A0A3Q0KR93_SCHMA Loading...

Putative serine/threonine-protein kinase STE20

AlphaFold DB , UniProt , Accession A0A3Q0KR93, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,236 aa.

						>A0A3Q0KR93_SCHMA|A0A3Q0KR93
MDQSTKLNQSCSLSSMQNKLFNGVQMKANRVLDCDYCHLPCITQKHNKSYIASLNSTKEPCSMRTSFYVPENRQTIMGSFCRQLTSSIIPPSDPILSYCKPTDLQLTPNNDYIASMPSMFRPLPFLLQSTSSSVIPVSSSSTLSSSSSPFHSPYNLPSSVYPSVPFSNHLRPSYCSFSSHSLKPIPSVKPYLSSNRAHLESSRIMLDSVNTKSFNQTTTSNALSTTITTATMNDAAIITDKTGDCAYHQSEQLNSTLLHHASGDSLSNQDSKFSFLHPPVFHSSSLKMSAIVENISDNNNSLTNSIADLFPTSSSNIPQTCLIPSSTSLTCRNISQLTQTSTVSSAQLPSNNLNDNLSNNYENGMLITNSNSNGSGNGSTSTSTTSCITNINDDLTIDKKLPNLNIENSSASNTSESSNADEKCTSLPRLNLRYTNVLHYPKYSSRKNSGFERRLKHTGLILDAKSTLRLLRKFLQPFVNRDFDQLIKKYMDDFILLAVNNIRDVLGEQSVSENDLTKFRQSLIHRAAVRYFPDLPQRDFINHQGTRSNPSPKTRDNKPEKQSSQRSDSIMRSKINSCSSFPSKLNSHIPTPDSLESSMSFNNSPHLSPIPSSDPTSFDKSFLSTNDITNPAVDKTFRTVYSPLHNPVTGDNESHYRLRNISNDSSLRNVRKRLHPSNRLKISPISYDKSKSDNSNHPLINTESFTIADCDINDLQEKCTSLPLSSHSPSSASSSSTVGFFRDPFSSDSEGTLINSSNIKLSEQTNNTQINRSSTYASHYSPNLSSTIKNNSNAPIHRLKSKSSRGRKTPWWDRTRGKKSKSKVTTNNNNIQCDKHNEGLSYEKNSLVEADYRQFINTLSDQSVTSSAIHASNNTSKDLPHNSNQNIHNNDSNTRKNTSSRLSRKKCTQIKNTMNNFTTKNSNVIKFTFDQNTHFALGSSANTWLGMGTARGRIYSKHPELFRYICDNEDKAWLVQTGLIISHGVKAYLVHAEQVHQIATRQINPYSSKADIEKLKTFKLPHWFLQKVKTVASRHSFFVHVISTELESTKNEIEKNIQDNSSSVDRPFASPFIQSSSSSSSSSMSRSNVSQFKLDNSTSLSNPMEINHYTSHNIITTIPSSRKILNSPVIFSSSSPSALSLASSSSVTSKYSLTASSSVQECHDMDNNQNSNNNNSNVLLNRNYTKSSWKSTNSYSKTMSIDYTDQNNNNNLVNKIQSLPSPNPPTLERFDYTTNR
					

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	36.9	Very low	30.8	Very low	222 Å²	222	137.6 Å²	137.6	100%	1.094	74%	0.741	S	S	*	*				0	74.8	0	-62	179.8	-178.4	0	0	113.1
2	D	36.5	Very low	30.6	Very low	136 Å²	136	134.6 Å²	134.6	73%	0.727	74%	0.738	S	S	*	*			cis	-147.9	164.3	-31.4	-102.5	-41.6	0	0	0	114.2
3	Q	29.7	Very low	30.4	Very low	167 Å²	167	133 Å²	133	78%	0.78	73%	0.728	S	S	*	*			trans	-42.4	126.4	-172.5	-67.2	174.3	18	0	0	113.2
4	S	32	Very low	30.3	Very low	95 Å²	95	127.8 Å²	127.8	66%	0.664	71%	0.706	S	S	*	*				86.5	134.7	58.5	-77.5	0	0	0	0	113.5
5	T	34.7	Very low	30.3	Very low	120 Å²	120	123.3 Å²	123.3	74%	0.736	69%	0.687	S	S	*	*			trans	68.7	152.1	148	56.9	0	0	0	0	118
6	K	32.3	Very low	30.4	Very low	170 Å²	170	123.4 Å²	123.4	74%	0.739	68%	0.682	S	S	*	*			cis	-163.2	153.6	-0.5	-119.3	162.8	179.1	178.8	0	110.1
7	L	29.3	Very low	30.5	Very low	130 Å²	130	124 Å²	124	68%	0.681	68%	0.679	S	S	*	*			trans	65.3	142.1	139	-70.4	162.8	0	0	0	122.9
8	N	27.1	Very low	30.6	Very low	108 Å²	108	123.6 Å²	123.6	58%	0.578	68%	0.676	S	S	*	*			trans	80.8	125	136.1	-74.5	8.6	0	0	0	119.1
9	Q	28.4	Very low	30.7	Very low	163 Å²	163	127.4 Å²	127.4	76%	0.762	69%	0.685	S	S	*	*				67.9	135	71.1	-66.7	175	-10.1	0	0	111.3
10	S	26.3	Very low	30.5	Very low	95 Å²	95	129.1 Å²	129.1	66%	0.664	69%	0.693	S	S	*	*			cis	-169.8	-169.4	-2.8	46.9	0	0	0	0	109.8
11	C	25.4	Very low	30.6	Very low	108 Å²	108	131.7 Å²	131.7	73%	0.73	70%	0.698	S	S	*	*			trans	75.8	129.5	168.8	-49.4	0	0	0	0	115
12	S	29	Very low	30.5	Very low	101 Å²	101	127.9 Å²	127.9	71%	0.706	68%	0.683	S	S	*	*			cis	92.6	125.9	25.4	80.5	0	0	0	0	115.6
13	L	28	Very low	30.3	Very low	114 Å²	114	125 Å²	125	60%	0.597	68%	0.684	S	S	*	*			trans	175.8	141	131.2	-118.1	62.3	0	0	0	115.1
14	S	29.1	Very low	30.3	Very low	60 Å²	60	123.5 Å²	123.5	42%	0.42	69%	0.687	S	S	.	*			trans	71.6	156.1	146.7	-121.4	0	0	0	0	122.1	E763 Q764	S14-E763 VanDerWaalsContact OG-CA 3.28Å; S14-E763 WeakPolarHBondContact OG-CA 3.4Å; S14-E763 VanDerWaalsContact OG-CG 3.27Å; S14-E763 WeakPolarHBondContact OG-CG 3.46Å; S14-Q764 WeakPolarHBondContact OG-CA 3.33Å; S14-Q764 WeakPolarHBondContact OG-CB 3.46Å
15	S	30.4	Very low	30.3	Very low	61 Å²	61	126.6 Å²	126.6	43%	0.427	69%	0.691	S	S	.	*			cis	-163.1	166.6	17.4	-144.4	0	0	0	0	117.4	E763 Q764	S15-E763 WeakPolarHBondContact OG-CG 3.37Å; S15-Q764 PolarHBondContact OG-OE1 3.43Å
16	M	32	Very low	30	Very low	124 Å²	124	128.9 Å²	128.9	61%	0.611	70%	0.695	S	S	*	*			trans	73.3	101.6	148.3	-66.6	-131.3	-150.2	0	0	122.6	E763	M16-E763 WeakPolarHBondContact CA-OE1 3.31Å; M16-E763 PolarHBondContact N-OE1 2.76Å
17	Q	30.9	Very low	30	Very low	134 Å²	134	130.2 Å²	130.2	63%	0.626	70%	0.701	S	S	*	*				26.3	127.5	121	-49.9	175	24.1	0	0	121.2	E763	Q17-E763 PolarHBondContact NE2-OE2 3.32Å
18	N	32.3	Very low	30.1	Very low	117 Å²	117	128.3 Å²	128.3	63%	0.626	70%	0.704	S	S	*	*				-178.3	145.5	97.7	-105.5	-85.1	0	0	0	116.4
19	K	33	Very low	30.4	Very low	195 Å²	195	129.8 Å²	129.8	85%	0.848	71%	0.712	S	S	*	*			trans	53.3	114	149.6	-70.9	164.7	-173.5	176.1	0	121.4
20	L	27.1	Very low	30.5	Very low	161 Å²	161	131.8 Å²	131.8	84%	0.843	71%	0.712	S	S	*	*			trans	-126.1	136.2	159.5	-150.3	-179.2	0	0	0	106.8
21	F	32.4	Very low	30.6	Very low	184 Å²	184	134.3 Å²	134.3	81%	0.807	72%	0.723	S	S	*	*			trans	-153.5	144.4	175.9	-130.8	-98.3	0	0	0	113.1
22	N	34.3	Very low	30.9	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	72%	0.722	S	S	*	*			trans	59.8	96.9	166.9	-71.5	-6.5	0	0	0	122.4
23	G	31.9	Very low	30.8	Very low	74 Å²	74	137.9 Å²	137.9	76%	0.763	73%	0.726	S	S	*	*				86.9	170.3	115.7	0	0	0	0	0	120.2
24	V	30.9	Very low	31.1	Very low	137 Å²	137	138.5 Å²	138.5	83%	0.83	74%	0.739	S	S	*	*			cis	-159.9	152	-12.8	109.2	0	0	0	0	111.4
25	Q	32.8	Very low	31.1	Very low	160 Å²	160	142.2 Å²	142.2	75%	0.748	75%	0.754	S	S	*	*			trans	53.8	119.4	165.1	-76.4	-171.1	16.3	0	0	122.7
26	M	28.4	Very low	31	Very low	168 Å²	168	147.9 Å²	147.9	83%	0.828	77%	0.768	S	S	*	*				31.2	123.1	107.6	-64	-76.1	-167	0	0	119.5
27	K	31.7	Very low	31.1	Very low	197 Å²	197	148.2 Å²	148.2	86%	0.857	78%	0.78	S	S	*	*				-166.7	142.1	103.1	-109.4	167.4	-177.9	169	0	113
28	A	30.4	Very low	31.1	Very low	90 Å²	90	149.9 Å²	149.9	74%	0.744	79%	0.788	S	S	*	*			trans	-86.5	154.2	166	0	0	0	0	0	110.5
29	N	32.9	Very low	31	Very low	140 Å²	140	152.3 Å²	152.3	75%	0.749	80%	0.8	S	S	*	*			trans	-157.4	119.7	149.4	-110.7	-27.3	0	0	0	113.1
30	R	30.9	Very low	30.9	Very low	204 Å²	204	147.7 Å²	147.7	77%	0.77	79%	0.79	S	S	*	*			trans	33	110.5	133.3	-58.4	176.7	-176.4	-157.8	-1.9	117.6
31	V	28.6	Very low	31	Very low	148 Å²	148	146.2 Å²	146.2	90%	0.897	79%	0.792	S	S	*	*			trans	-69.5	130.5	141.8	178	0	0	0	0	107.4
32	L	32.2	Very low	30.9	Very low	135 Å²	135	144 Å²	144	71%	0.707	79%	0.787	S	S	*	*			trans	-137.9	141.2	168.6	-93.6	167.5	0	0	0	107.6
33	D	27.8	Very low	30.6	Very low	149 Å²	149	143 Å²	143	80%	0.797	79%	0.786	S	S	*	*			trans	-68	142.9	174.7	-62.2	-76.7	0	0	0	111.6
34	C	32.4	Very low	30.6	Very low	128 Å²	128	148.2 Å²	148.2	87%	0.865	79%	0.791	S	S	*	*			trans	-167.4	99.3	137.3	-98.3	0	0	0	0	110.7
35	D	29.6	Very low	30.5	Very low	138 Å²	138	151 Å²	151	74%	0.738	79%	0.792	S	S	*	*				11.5	156.3	127.7	-125.5	-24.2	0	0	0	122.1
36	Y	29.4	Very low	30.6	Very low	180 Å²	180	151.4 Å²	151.4	71%	0.706	79%	0.793	S	S	*	*			trans	50.4	110.3	168.9	-74.4	-96.3	0	0	0	120.2
37	C	33.5	Very low	30.9	Very low	130 Å²	130	150.2 Å²	150.2	88%	0.878	79%	0.79	S	S	*	*				-164.2	140.8	108.7	-99.6	0	0	0	0	113.2
38	H	30.7	Very low	30.8	Very low	170 Å²	170	150.3 Å²	150.3	79%	0.787	79%	0.791	S	S	*	*			trans	-87.9	141.4	166	-78.1	-106.3	0	0	0	110.1
39	L	30.6	Very low	31	Very low	167 Å²	167	151 Å²	151	87%	0.874	79%	0.79	S	S	*	*				-177.3	162	111.7	-114.9	83.5	0	0	0	111.4
40	P	30.6	Very low	30.8	Very low	99 Å²	99	154.8 Å²	154.8	64%	0.643	80%	0.795	S	S	*	*			trans	-116.2	148.9	-172.8	39.6	-29.6	0	0	0	116
41	C	30.2	Very low	31	Very low	130 Å²	130	152.8 Å²	152.8	88%	0.878	80%	0.798	S	S	*	*			trans	-146.5	127.2	155.9	-84	0	0	0	0	107.6
42	I	29.8	Very low	31.2	Very low	138 Å²	138	149.5 Å²	149.5	71%	0.708	79%	0.787	S	S	*	*			cis	86.2	82.9	36.9	-55.6	178.8	0	0	0	113.7
43	T	27.3	Very low	31	Very low	121 Å²	121	148.2 Å²	148.2	74%	0.742	79%	0.789	S	S	*	*			trans	50.4	138.2	143.6	65.7	0	0	0	0	122
44	Q	32	Very low	31.3	Very low	184 Å²	184	149.3 Å²	149.3	86%	0.86	79%	0.794	S	S	*	*				-159.2	156.6	110.3	-108.7	170.4	39.1	0	0	113.2
45	K	29.4	Very low	31.2	Very low	195 Å²	195	150 Å²	150	85%	0.848	79%	0.789	S	S	*	*			trans	-120.9	125	171.4	-70.2	176.3	179.5	173	0	108.9
46	H	35.4	Very low	31.2	Very low	168 Å²	168	148.4 Å²	148.4	78%	0.778	79%	0.788	S	S	*	*			trans	-165.3	148.7	159.1	-89.6	-75.6	0	0	0	106
47	N	34	Very low	31.3	Very low	143 Å²	143	145.1 Å²	145.1	77%	0.765	79%	0.787	S	S	*	*			cis	-140.6	175.8	10.2	-104.4	-30.6	0	0	0	112.2
48	K	29.3	Very low	31.1	Very low	200 Å²	200	146.8 Å²	146.8	87%	0.87	78%	0.78	S	S	*	*			trans	-121	143.1	167.8	-83.2	-175	173.9	-176.4	0	111.2
49	S	33.8	Very low	31	Very low	104 Å²	104	146.1 Å²	146.1	73%	0.727	78%	0.777	S	S	*	*			trans	-153.6	120.7	153.2	44.2	0	0	0	0	107.4
50	Y	29.8	Very low	31	Very low	220 Å²	220	144.3 Å²	144.3	86%	0.863	78%	0.775	S	S	*	*				57.9	128.5	92	-70.4	-72.3	0	0	0	111.7
51	I	33.9	Very low	31	Very low	162 Å²	162	145.9 Å²	145.9	83%	0.831	79%	0.787	S	S	*	*			cis	-142	172	43.8	-76.4	177.3	0	0	0	113.1
52	A	33.1	Very low	30.9	Very low	79 Å²	79	145 Å²	145	65%	0.653	78%	0.783	S	S	*	*			trans	-16.5	137.8	170.2	0	0	0	0	0	118.8
53	S	28.7	Very low	30.9	Very low	108 Å²	108	147.2 Å²	147.2	76%	0.755	79%	0.792	S	S	*	*			cis	89.4	112.9	33	81.7	0	0	0	0	116.2
54	L	34.1	Very low	30.9	Very low	171 Å²	171	152.5 Å²	152.5	90%	0.895	80%	0.798	S	S	*	*			trans	-159.3	141.4	147.8	-109	164.4	0	0	0	112.2
55	N	31	Very low	31	Very low	144 Å²	144	150 Å²	150	77%	0.77	80%	0.796	S	S	*	*			trans	-62	146	-169.3	-65.2	-54	0	0	0	115
56	S	28.5	Very low	30.8	Very low	104 Å²	104	144.2 Å²	144.2	73%	0.727	78%	0.78	S	S	*	*				64.1	131.2	86.8	-141.6	0	0	0	0	113.4
57	T	31	Very low	30.6	Very low	111 Å²	111	145.1 Å²	145.1	68%	0.681	78%	0.782	S	S	*	*			cis	-160.4	146.1	44.3	40.7	0	0	0	0	115.3
58	K	29.1	Very low	30.3	Very low	165 Å²	165	148.3 Å²	148.3	72%	0.717	79%	0.785	S	S	*	*			trans	51	148.9	132.8	-51.6	174.4	96.9	-127.8	0	124.3
59	E	30.3	Very low	30.5	Very low	155 Å²	155	144 Å²	144	72%	0.724	78%	0.775	S	S	*	*			trans	95.2	125	150.2	-45.5	-145.3	171.7	0	0	119.4
60	P	30.6	Very low	30.4	Very low	130 Å²	130	145.2 Å²	145.2	84%	0.844	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-97.7	126.6	172.4	35.6	-28.8	0	0	0	111.8
61	C	30.4	Very low	30.4	Very low	131 Å²	131	142.9 Å²	142.9	89%	0.885	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-93.2	137	171.9	-72.3	0	0	0	0	111.8
62	S	26.5	Very low	30.2	Very low	113 Å²	113	142 Å²	142	79%	0.79	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-89	141.1	167.5	-177.1	0	0	0	0	109.9
63	M	31.6	Very low	30	Very low	183 Å²	183	148.2 Å²	148.2	90%	0.901	78%	0.781	S	S	*	*			trans	-125.1	140	170.1	-85.8	-73.6	-79.7	0	0	109
64	R	27	Very low	30	Very low	232 Å²	232	151.6 Å²	151.6	88%	0.875	78%	0.784	S	S	*	*			trans	-142.6	107.3	-159.4	177	-160.4	-178	-162.1	2.8	111.6
65	T	33.5	Very low	29.8	Very low	132 Å²	132	148.9 Å²	148.9	81%	0.81	78%	0.775	S	S	*	*			trans	-156.8	145.5	168.9	44.7	0	0	0	0	109.5
66	S	26.3	Very low	29.8	Very low	73 Å²	73	149 Å²	149	51%	0.51	77%	0.774	S	S	.	*			cis	163.1	149.4	-33.7	42.8	0	0	0	0	107.5
67	F	29.4	Very low	29.6	Very low	188 Å²	188	152.9 Å²	152.9	83%	0.825	78%	0.783	S	S	*	*			trans	71.3	148.7	176.1	-40.2	-62.5	0	0	0	114.3
68	Y	28.3	Very low	29.5	Very low	210 Å²	210	150.4 Å²	150.4	82%	0.824	78%	0.78	S	S	*	*			cis	-147.4	167.6	-9.2	-150.2	-99.9	0	0	0	109.1
69	V	32.8	Very low	29.5	Very low	110 Å²	110	147.8 Å²	147.8	67%	0.667	78%	0.782	S	S	*	*			trans	-129.7	144.4	178.5	175.4	0	0	0	0	110.2	E71	V69-E71 HydrophobicContact CG1-CG 4.42Å
70	P	32.7	Very low	29.5	Very low	128 Å²	128	148.6 Å²	148.6	83%	0.831	78%	0.784	S	S	*	*			trans	-127.4	142.6	141.9	35.3	-25.1	0	0	0	112.5
71	E	29.7	Very low	29.4	Very low	172 Å²	172	147.7 Å²	147.7	80%	0.804	78%	0.779	S	S	*	*			trans	-93.5	149.9	174.4	-63.8	179.1	103	0	0	112.1	V69	V69-E71 HydrophobicContact CG1-CG 4.42Å
72	N	30.5	Very low	29.4	Very low	144 Å²	144	150 Å²	150	77%	0.77	77%	0.77	S	S	*	*			trans	139.8	148.9	149.4	-80.9	-51.8	0	0	0	111.1
73	R	28.2	Very low	29.6	Very low	209 Å²	209	151.2 Å²	151.2	79%	0.789	76%	0.762	S	S	*	*			cis	-176.3	152.7	-31.2	-121.2	-172.7	-174.5	-160.3	0.6	104.4
74	Q	28.7	Very low	29.7	Very low	178 Å²	178	149.8 Å²	149.8	83%	0.832	76%	0.758	S	S	*	*			trans	66.3	159	-178.2	-57.4	150.7	-14.6	0	0	112
75	T	29.3	Very low	29.7	Very low	115 Å²	115	144 Å²	144	71%	0.706	75%	0.749	S	S	*	*			cis	-148.7	160.2	15.1	-24.2	0	0	0	0	110.4
76	I	31.5	Very low	29.4	Very low	146 Å²	146	142.4 Å²	142.4	75%	0.749	74%	0.743	S	S	*	*			trans	57	108.1	159	-61.8	151.7	0	0	0	115.6
77	M	24.7	Very low	29.4	Very low	185 Å²	185	144.1 Å²	144.1	91%	0.911	75%	0.754	S	S	*	*			cis	63.9	83.9	34.2	-165.2	80.4	97.1	0	0	115.8
78	G	27.6	Very low	29.4	Very low	59 Å²	59	142.2 Å²	142.2	61%	0.608	75%	0.751	S	S	*	*			trans	112.4	152.9	139.8	0	0	0	0	0	118.5
79	S	29.1	Very low	29.6	Very low	111 Å²	111	139.1 Å²	139.1	78%	0.776	75%	0.748	S	S	*	*			trans	68.8	157.5	174.8	83.5	0	0	0	0	115.8
80	F	30.2	Very low	29.4	Very low	172 Å²	172	139.7 Å²	139.7	75%	0.754	75%	0.753	S	S	*	*			cis	-124.6	148	8.3	-128.3	-84.6	0	0	0	113
81	C	30.3	Very low	29.4	Very low	111 Å²	111	138.8 Å²	138.8	75%	0.75	75%	0.747	S	S	*	*			trans	-73.5	171.9	165.8	-55.3	0	0	0	0	110.9
82	R	30.4	Very low	29.4	Very low	180 Å²	180	135.7 Å²	135.7	68%	0.679	75%	0.745	S	S	*	*				-179.2	134.1	116.3	-98	170.2	-176.4	-98.5	6.1	112
83	Q	29.4	Very low	29.5	Very low	137 Å²	137	135.6 Å²	135.6	64%	0.64	74%	0.744	S	S	*	*			trans	51.5	129.4	134.9	-67	153.3	-22	0	0	117.7
84	L	34.4	Very low	29.7	Very low	154 Å²	154	130.6 Å²	130.6	81%	0.806	74%	0.739	S	S	*	*			cis	-128.7	145.2	34.5	-61.7	161.9	0	0	0	109.6
85	T	26.7	Very low	29.9	Very low	111 Å²	111	130.3 Å²	130.3	68%	0.681	74%	0.741	S	S	*	*				48	128.7	65.3	61.6	0	0	0	0	113.4
86	S	27.9	Very low	29.9	Very low	98 Å²	98	131 Å²	131	69%	0.685	74%	0.74	S	S	*	*			cis	-174.3	152.8	7.1	44.2	0	0	0	0	112.3
87	S	26.4	Very low	29.9	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	74%	0.735	S	S	*	*			trans	69.1	171.5	151.1	-55.9	0	0	0	0	119.7
88	I	29.1	Very low	30.3	Very low	149 Å²	149	130.1 Å²	130.1	76%	0.764	73%	0.733	S	S	*	*			trans	71.7	96.1	170.3	-53.3	168.5	0	0	0	112.7
89	I	31.3	Very low	30.4	Very low	145 Å²	145	132.8 Å²	132.8	74%	0.744	74%	0.741	S	S	*	*				60.8	116.9	75.6	-58	173.5	0	0	0	112	P91	I89-P91 WeakPolarHBondContact O-CD 3.34Å
90	P	29	Very low	30.7	Very low	121 Å²	121	136.4 Å²	136.4	79%	0.786	74%	0.743	S	S	*	*			trans	-80.8	128.7	-177.5	31.9	-33.4	0	0	0	112.5
91	P	32.4	Very low	30.8	Very low	109 Å²	109	133.7 Å²	133.7	71%	0.708	74%	0.742	S	S	*	*			trans	-78.1	168.6	154.6	34.9	-32.4	0	0	0	110.5	I89	I89-P91 WeakPolarHBondContact O-CD 3.34Å
92	S	29.5	Very low	30.9	Very low	107 Å²	107	133.7 Å²	133.7	75%	0.748	74%	0.739	S	S	*	*			trans	-123.7	115.3	-176	55.3	0	0	0	0	111.5	P94	S92-P94 WeakPolarHBondContact O-CD 3.41Å
93	D	33.1	Very low	31	Very low	142 Å²	142	133 Å²	133	76%	0.759	75%	0.749	S	S	*	*			trans	-75.3	122.5	-178.7	-62	-35.3	0	0	0	112.6
94	P	33.3	Very low	31	Very low	104 Å²	104	133.5 Å²	133.5	68%	0.675	76%	0.755	S	S	*	*			trans	-99.1	121.4	172.1	34.6	-26	0	0	0	111.3	S92 L96	S92-P94 WeakPolarHBondContact O-CD 3.41Å; P94-L96 PolarHBondContact O-N 2.66Å
95	I	32.1	Very low	30.9	Very low	172 Å²	172	134.6 Å²	134.6	88%	0.882	76%	0.756	S	S	*	*			trans	-87	102.7	173	-58.8	178	0	0	0	109.4
96	L	30.3	Very low	31	Very low	131 Å²	131	136 Å²	136	69%	0.686	76%	0.759	S	S	*	*			trans	-129.8	129.2	164.6	-149	83.3	0	0	0	111.5	P94 T1233	P94-L96 PolarHBondContact O-N 2.66Å; L96-T1233 HydrophobicContact CD2-CG2 4.41Å
97	S	31.4	Very low	31.3	Very low	91 Å²	91	138 Å²	138	64%	0.636	77%	0.767	S	S	*	*			trans	2.7	110.9	166.1	55.3	0	0	0	0	119.4	C99	S97-C99 PolarHBondContact O-N 2.81Å
98	Y	31.6	Very low	31.7	Very low	221 Å²	221	137.9 Å²	137.9	87%	0.867	76%	0.763	S	S	*	*			trans	-74.5	113.2	147.1	-108.5	-81.1	0	0	0	109.4
99	C	30.7	Very low	31.9	Very low	115 Å²	115	137.8 Å²	137.8	78%	0.777	77%	0.765	S	S	*	*			trans	-92.6	132.7	156.2	-73.7	0	0	0	0	108.6	S97	S97-C99 PolarHBondContact O-N 2.81Å
100	K	35.7	Very low	32.1	Very low	187 Å²	187	136.9 Å²	136.9	81%	0.813	76%	0.761	S	S	*	*			trans	-105.4	145.8	164.8	-82.9	-169.7	173.3	-174.1	0	109.6
101	P	32.7	Very low	32.5	Very low	114 Å²	114	136.3 Å²	136.3	74%	0.74	75%	0.751	S	S	*	*			trans	-80.2	152.1	-172.2	32.8	-36.3	0	0	0	113.1
102	T	30.9	Very low	32.5	Very low	111 Å²	111	140.5 Å²	140.5	68%	0.681	75%	0.754	S	S	*	*			trans	48.2	118	143.8	-44.5	0	0	0	0	119.5	L104	T102-L104 HydrophobicContact CG2-CD1 4.44Å
103	D	32.5	Very low	32.6	Very low	167 Å²	167	142.3 Å²	142.3	89%	0.893	75%	0.754	S	S	*	*				-140.6	146.5	121.2	-113.6	-34.1	0	0	0	110.2
104	L	29.3	Very low	32.7	Very low	146 Å²	146	139.7 Å²	139.7	76%	0.764	75%	0.752	S	S	*	*			trans	-98.9	145.8	-178.6	-77.1	138.7	0	0	0	110.4	T102	T102-L104 HydrophobicContact CG2-CD1 4.44Å
105	Q	32.4	Very low	32.7	Very low	178 Å²	178	140.1 Å²	140.1	83%	0.832	76%	0.758	S	S	*	*			trans	-165.3	136.8	139	-99.4	-60.4	-11.3	0	0	110.4
106	L	29.6	Very low	32.8	Very low	140 Å²	140	140 Å²	140	73%	0.733	76%	0.756	S	S	*	*			trans	-76.5	148.7	-169.9	-61.1	134.3	0	0	0	113.3
107	T	33.5	Very low	33.1	Very low	139 Å²	139	139.9 Å²	139.9	85%	0.853	76%	0.763	S	S	*	*				172.4	159.3	107.5	32.9	0	0	0	0	112.7
108	P	34.5	Very low	33.3	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	77%	0.768	S	S	*	*			trans	-110.7	-179.4	-166.4	42.4	-35.1	0	0	0	115.6
109	N	34.8	Very low	33.4	Very low	148 Å²	148	137.8 Å²	137.8	79%	0.791	76%	0.764	S	S	*	*			trans	132.1	138.6	161.4	-71.8	-9.8	0	0	0	111.4
110	N	35.5	Very low	33.6	Very low	126 Å²	126	141.9 Å²	141.9	67%	0.674	77%	0.769	S	S	*	*			cis	-162.3	171.4	-21.9	-143.9	31.4	0	0	0	110.4
111	D	36	Very low	33.5	Very low	108 Å²	108	143.5 Å²	143.5	58%	0.578	77%	0.771	S	S	*	*			trans	80	126	144.3	-70.5	-31.8	0	0	0	125.8
112	Y	34.3	Very low	33.7	Very low	197 Å²	197	143.8 Å²	143.8	77%	0.773	77%	0.772	S	S	*	*			trans	57.1	146	159.1	-55.9	-72.5	0	0	0	124
113	I	31.6	Very low	33.9	Very low	145 Å²	145	145.1 Å²	145.1	74%	0.744	77%	0.774	S	S	*	*			cis	-167.7	160.4	-46.1	-121	175.3	0	0	0	111.4
114	A	34.3	Very low	34.1	Very low	87 Å²	87	142.7 Å²	142.7	72%	0.719	77%	0.768	S	S	*	*			trans	66.7	145.6	165.9	0	0	0	0	0	119.1
115	S	33.5	Very low	34.4	Very low	114 Å²	114	144.8 Å²	144.8	80%	0.797	77%	0.771	S	S	*	*			cis	-160.6	143.9	-12	46.7	0	0	0	0	111.3
116	M	33.7	Very low	34.3	Very low	169 Å²	169	144.4 Å²	144.4	83%	0.833	77%	0.774	S	S	*	*			trans	-92.2	176.8	174.7	-70.6	-79.3	-179.6	0	0	111.6
117	P	37.5	Very low	34.6	Very low	129 Å²	129	145.6 Å²	145.6	84%	0.838	78%	0.78	S	S	*	*				-141.2	147.4	86.2	36.9	-21.9	0	0	0	115.5
118	S	34.6	Very low	34.4	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	78%	0.778	S	S	*	*			trans	-128.9	126.3	165.4	59	0	0	0	0	109.4
119	M	33.7	Very low	34.3	Very low	162 Å²	162	147.3 Å²	147.3	80%	0.798	78%	0.782	S	S	*	*			trans	-91.3	162.2	-179.1	-68.1	-158.2	-69	0	0	113.5
120	F	35.1	Very low	34.2	Very low	201 Å²	201	145.7 Å²	145.7	88%	0.882	78%	0.777	S	S	*	*			trans	76.9	109.2	176.1	-62.2	-76.9	0	0	0	117.6
121	R	34.2	Very low	34.1	Very low	222 Å²	222	145.4 Å²	145.4	84%	0.838	79%	0.785	S	S	*	*			trans	-137.3	130.6	175.5	173.5	-168.4	-168.8	-171.9	7.7	107.4
122	P	36.7	Very low	34	Very low	120 Å²	120	144.8 Å²	144.8	78%	0.779	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-93.1	160	159.2	-12.5	31	0	0	0	112
123	L	35.2	Very low	33.9	Very low	138 Å²	138	140.3 Å²	140.3	72%	0.723	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-93	151.5	-177.4	-60.1	93.3	0	0	0	112.4
124	P	36	Very low	34.1	Very low	117 Å²	117	139.1 Å²	139.1	76%	0.76	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-80.3	126.2	156.5	32.9	-29.2	0	0	0	109.8
125	F	35.3	Very low	34.1	Very low	190 Å²	190	142.2 Å²	142.2	83%	0.833	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-89.5	125	166.5	-94.1	-90.3	0	0	0	109.8
126	L	30.9	Very low	34.4	Very low	170 Å²	170	142.3 Å²	142.3	89%	0.89	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-88.4	141	163.1	-79.8	166.5	0	0	0	109.1
127	L	35.3	Very low	34.4	Very low	164 Å²	164	140.2 Å²	140.2	86%	0.859	78%	0.783	S	S	*	*			trans	-134.1	141.2	164.7	-105.3	166.6	0	0	0	109.2
128	Q	29.7	Very low	34.1	Very low	171 Å²	171	138.9 Å²	138.9	80%	0.799	78%	0.777	S	S	*	*			trans	-88.2	147.3	-171.1	-61.3	155.2	-82.4	0	0	111.7
129	S	33.5	Very low	34	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	78%	0.775	S	S	*	*			trans	-177.4	90.4	143.5	-77.7	0	0	0	0	107.8
130	T	32.6	Very low	33.9	Very low	113 Å²	113	135.8 Å²	135.8	69%	0.693	77%	0.771	S	S	*	*				70.8	131.7	85.6	58.7	0	0	0	0	115.6
131	S	32.7	Very low	33.6	Very low	120 Å²	120	131 Å²	131	84%	0.839	76%	0.763	S	S	*	*			trans	63.6	147.9	162.2	50.3	0	0	0	0	119.1
132	S	32.9	Very low	33.4	Very low	95 Å²	95	126 Å²	126	66%	0.664	76%	0.757	S	S	*	*			cis	-169.3	141	-17.9	174.1	0	0	0	0	110.9
133	S	33.2	Very low	32.9	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	76%	0.756	S	S	*	*			trans	62	167.9	153.9	62.8	0	0	0	0	117.3
134	V	35.7	Very low	32.5	Very low	120 Å²	120	125.4 Å²	125.4	73%	0.727	76%	0.755	S	S	*	*			cis	-133.9	118.9	9.6	173.4	0	0	0	0	111.1
135	I	34.4	Very low	32	Very low	152 Å²	152	124.4 Å²	124.4	78%	0.779	75%	0.751	S	S	*	*			trans	44.2	133.4	134.5	-55.3	175.3	0	0	0	121.4
136	P	39.8	Very low	31.6	Very low	115 Å²	115	120.3 Å²	120.3	75%	0.747	75%	0.746	S	S	*	*			trans	-102.4	179.6	171.1	42.3	-36.3	0	0	0	114.1
137	V	34.4	Very low	31.4	Very low	126 Å²	126	117 Å²	117	76%	0.764	74%	0.736	S	S	*	*			trans	-162.9	121.4	154.7	126.5	0	0	0	0	107.1
138	S	29.4	Very low	31.4	Very low	101 Å²	101	114.2 Å²	114.2	71%	0.706	73%	0.731	S	S	*	*				60.5	144.9	95.8	-39.8	0	0	0	0	114.2
139	S	33.7	Very low	31.6	Very low	99 Å²	99	110.9 Å²	110.9	69%	0.692	72%	0.724	S	S	*	*			cis	-159.6	160.9	21.5	-29.3	0	0	0	0	112.6
140	S	31	Very low	31.3	Very low	102 Å²	102	114.1 Å²	114.1	71%	0.713	73%	0.725	S	S	*	*			trans	51.5	129.5	137	-40.2	0	0	0	0	121.2
141	S	29.5	Very low	31.2	Very low	101 Å²	101	116.6 Å²	116.6	71%	0.706	73%	0.728	S	S	*	*				70.9	139.6	102.6	81.7	0	0	0	0	116.2
142	T	28.5	Very low	31.3	Very low	117 Å²	117	115.7 Å²	115.7	72%	0.718	72%	0.722	S	S	*	*			cis	-169.5	167.4	6.1	3.3	0	0	0	0	110.5
143	L	27.3	Very low	31.6	Very low	146 Å²	146	115.4 Å²	115.4	76%	0.764	72%	0.718	S	S	*	*			trans	49.1	112.4	144.4	-68.4	163.6	0	0	0	121.3
144	S	26.1	Very low	31.5	Very low	100 Å²	100	120.1 Å²	120.1	70%	0.699	72%	0.721	S	S	*	*				85.3	159.2	118.2	77.7	0	0	0	0	122.7
145	S	26.6	Very low	31.3	Very low	96 Å²	96	121.3 Å²	121.3	67%	0.671	72%	0.723	S	S	*	*			trans	66.1	100.5	153.3	57.9	0	0	0	0	121.4
146	S	25.9	Very low	31.4	Very low	104 Å²	104	120.4 Å²	120.4	73%	0.727	72%	0.719	S	S	*	*				75	152.4	121.7	62.2	0	0	0	0	122.6
147	S	27.2	Very low	31.1	Very low	99 Å²	99	120.6 Å²	120.6	69%	0.692	72%	0.72	S	S	*	*			trans	60	100.3	156.5	47.4	0	0	0	0	118.7
148	S	34.4	Very low	31	Very low	106 Å²	106	119 Å²	119	74%	0.741	72%	0.715	S	S	*	*				-3.5	145	118.3	58.2	0	0	0	0	115.9
149	P	35.5	Very low	31.1	Very low	102 Å²	102	119.7 Å²	119.7	66%	0.662	72%	0.72	S	S	*	*				-161.2	-179.8	64.2	44.6	-24.2	0	0	0	120.2
150	F	26.8	Very low	31	Very low	178 Å²	178	121.1 Å²	121.1	78%	0.781	72%	0.724	S	S	*	*			trans	79.6	151.3	141.5	-87.8	-58	0	0	0	123.1
151	H	29.1	Very low	31.1	Very low	165 Å²	165	125.6 Å²	125.6	76%	0.764	73%	0.726	S	S	*	*			trans	67.3	101.9	159.3	-68.9	-58.3	0	0	0	121.7
152	S	36.2	Very low	31.4	Very low	102 Å²	102	126.5 Å²	126.5	71%	0.713	73%	0.73	S	S	*	*			trans	-64.7	175.6	133.8	59.1	0	0	0	0	110.8
153	P	38	Very low	31.6	Very low	88 Å²	88	125.2 Å²	125.2	57%	0.571	73%	0.726	S	S	*	*				-160.7	175.9	99.3	44.7	-26.9	0	0	0	118.6
154	Y	31.1	Very low	31.9	Very low	203 Å²	203	124.4 Å²	124.4	80%	0.796	73%	0.727	S	S	*	*			trans	67.2	149.6	149.5	-58.7	-36.7	0	0	0	120.6
155	N	31.6	Very low	32.3	Very low	145 Å²	145	125.6 Å²	125.6	78%	0.775	73%	0.732	S	S	*	*			cis	-151.4	170	-5.5	-124.9	-23	0	0	0	115.2
156	L	36.4	Very low	32.4	Very low	134 Å²	134	130 Å²	130	70%	0.702	74%	0.739	S	S	*	*			trans	-88.2	171.8	174.3	-134.8	76.9	0	0	0	112.3
157	P	35.2	Very low	32.6	Very low	118 Å²	118	129.9 Å²	129.9	77%	0.766	74%	0.739	S	S	*	*				-133.9	149.5	75.2	10.5	15	0	0	0	114.7
158	S	31.1	Very low	32.6	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	74%	0.741	S	S	*	*				72.6	137.2	70.9	-51	0	0	0	0	114.1
159	S	31.3	Very low	32.4	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	74%	0.741	S	S	*	*			cis	-164	-166.4	-4.1	52.1	0	0	0	0	108
160	V	32.2	Very low	32.1	Very low	129 Å²	129	135.9 Å²	135.9	78%	0.782	74%	0.743	S	S	*	*			cis	-149.4	-130.5	11.4	63.6	0	0	0	0	111.9
161	Y	33.2	Very low	32.1	Very low	196 Å²	196	137.9 Å²	137.9	77%	0.769	75%	0.745	S	S	*	*			trans	-157	174.3	-165.4	-106.6	-83.3	0	0	0	110.4
162	P	36.2	Very low	32.3	Very low	121 Å²	121	136.2 Å²	136.2	79%	0.786	75%	0.749	S	S	*	*				-137.2	-145.9	56.4	39	-16.8	0	0	0	115.1
163	S	32.8	Very low	31.9	Very low	89 Å²	89	136 Å²	136	62%	0.622	75%	0.748	S	S	*	*			trans	-165.5	-175.7	-166.8	-75.1	0	0	0	0	113.8
164	V	32.7	Very low	31.2	Very low	130 Å²	130	142.5 Å²	142.5	79%	0.788	76%	0.762	S	S	*	*			trans	67.6	162.7	169.7	-87	0	0	0	0	118
165	P	34.5	Very low	31	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	76%	0.761	S	S	*	*			cis	-130.6	-168.6	13.2	43.8	-25.9	0	0	0	118.2
166	F	30	Very low	30.6	Very low	188 Å²	188	135.3 Å²	135.3	83%	0.825	75%	0.752	S	S	*	*			trans	-78	158.5	-173.8	-66.6	-117.9	0	0	0	115.4
167	S	28.9	Very low	30.3	Very low	102 Å²	102	138.6 Å²	138.6	71%	0.713	76%	0.761	S	S	*	*				164.4	140.3	108.8	-73.4	0	0	0	0	117.5
168	N	27.8	Very low	30	Very low	138 Å²	138	137.5 Å²	137.5	74%	0.738	76%	0.756	S	S	*	*			trans	64.7	121.3	135.6	-67.7	-9.1	0	0	0	125.6
169	H	29.7	Very low	30	Very low	160 Å²	160	136.9 Å²	136.9	74%	0.741	75%	0.752	S	S	*	*				85.8	136.2	124.9	-87.1	-60.9	0	0	0	125.2
170	L	29.2	Very low	30.3	Very low	136 Å²	136	139.9 Å²	139.9	71%	0.712	75%	0.753	S	S	*	*			trans	86.2	109.8	138.9	-73.2	164.6	0	0	0	123
171	R	27.6	Very low	30.5	Very low	219 Å²	219	138.5 Å²	138.5	83%	0.826	75%	0.749	S	S	*	*			trans	65	136.7	136.1	-78	-177.5	174	-177.3	-1.9	121.6
172	P	33.7	Very low	30.5	Very low	130 Å²	130	136 Å²	136	84%	0.844	75%	0.748	S	S	*	*			trans	-93.5	133.1	158.2	35.4	-28.9	0	0	0	111.9
173	S	26.3	Very low	30.5	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	75%	0.752	S	S	*	*			trans	-164.9	117.1	165.4	55.2	0	0	0	0	114.3
174	Y	24.9	Very low	30.7	Very low	223 Å²	223	140 Å²	140	88%	0.875	75%	0.752	S	S	*	*			trans	54.8	150.6	139.3	-82.6	-90.1	0	0	0	123.3
175	C	25.1	Very low	30.9	Very low	114 Å²	114	141 Å²	141	77%	0.77	75%	0.751	S	S	*	*			trans	71.9	151.6	162.3	-68	0	0	0	0	117.4
176	S	24.7	Very low	31	Very low	84 Å²	84	140.9 Å²	140.9	59%	0.587	75%	0.75	S	S	*	*			cis	-170	175.7	-25.2	-103.7	0	0	0	0	109.1
177	F	29.1	Very low	31.3	Very low	203 Å²	203	136.1 Å²	136.1	89%	0.89	74%	0.741	S	S	*	*			trans	69.9	156.5	173.8	-54.5	-80.7	0	0	0	114.4
178	S	28.4	Very low	31.6	Very low	94 Å²	94	137 Å²	137	66%	0.657	74%	0.741	S	S	*	*			cis	164.8	161.8	-16.1	-166.3	0	0	0	0	103.2
179	S	33.1	Very low	31.8	Very low	82 Å²	82	138.4 Å²	138.4	57%	0.573	74%	0.741	S	S	*	*			cis	-160.7	148.6	20.8	-33.1	0	0	0	0	111.8
180	H	36.7	Very low	32	Very low	177 Å²	177	136.3 Å²	136.3	82%	0.819	74%	0.741	S	S	*	*			trans	63.5	158.6	154.5	-46.6	-47.6	0	0	0	118.2
181	S	35.1	Very low	32.2	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	75%	0.745	S	S	*	*			cis	-145.6	136.7	4.8	-155.4	0	0	0	0	114.1
182	L	34.8	Very low	32.5	Very low	144 Å²	144	135.7 Å²	135.7	75%	0.754	74%	0.741	S	S	*	*			trans	18.8	142.2	140.1	-49.2	174.2	0	0	0	119.6
183	K	36.3	Very low	32.1	Very low	197 Å²	197	134 Å²	134	86%	0.857	73%	0.732	S	S	*	*			cis	-149.4	168.3	46.6	-77.9	-180	178.9	177.8	0	114.5
184	P	35.8	Very low	32.2	Very low	98 Å²	98	133.6 Å²	133.6	64%	0.636	73%	0.73	S	S	*	*			trans	-136.6	171	-152.4	44.9	-28.3	0	0	0	118.6
185	I	36.8	Very low	32.3	Very low	150 Å²	150	129.8 Å²	129.8	77%	0.769	72%	0.724	S	S	*	*			trans	48.7	126.3	133.4	-65.5	169.3	0	0	0	118.4
186	P	38.1	Very low	32.5	Very low	121 Å²	121	135.7 Å²	135.7	79%	0.786	73%	0.73	S	S	*	*				-150.6	179.2	71.2	33.5	-11	0	0	0	117.6
187	S	35.2	Very low	32.7	Very low	89 Å²	89	135.5 Å²	135.5	62%	0.622	73%	0.734	S	S	*	*			cis	-178.2	146.3	-38.3	66.6	0	0	0	0	111.6
188	V	34.4	Very low	32.7	Very low	120 Å²	120	133.6 Å²	133.6	73%	0.727	73%	0.728	S	S	*	*			trans	66	141.1	135.2	166.2	0	0	0	0	118
189	K	32.9	Very low	32.8	Very low	167 Å²	167	135.2 Å²	135.2	73%	0.726	73%	0.728	S	S	*	*			cis	-158.2	146.1	24.9	-148.2	159.7	-123.3	167.2	0	112	Y191	K189-Y191 HydrophobicContact CD-CE2 4.43Å; K189-Y191 HydrophobicContact CG-CD2 4.45Å; K189-Y191 HydrophobicContact CG-CE2 4.37Å
190	P	34.2	Very low	32.7	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	73%	0.733	S	S	*	*			trans	-112.1	158	165.9	38.3	-30.5	0	0	0	113.1
191	Y	33.9	Very low	32.4	Very low	201 Å²	201	134 Å²	134	79%	0.788	72%	0.724	S	S	*	*			trans	-156.8	135.7	164.8	-95.5	-60	0	0	0	117.3	K189	K189-Y191 HydrophobicContact CD-CE2 4.43Å; K189-Y191 HydrophobicContact CG-CD2 4.45Å; K189-Y191 HydrophobicContact CG-CE2 4.37Å
192	L	32.2	Very low	32.4	Very low	141 Å²	141	134.1 Å²	134.1	74%	0.738	72%	0.724	S	S	*	*			trans	30.5	113	147.1	-71.1	164.3	0	0	0	123.9
193	S	26	Very low	32.2	Very low	94 Å²	94	138.1 Å²	138.1	66%	0.657	73%	0.73	S	S	*	*				46.5	140.6	111.8	100	0	0	0	0	124.1
194	S	27.8	Very low	32	Very low	92 Å²	92	136 Å²	136	64%	0.643	73%	0.726	S	S	*	*			trans	103.9	124.7	133.7	-62.2	0	0	0	0	121.1
195	N	28.6	Very low	31.6	Very low	143 Å²	143	138.6 Å²	138.6	77%	0.765	73%	0.731	S	S	*	*			trans	70.2	119.6	139.6	-70.7	-30.4	0	0	0	121.6
196	R	28.3	Very low	31.3	Very low	237 Å²	237	137.8 Å²	137.8	89%	0.894	73%	0.728	S	S	*	*				62.8	135.1	116.5	-166.7	-172.3	-163.7	171.9	4.1	118.6
197	A	28.7	Very low	31	Very low	80 Å²	80	138.3 Å²	138.3	66%	0.661	72%	0.724	S	S	*	*			cis	-179.6	170.8	-17.5	0	0	0	0	0	107.4
198	H	29.1	Very low	30.6	Very low	164 Å²	164	138.6 Å²	138.6	76%	0.759	73%	0.726	S	S	*	*			trans	78.1	130.6	147.4	-120.7	-132.6	0	0	0	120.6
199	L	30.7	Very low	30.5	Very low	128 Å²	128	138.2 Å²	138.2	67%	0.67	72%	0.724	S	S	*	*			trans	69.7	160.5	155.8	-47.8	178.1	0	0	0	117.6
200	E	31.9	Very low	30.3	Very low	143 Å²	143	137.1 Å²	137.1	67%	0.668	73%	0.726	S	S	*	*			cis	-136.3	170.4	1.6	-164.7	43.2	-88.3	0	0	113
201	S	30.4	Very low	30	Very low	90 Å²	90	136.4 Å²	136.4	63%	0.629	72%	0.72	S	S	*	*			trans	-98.5	148.3	-172.2	-35.3	0	0	0	0	113.5
202	S	35.3	Very low	29.8	Very low	101 Å²	101	135.5 Å²	135.5	71%	0.706	72%	0.72	S	S	*	*			trans	176	134.7	133.4	-83.9	0	0	0	0	111.6
203	R	28.9	Very low	29.6	Very low	229 Å²	229	133.6 Å²	133.6	86%	0.864	72%	0.718	S	S	*	*				51.7	131.9	91.4	-49.5	-179.3	-172.4	-166.8	5.8	112.4
204	I	32.6	Very low	29.9	Very low	151 Å²	151	138.2 Å²	138.2	77%	0.774	73%	0.727	S	S	*	*			cis	-155.2	127	49.9	-74.8	173.3	0	0	0	106.4
205	M	27.3	Very low	29.9	Very low	153 Å²	153	140.5 Å²	140.5	75%	0.754	73%	0.732	S	S	*	*				69.4	139.6	82.1	-89.1	-69.4	-64.8	0	0	116
206	L	31.4	Very low	30	Very low	134 Å²	134	141.8 Å²	141.8	70%	0.702	73%	0.733	S	S	*	*			trans	72.4	148.8	175.6	-49.5	174.8	0	0	0	115.9
207	D	30.4	Very low	30	Very low	132 Å²	132	135.9 Å²	135.9	71%	0.706	72%	0.724	S	S	*	*			cis	-158.3	135.8	-25.3	-123.7	-11.5	0	0	0	114.2
208	S	28.4	Very low	30.1	Very low	94 Å²	94	137.1 Å²	137.1	66%	0.657	72%	0.723	S	S	*	*			trans	63.9	163.3	133	86.4	0	0	0	0	124.5
209	V	31.4	Very low	30.3	Very low	113 Å²	113	135.3 Å²	135.3	69%	0.685	72%	0.724	S	S	*	*			trans	70.9	102.8	153.9	179.5	0	0	0	0	120.1
210	N	28.6	Very low	30.3	Very low	143 Å²	143	133.5 Å²	133.5	77%	0.765	72%	0.722	S	S	*	*			trans	63.2	163.4	137.3	-67.5	-6.3	0	0	0	119.9
211	T	29.3	Very low	30.4	Very low	102 Å²	102	133.9 Å²	133.9	63%	0.626	73%	0.729	S	S	*	*			cis	-161.9	169.7	-17	24	0	0	0	0	108.8
212	K	29.7	Very low	30.5	Very low	181 Å²	181	134 Å²	134	79%	0.787	74%	0.735	S	S	*	*			trans	57.9	98.8	145	-75.5	167.5	-177.2	-178.6	0	116.5
213	S	27.5	Very low	30.4	Very low	101 Å²	101	137.4 Å²	137.4	71%	0.706	74%	0.744	S	S	*	*				81.3	128	85.1	69.9	0	0	0	0	114.8
214	F	31	Very low	30.4	Very low	191 Å²	191	131.3 Å²	131.3	84%	0.838	74%	0.737	S	S	*	*				-153.3	138.7	126.4	-132.9	-101	0	0	0	110.1
215	N	28.7	Very low	30.5	Very low	140 Å²	140	131.3 Å²	131.3	75%	0.749	74%	0.744	S	S	*	*			trans	-99.1	159.6	167.8	-69.3	-24.3	0	0	0	108.4
216	Q	30.5	Very low	30.7	Very low	170 Å²	170	130.1 Å²	130.1	79%	0.794	75%	0.745	S	S	*	*				155.7	127.2	127.7	-80.8	-175	-29.2	0	0	109.6
217	T	29.3	Very low	30.6	Very low	113 Å²	113	130.7 Å²	130.7	69%	0.693	75%	0.748	S	S	*	*				65.4	143	87.4	-12.9	0	0	0	0	111.9
218	T	30.9	Very low	30.6	Very low	106 Å²	106	129.7 Å²	129.7	65%	0.65	75%	0.746	S	S	*	*			cis	-168.1	151.3	27.2	-27	0	0	0	0	111.7
219	T	31.7	Very low	30.6	Very low	127 Å²	127	131.1 Å²	131.1	78%	0.779	75%	0.751	S	S	*	*			trans	54.3	160.3	144.6	47.7	0	0	0	0	122
220	S	31.5	Very low	30.7	Very low	90 Å²	90	130 Å²	130	63%	0.629	75%	0.754	S	S	*	*			cis	-176.8	156.6	-19.3	54.7	0	0	0	0	113.1
221	N	33.2	Very low	30.9	Very low	151 Å²	151	129.5 Å²	129.5	81%	0.807	76%	0.756	S	S	*	*			trans	67.4	121.5	140.8	-66.2	1.8	0	0	0	125
222	A	34.1	Very low	30.8	Very low	92 Å²	92	132 Å²	132	76%	0.76	76%	0.763	S	S	*	*				92.8	146.6	116.2	0	0	0	0	0	125.8
223	L	32.3	Very low	30.9	Very low	172 Å²	172	128.9 Å²	128.9	90%	0.901	76%	0.755	S	S	*	*			trans	86	160.9	149.2	-82.1	165.8	0	0	0	123.3
224	S	29.1	Very low	31.1	Very low	101 Å²	101	130.6 Å²	130.6	71%	0.706	76%	0.756	S	S	*	*			trans	-135.8	146.7	-162.6	-41.8	0	0	0	0	111.9
225	T	33.9	Very low	31.3	Very low	151 Å²	151	126 Å²	126	93%	0.926	75%	0.753	S	S	*	*			trans	-164	176.8	146.4	8.2	0	0	0	0	114.1
226	T	31.3	Very low	31.3	Very low	128 Å²	128	123.9 Å²	123.9	79%	0.785	76%	0.755	S	S	*	*			trans	-105.4	169.5	-168	-47.6	0	0	0	0	112.3
227	I	30	Very low	31.5	Very low	146 Å²	146	123.8 Å²	123.8	75%	0.749	76%	0.758	S	S	*	*			trans	125.6	96.8	151.1	-64.1	175.1	0	0	0	115.8
228	T	31.2	Very low	31.5	Very low	111 Å²	111	125.5 Å²	125.5	68%	0.681	76%	0.762	S	S	*	*				64.7	117.6	121.5	-43.5	0	0	0	0	122.7
229	T	28.2	Very low	31.8	Very low	124 Å²	124	127.4 Å²	127.4	76%	0.761	77%	0.774	S	S	*	*			trans	60.7	108.6	152.7	57.1	0	0	0	0	122
230	A	31.8	Very low	31.8	Very low	89 Å²	89	128.2 Å²	128.2	74%	0.736	77%	0.773	S	S	*	*				68.8	155.2	124.6	0	0	0	0	0	119.7
231	T	33.6	Very low	32	Very low	133 Å²	133	133 Å²	133	82%	0.816	78%	0.783	S	S	*	*			trans	58.7	130.7	-177.4	40.9	0	0	0	0	116.7
232	M	27.6	Very low	32	Very low	156 Å²	156	132.5 Å²	132.5	77%	0.768	79%	0.785	S	S	*	*			trans	48.1	115.6	143.8	-58.3	-165.9	73.2	0	0	120.5
233	N	31.4	Very low	32.1	Very low	114 Å²	114	131.5 Å²	131.5	61%	0.61	78%	0.784	S	S	*	*				87.9	131.7	126	-75.2	52.6	0	0	0	121.8
234	D	32.5	Very low	32.3	Very low	138 Å²	138	130.8 Å²	130.8	74%	0.738	78%	0.781	S	S	*	*			trans	67.8	105.3	134.3	-50.9	-23	0	0	0	122.4
235	A	34	Very low	32.4	Very low	94 Å²	94	131.6 Å²	131.6	78%	0.777	79%	0.785	S	S	*	*				61.3	99.9	126.9	0	0	0	0	0	122.9
236	A	30.3	Very low	32.4	Very low	96 Å²	96	128.6 Å²	128.6	79%	0.793	78%	0.775	S	S	*	*				70.1	169.7	129.1	0	0	0	0	0	122
237	I	33.1	Very low	32.5	Very low	168 Å²	168	130.3 Å²	130.3	86%	0.862	77%	0.769	S	S	*	*			trans	101.9	157.3	168.6	-56.1	167.4	0	0	0	116.2
238	I	30.1	Very low	32.7	Very low	148 Å²	148	127.6 Å²	127.6	76%	0.759	75%	0.753	S	S	*	*			trans	-128	148.6	-156	-61.4	156.6	0	0	0	111.2
239	T	36.5	Very low	32.8	Very low	147 Å²	147	129.1 Å²	129.1	90%	0.902	75%	0.752	S	S	*	*			trans	-175.6	160	146.7	12	0	0	0	0	116
240	D	31.3	Very low	32.9	Very low	144 Å²	144	128.1 Å²	128.1	77%	0.77	75%	0.75	S	S	*	*			trans	-95.3	165.7	-177.7	-57.5	-83	0	0	0	116.3
241	K	36.5	Very low	32.9	Very low	190 Å²	190	131.7 Å²	131.7	83%	0.826	75%	0.752	S	S	*	*				163.5	118	115.8	-89.2	171.8	-175	-179.6	0	119.7
242	T	33.3	Very low	32.9	Very low	141 Å²	141	132.4 Å²	132.4	87%	0.865	75%	0.746	S	S	*	*			trans	48.9	126.6	134.3	58.2	0	0	0	0	126.3
243	G	37.2	Very low	32.9	Very low	71 Å²	71	131.4 Å²	131.4	73%	0.732	74%	0.743	S	S	*	*			trans	144.1	158.9	153.7	0	0	0	0	0	114.9
244	D	34.6	Very low	32.8	Very low	157 Å²	157	132.8 Å²	132.8	84%	0.84	75%	0.75	S	S	*	*			cis	-164.2	-162.6	-25.9	-140.4	-79.4	0	0	0	113.6
245	C	31.5	Very low	32.7	Very low	118 Å²	118	130.6 Å²	130.6	80%	0.797	75%	0.746	S	S	*	*			trans	-94	175.9	-167.3	-59.8	0	0	0	0	115.7
246	A	34.1	Very low	32.5	Very low	87 Å²	87	132 Å²	132	72%	0.719	75%	0.745	S	S	*	*			cis	-166.2	-150.3	-21.8	0	0	0	0	0	107.7
247	Y	33.5	Very low	32.4	Very low	164 Å²	164	133.4 Å²	133.4	64%	0.643	74%	0.738	S	S	*	*			cis	-170.4	148.3	2.5	-162.1	-126.1	0	0	0	111.6
248	H	34.8	Very low	32.4	Very low	89 Å²	89	129 Å²	129	41%	0.412	72%	0.716	S	S	.	*			trans	56.5	159.2	159.6	-86.5	-128.5	0	0	0	121.7
249	Q	32.1	Very low	32.5	Very low	144 Å²	144	128 Å²	128	67%	0.673	71%	0.708	S	S	*	*			cis	-173.5	154	-18.5	-174.5	177.9	14.9	0	0	111.9
250	S	31.1	Very low	32.3	Very low	103 Å²	103	127.4 Å²	127.4	72%	0.72	70%	0.695	S	S	*	*			trans	60.1	155.8	156.8	46.6	0	0	0	0	122
251	E	32.6	Very low	32.3	Very low	163 Å²	163	124.7 Å²	124.7	76%	0.762	69%	0.692	S	S	*	*			cis	-168.7	172.4	-28.1	-154.4	-176.7	-114.5	0	0	110.8
252	Q	32.2	Very low	32	Very low	148 Å²	148	120 Å²	120	69%	0.692	68%	0.683	S	S	*	*			trans	80.1	107.1	156.6	-61.8	-175.6	26.6	0	0	124.6
253	L	29.1	Very low	31.9	Very low	136 Å²	136	116.8 Å²	116.8	71%	0.712	68%	0.678	S	S	*	*				60.1	125	120.4	-60.7	175.1	0	0	0	124.1
254	N	29	Very low	31.6	Very low	142 Å²	142	120 Å²	120	76%	0.759	68%	0.679	S	S	*	*			trans	65.3	152.4	134.1	-66.1	-10.1	0	0	0	121.3
255	S	29.4	Very low	31.4	Very low	92 Å²	92	117.3 Å²	117.3	64%	0.643	67%	0.672	S	S	*	*			cis	-173.2	142.9	-23.3	58.2	0	0	0	0	111.8
256	T	30.7	Very low	31.2	Very low	125 Å²	125	117.8 Å²	117.8	77%	0.767	67%	0.666	S	S	*	*			trans	71.4	135.6	152	-10.3	0	0	0	0	122.2
257	L	28.2	Very low	31	Very low	124 Å²	124	119 Å²	119	65%	0.649	67%	0.669	S	S	*	*			trans	107.8	89.5	130.6	-140.1	80.3	0	0	0	121.9
258	L	32.6	Very low	30.7	Very low	75 Å²	75	117.2 Å²	117.2	39%	0.393	67%	0.671	S	S	.	*			trans	35.9	131.5	130.1	-33.1	170.6	0	0	0	121.3	Q339 T340	L258-Q339 HydrophobicContact CB-CB 4Å; L258-Q339 WeakPolarHBondContact CD2-O 3.24Å; L258-T340 CarbonylContact C-O 3.56Å
259	H	32.6	Very low	30.5	Very low	128 Å²	128	120.4 Å²	120.4	59%	0.593	69%	0.686	S	S	*	*	B	Isolated β-bridge	trans	-163.9	172.9	130.8	-102.6	68	0	0	0	113.9	Q339 T340	H259-Q339 PolarHBondContact CD2-NE2 2.89Å; H259-Q339 VanDerWaalsContact CD2-NE2 3.34Å; H259-Q339 PolarHBondContact CD2-OE1 2.84Å; H259-Q339 PolarHBondContact CE1-NE2 3.06Å; H259-Q339 VanDerWaalsContact CE1-NE2 3.32Å; H259-Q339 PolarHBondContact NE2-NE2 2.97Å; H259-Q339 VanDerWaalsContact NE2-NE2 3.16Å; H259-T340 PolarHBondContact N-O 3.36Å; H259-T340 PolarHBondContact O-N 3.36Å; H259-T340 PolarHBondContact O-OG1 2.99Å
260	H	32.5	Very low	30.3	Very low	135 Å²	135	119.3 Å²	119.3	63%	0.625	68%	0.684	S	S	*	*			trans	-68.4	178.3	-164.5	-105.2	-51.8	0	0	0	115.6	S262 Q339	H260-S262 PolarHBondContact CE1-OG 2.94Å; H260-S262 PolarHBondContact ND1-OG 3.37Å; H260-Q339 HydrophobicContact CB-CG 4.05Å; H260-Q339 VanDerWaalsContact CD2-CD 3.43Å; H260-Q339 VanDerWaalsContact CD2-CG 3.42Å; H260-Q339 WeakPolarHBondContact CD2-CG 3.35Å; H260-Q339 PolarHBondContact CD2-OE1 3.24Å; H260-Q339 VanDerWaalsContact CG-OE1 3.29Å
261	A	29.8	Very low	30.1	Very low	87 Å²	87	118.2 Å²	118.2	72%	0.719	68%	0.677	S	S	*	*			cis	-158	-155.7	22.1	0	0	0	0	0	112.1
262	S	30.2	Very low	29.9	Very low	91 Å²	91	118.6 Å²	118.6	64%	0.636	68%	0.676	S	S	*	*				-177.2	140.5	-68.9	-75	0	0	0	0	111.6	H260	H260-S262 PolarHBondContact CE1-OG 2.94Å; H260-S262 PolarHBondContact ND1-OG 3.37Å
263	G	31.3	Very low	29.6	Very low	73 Å²	73	119.3 Å²	119.3	75%	0.753	68%	0.677	S	S	*	*			trans	87	161.7	172.5	0	0	0	0	0	115.8
264	D	30.9	Very low	29.4	Very low	140 Å²	140	117 Å²	117	75%	0.749	67%	0.673	S	S	*	*			cis	-159.5	-175.1	-13	-132.1	-122.6	0	0	0	107.5
265	S	30.6	Very low	29.3	Very low	100 Å²	100	118.6 Å²	118.6	70%	0.699	67%	0.673	S	S	*	*			cis	-137.1	-177.9	11	68	0	0	0	0	109.9
266	L	27.8	Very low	29.1	Very low	128 Å²	128	121.8 Å²	121.8	67%	0.67	68%	0.682	S	S	*	*			cis	84.4	90.6	16.9	-76.3	177.1	0	0	0	119.3
267	S	29.2	Very low	29.3	Very low	111 Å²	111	124 Å²	124	78%	0.776	68%	0.684	S	S	*	*			trans	-173.7	135	130.6	48.3	0	0	0	0	109.6
268	N	28	Very low	29.8	Very low	128 Å²	128	123 Å²	123	68%	0.684	68%	0.684	S	S	*	*			cis	96.6	147.8	32.8	-76.4	-5	0	0	0	114
269	Q	30	Very low	29.7	Very low	155 Å²	155	124.2 Å²	124.2	72%	0.724	70%	0.697	S	S	*	*			trans	73	142.6	166.6	-47.4	-41.4	79.5	0	0	116.6
270	D	28.1	Very low	29.6	Very low	121 Å²	121	123.6 Å²	123.6	65%	0.647	70%	0.702	S	S	*	*			cis	-160.8	167.7	-16.9	-134.8	-47.6	0	0	0	113.1
271	S	28	Very low	29.3	Very low	81 Å²	81	125.5 Å²	125.5	57%	0.566	71%	0.708	S	S	*	*			trans	65.1	134.7	142.9	73.9	0	0	0	0	122.8
272	K	27.8	Very low	29.1	Very low	170 Å²	170	128.1 Å²	128.1	74%	0.739	71%	0.705	S	S	*	*				29.7	134.4	123.2	-41.8	164.1	-171.1	167.1	0	116.8
273	F	25.9	Very low	28.8	Very low	164 Å²	164	128 Å²	128	72%	0.719	70%	0.704	S	S	*	*			cis	-145.7	136.4	42.2	-91.8	-104	0	0	0	108.7
274	S	25.7	Very low	28.6	Very low	88 Å²	88	129.9 Å²	129.9	62%	0.615	71%	0.706	S	S	*	*				72.5	155	77	-49.2	0	0	0	0	114.7
275	F	26.3	Very low	28.3	Very low	175 Å²	175	128.1 Å²	128.1	77%	0.768	71%	0.705	S	S	*	*			trans	81.6	130.9	167.6	-69.1	-73.5	0	0	0	120.1
276	L	26.1	Very low	28.1	Very low	158 Å²	158	129.3 Å²	129.3	83%	0.827	70%	0.703	S	S	*	*			trans	74.1	95.3	144.8	-64.6	166.2	0	0	0	120.6
277	H	34.6	Very low	28	Very low	173 Å²	173	131.5 Å²	131.5	80%	0.801	71%	0.707	S	S	*	*				-47.3	165.1	128.6	-91.1	-81	0	0	0	113
278	P	38.1	Very low	27.8	Very low	103 Å²	103	133.3 Å²	133.3	67%	0.669	71%	0.705	S	S	*	*			cis	-102.4	-86	-0.1	19.6	2.4	0	0	0	110.8
279	P	29.4	Very low	27.6	Very low	100 Å²	100	133 Å²	133	65%	0.649	71%	0.712	S	S	*	*			cis	-77.2	162.4	-32.7	35.7	-34.5	0	0	0	112.4	F281	P279-F281 HydrophobicContact CB-CD2 4.08Å; P279-F281 HydrophobicContact CB-CE2 4Å; P279-F281 HydrophobicContact CG-CD2 4.02Å; P279-F281 HydrophobicContact CG-CE2 4.09Å
280	V	30.7	Very low	27.4	Very low	115 Å²	115	128.7 Å²	128.7	70%	0.697	70%	0.704	S	S	*	*			trans	-83.6	126.9	154.5	165.9	0	0	0	0	107.4	H282	V280-H282 PolarHBondContact O-CD2 2.82Å
281	F	26.2	Very low	27.4	Very low	174 Å²	174	130.5 Å²	130.5	76%	0.763	71%	0.712	S	S	*	*			trans	-115.7	115.7	149.7	-83.4	-97.9	0	0	0	107.2	P279	P279-F281 HydrophobicContact CB-CD2 4.08Å; P279-F281 HydrophobicContact CB-CE2 4Å; P279-F281 HydrophobicContact CG-CD2 4.02Å; P279-F281 HydrophobicContact CG-CE2 4.09Å
282	H	25.6	Very low	27.2	Very low	142 Å²	142	132.4 Å²	132.4	66%	0.657	72%	0.72	S	S	*	*				63	127.9	72.9	-72.5	-83	0	0	0	111.6	V280	V280-H282 PolarHBondContact O-CD2 2.82Å
283	S	24	Very low	27.1	Very low	88 Å²	88	129.8 Å²	129.8	62%	0.615	71%	0.71	S	S	*	*			cis	-168.1	155.4	-9.2	41.8	0	0	0	0	111.4	S285	S283-S285 PolarHBondContact O-N 3.23Å
284	S	27.1	Very low	27.1	Very low	113 Å²	113	129.2 Å²	129.2	79%	0.79	71%	0.714	S	S	*	*			trans	18.7	101.4	134.6	-45.9	0	0	0	0	118
285	S	26	Very low	27.1	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	72%	0.722	S	S	*	*				-147.2	109.6	128.6	-87.8	0	0	0	0	110	S283	S283-S285 PolarHBondContact O-N 3.23Å
286	L	26.5	Very low	27.2	Very low	126 Å²	126	128 Å²	128	66%	0.66	71%	0.714	S	S	*	*				74.9	107.3	94.6	-68	173.7	0	0	0	110.2
287	K	24.1	Very low	27.5	Very low	173 Å²	173	126.6 Å²	126.6	75%	0.752	71%	0.707	S	S	*	*				64.8	138.6	92.3	-67.5	-178.2	-156.5	163	0	111.9
288	M	25.1	Very low	27.4	Very low	150 Å²	150	124.3 Å²	124.3	74%	0.739	70%	0.701	S	S	*	*			cis	-147.3	137.7	29.2	-164.2	80.9	83.1	0	0	112.9	A290	M288-A290 HydrophobicContact CG-CB 3.64Å
289	S	25.4	Very low	27.1	Very low	120 Å²	120	125.3 Å²	125.3	84%	0.839	70%	0.701	S	S	*	*			trans	-99.4	100.6	153.1	54.9	0	0	0	0	108.9
290	A	24.4	Very low	27.4	Very low	66 Å²	66	127.2 Å²	127.2	55%	0.545	71%	0.706	S	S	.	*			trans	-144.5	143.9	172.8	0	0	0	0	0	107.4	M288	M288-A290 HydrophobicContact CG-CB 3.64Å
291	I	28.2	Very low	27.4	Very low	159 Å²	159	125.8 Å²	125.8	82%	0.815	70%	0.701	S	S	*	*			cis	68.2	58.3	16.2	-37.5	-177.6	0	0	0	114.5
292	V	23.9	Very low	27.6	Very low	121 Å²	121	124.8 Å²	124.8	73%	0.733	70%	0.703	S	S	*	*			trans	-146.3	118.1	141.4	173	0	0	0	0	103.7
293	E	24.9	Very low	28	Very low	115 Å²	115	122.7 Å²	122.7	54%	0.537	70%	0.7	S	S	.	*				66.2	77	59.7	-76.1	-172.9	132.5	0	0	115.8	K1123	E293-K1123 IonicContact OE1-NZ 3.63Å; E293-K1123 PolarHBondContact OE1-NZ 3.05Å; E293-K1123 IonicContact OE2-NZ 3.89Å; E293-K1123 PolarHBondContact OE2-NZ 2.79Å
294	N	26.2	Very low	28.3	Very low	151 Å²	151	125.3 Å²	125.3	81%	0.807	71%	0.707	S	S	*	*			trans	62.9	-179.4	152.7	-57.2	-25.9	0	0	0	117.3
295	I	27	Very low	28.6	Very low	151 Å²	151	124 Å²	124	77%	0.774	70%	0.698	S	S	*	*			trans	68.5	95.6	-177.4	-47.5	171.6	0	0	0	109.7
296	S	28.5	Very low	28.9	Very low	86 Å²	86	126.6 Å²	126.6	60%	0.601	70%	0.702	S	S	*	*				63	135.3	75	102.9	0	0	0	0	111.8
297	D	30.7	Very low	29.1	Very low	129 Å²	129	124.6 Å²	124.6	69%	0.69	70%	0.704	S	S	*	*			cis	-144	164.4	12.1	-83.9	-68.7	0	0	0	112.8
298	N	32.7	Very low	29.4	Very low	126 Å²	126	122.7 Å²	122.7	67%	0.674	70%	0.702	S	S	*	*			trans	49.3	122.8	142.1	-72.2	-29.8	0	0	0	122.9
299	N	33	Very low	29.9	Very low	123 Å²	123	122.2 Å²	122.2	66%	0.658	70%	0.702	S	S	*	*				84.5	124	126.5	-64.7	-13.2	0	0	0	121.7
300	N	34.8	Very low	30	Very low	140 Å²	140	125.2 Å²	125.2	75%	0.749	70%	0.7	S	S	*	*			trans	62.1	123.8	134	-57.7	-10.6	0	0	0	118
301	S	30.4	Very low	30.7	Very low	86 Å²	86	126.6 Å²	126.6	60%	0.601	70%	0.703	S	S	*	*			cis	149.3	156.1	23.1	54.7	0	0	0	0	104.5
302	L	31.5	Very low	30.7	Very low	152 Å²	152	124.9 Å²	124.9	80%	0.796	70%	0.7	S	S	*	*			trans	66.3	148	154.4	-63.7	168	0	0	0	117.2
303	T	32.8	Very low	30.8	Very low	99 Å²	99	124.6 Å²	124.6	61%	0.607	70%	0.704	S	S	*	*			cis	-167.6	171.6	-28.7	11.8	0	0	0	0	108.1
304	N	31.1	Very low	30.8	Very low	143 Å²	143	124 Å²	124	77%	0.765	71%	0.712	S	S	*	*			trans	71	154.7	151	-67.3	-9.9	0	0	0	117.9
305	S	32.9	Very low	31	Very low	84 Å²	84	121.2 Å²	121.2	59%	0.587	70%	0.704	S	S	*	*			cis	-172.3	170.5	-22.7	-100.5	0	0	0	0	110
306	I	32.4	Very low	31	Very low	158 Å²	158	120.3 Å²	120.3	81%	0.81	70%	0.701	S	S	*	*			trans	67.3	104	154.8	-70	153.6	0	0	0	114.1
307	A	30.8	Very low	31	Very low	84 Å²	84	123 Å²	123	69%	0.694	71%	0.707	S	S	*	*				76.8	162.2	84.1	0	0	0	0	0	112.8
308	D	32	Very low	31.1	Very low	134 Å²	134	120.9 Å²	120.9	72%	0.717	70%	0.701	S	S	*	*			cis	-157.5	-176.3	11.7	-147	-31.9	0	0	0	111.4
309	L	34.7	Very low	31	Very low	140 Å²	140	123 Å²	123	73%	0.733	71%	0.707	S	S	*	*			trans	70.3	102.6	155	-64.7	157.8	0	0	0	121.1
310	F	28.4	Very low	30.7	Very low	183 Å²	183	122.8 Å²	122.8	80%	0.803	71%	0.71	S	S	*	*				46.5	171.3	101.7	-71	-73.4	0	0	0	121.1
311	P	37.3	Very low	30.3	Very low	95 Å²	95	120.9 Å²	120.9	62%	0.617	71%	0.707	S	S	*	*				-144.4	173.7	-78.9	40.4	-19.7	0	0	0	117.9
312	T	28.7	Very low	30.2	Very low	122 Å²	122	124.1 Å²	124.1	75%	0.748	72%	0.716	S	S	*	*			trans	57.6	153.5	145.3	49.2	0	0	0	0	123.2
313	S	26.3	Very low	30.1	Very low	115 Å²	115	124.2 Å²	124.2	80%	0.804	72%	0.716	S	S	*	*			trans	74.2	155.5	161.1	88.2	0	0	0	0	115.8
314	S	26	Very low	30.5	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	72%	0.721	S	S	*	*			cis	-166.3	-175.5	-28.2	55.9	0	0	0	0	109.6
315	S	29	Very low	30.4	Very low	93 Å²	93	123.3 Å²	123.3	65%	0.65	72%	0.722	S	S	*	*			trans	83.3	122.7	157	85.4	0	0	0	0	119.5
316	N	27.5	Very low	30.6	Very low	133 Å²	133	124.4 Å²	124.4	71%	0.711	73%	0.73	S	S	*	*				74	118.3	118.6	-65.4	0.6	0	0	0	123.6
317	I	28.6	Very low	30.6	Very low	141 Å²	141	124.1 Å²	124.1	72%	0.723	74%	0.735	S	S	*	*				71.5	137.9	118.5	-65.4	170.1	0	0	0	118
318	P	33.4	Very low	30.8	Very low	86 Å²	86	125.2 Å²	125.2	56%	0.558	74%	0.738	S	S	*	*			cis	-145.3	-158.5	-30	43	-22.1	0	0	0	112.4
319	Q	29.3	Very low	30.9	Very low	171 Å²	171	125.9 Å²	125.9	80%	0.799	74%	0.741	S	S	*	*			trans	62.3	158.6	149.5	-69.7	167	-5.7	0	0	118.3
320	T	27	Very low	30.8	Very low	118 Å²	118	124.3 Å²	124.3	72%	0.724	74%	0.737	S	S	*	*			cis	-152.2	141.7	-8.9	5.9	0	0	0	0	111.9
321	C	26.4	Very low	31	Very low	100 Å²	100	121.1 Å²	121.1	68%	0.676	74%	0.736	S	S	*	*			trans	46.9	122.2	139.7	-66.2	0	0	0	0	125.3
322	L	29	Very low	30.8	Very low	154 Å²	154	127.1 Å²	127.1	81%	0.806	75%	0.747	S	S	*	*				69.3	162.8	122.1	-55.3	172.5	0	0	0	118.7
323	I	29.7	Very low	31.1	Very low	154 Å²	154	128.1 Å²	128.1	79%	0.79	75%	0.747	S	S	*	*			cis	-136.2	152.7	15.5	-69.3	175.1	0	0	0	110.7
324	P	41	Very low	31.4	Very low	110 Å²	110	128.9 Å²	128.9	71%	0.714	74%	0.741	S	S	*	*			trans	-104.3	162.1	175.4	39.5	-35	0	0	0	116
325	S	28.8	Very low	31.8	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	74%	0.738	S	S	*	*			trans	-168.6	140.8	154.9	-77.5	0	0	0	0	109.1
326	S	36.2	Very low	32	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	74%	0.741	S	S	*	*			cis	88.6	112.6	16	86.8	0	0	0	0	117.6
327	T	33.2	Very low	32.3	Very low	152 Å²	152	132.3 Å²	132.3	93%	0.933	75%	0.746	S	S	*	*			trans	-138.4	156.3	153.9	42.8	0	0	0	0	110
328	S	33.6	Very low	32.3	Very low	107 Å²	107	129 Å²	129	75%	0.748	73%	0.732	S	S	*	*			trans	-149.6	-137.1	-167.2	66	0	0	0	0	111.6
329	L	35.2	Very low	32.3	Very low	148 Å²	148	126.7 Å²	126.7	78%	0.775	71%	0.714	S	S	*	*			trans	109.3	102.3	171.2	-57.2	171	0	0	0	113.5
330	T	32.5	Very low	32.2	Very low	108 Å²	108	123.3 Å²	123.3	66%	0.663	71%	0.705	S	S	*	*				77.2	143.8	60.5	68.6	0	0	0	0	113.1
331	C	32	Very low	32.4	Very low	115 Å²	115	122.2 Å²	122.2	78%	0.777	70%	0.703	S	S	*	*				-161.5	-174.5	57.3	-75.2	0	0	0	0	112.4
332	R	33.3	Very low	32.3	Very low	221 Å²	221	123.8 Å²	123.8	83%	0.834	71%	0.709	S	S	*	*			cis	173.4	155.7	-42.3	-160.8	177.7	-160.4	171	5	108.6
333	N	34.4	Very low	32.2	Very low	143 Å²	143	122.6 Å²	122.6	77%	0.765	71%	0.708	S	S	*	*			trans	122.5	146.2	166	-71.3	0	0	0	0	113.2
334	I	34	Very low	32	Very low	131 Å²	131	120 Å²	120	67%	0.672	70%	0.703	S	S	*	*			cis	-168.6	166.1	-23.8	-128.8	166.5	0	0	0	105.4
335	S	34.1	Very low	31.3	Very low	94 Å²	94	120.4 Å²	120.4	66%	0.657	71%	0.709	S	S	*	*			cis	-99.2	-161.3	5.2	-61.6	0	0	0	0	110.9
336	Q	33.4	Very low	31.2	Very low	151 Å²	151	119.5 Å²	119.5	71%	0.706	71%	0.708	S	S	*	*			cis	72.4	154.1	10.4	-69.8	171.4	-40.2	0	0	116.4
337	L	32.6	Very low	30.8	Very low	155 Å²	155	123.1 Å²	123.1	81%	0.812	71%	0.713	S	S	*	*			cis	-94.6	-148.3	0.3	-76.1	76.7	0	0	0	112.7
338	T	30	Very low	30.5	Very low	71 Å²	71	122.6 Å²	122.6	44%	0.436	70%	0.704	S	S	.	*			trans	-159.2	173.5	-147.8	-42.6	0	0	0	0	112.1
339	Q	32.3	Very low	30.2	Very low	39 Å²	39	123.5 Å²	123.5	18%	0.182	71%	0.707	C	S	.	*			trans	117.6	-163.9	150	-55.7	152.7	112.8	0	0	118.5	L258 H259 H260	L258-Q339 HydrophobicContact CB-CB 4Å; L258-Q339 WeakPolarHBondContact CD2-O 3.24Å; H259-Q339 PolarHBondContact CD2-NE2 2.89Å; H259-Q339 VanDerWaalsContact CD2-NE2 3.34Å; H259-Q339 PolarHBondContact CD2-OE1 2.84Å; H259-Q339 PolarHBondContact CE1-NE2 3.06Å; H259-Q339 VanDerWaalsContact CE1-NE2 3.32Å; H259-Q339 PolarHBondContact NE2-NE2 2.97Å; H259-Q339 VanDerWaalsContact NE2-NE2 3.16Å; H260-Q339 HydrophobicContact CB-CG 4.05Å; H260-Q339 VanDerWaalsContact CD2-CD 3.43Å; H260-Q339 VanDerWaalsContact CD2-CG 3.42Å; H260-Q339 WeakPolarHBondContact CD2-CG 3.35Å; H260-Q339 PolarHBondContact CD2-OE1 3.24Å; H260-Q339 VanDerWaalsContact CG-OE1 3.29Å
340	T	27.8	Very low	29.7	Very low	99 Å²	99	120.4 Å²	120.4	61%	0.607	70%	0.698	S	S	*	*	B	Isolated β-bridge	trans	-158.4	156.4	-161.1	42.7	0	0	0	0	115.2	L258 H259	L258-T340 CarbonylContact C-O 3.56Å; H259-T340 PolarHBondContact N-O 3.36Å; H259-T340 PolarHBondContact O-N 3.36Å; H259-T340 PolarHBondContact O-OG1 2.99Å
341	S	30.7	Very low	29.5	Very low	96 Å²	96	121.5 Å²	121.5	67%	0.671	70%	0.7	S	S	*	*			trans	-162.4	169.7	158.6	56.1	0	0	0	0	112.2
342	T	25.5	Very low	29.3	Very low	133 Å²	133	122.4 Å²	122.4	82%	0.816	70%	0.697	S	S	*	*			trans	-118.3	176.6	-149.9	47.5	0	0	0	0	116.3
343	V	26.5	Very low	29.2	Very low	128 Å²	128	117.4 Å²	117.4	78%	0.776	69%	0.686	S	S	*	*			trans	108.9	132	158.8	-177.9	0	0	0	0	118.2
344	S	25.8	Very low	28.9	Very low	99 Å²	99	117.3 Å²	117.3	69%	0.692	69%	0.686	S	S	*	*			trans	56.5	115.4	159.8	-66.4	0	0	0	0	123.7
345	S	25.5	Very low	28.7	Very low	119 Å²	119	117.5 Å²	117.5	83%	0.832	69%	0.688	S	S	*	*				37.3	153.6	106.8	-50.7	0	0	0	0	123.2
346	A	26.4	Very low	28.5	Very low	94 Å²	94	118.9 Å²	118.9	78%	0.777	69%	0.688	S	S	*	*			trans	88.3	109.9	-179.5	0	0	0	0	0	113.9
347	Q	27.4	Very low	28.4	Very low	182 Å²	182	118.9 Å²	118.9	85%	0.85	69%	0.693	S	S	*	*			cis	92.5	132.9	32.8	-164.6	168.8	-32.5	0	0	113.6
348	L	27.6	Very low	28.1	Very low	142 Å²	142	115.3 Å²	115.3	74%	0.743	68%	0.681	S	S	*	*			trans	-17	148.7	174.6	-71.6	148.4	0	0	0	117.9
349	P	26.7	Very low	28.1	Very low	125 Å²	125	118.2 Å²	118.2	81%	0.812	69%	0.693	S	S	*	*				-131.3	120.3	106.4	35.7	-28.4	0	0	0	114.3
350	S	26	Very low	27.9	Very low	84 Å²	84	121.4 Å²	121.4	59%	0.587	71%	0.712	S	S	*	*				-75.8	136.3	129.9	53	0	0	0	0	108.2
351	N	27.2	Very low	28	Very low	130 Å²	130	126.2 Å²	126.2	70%	0.695	72%	0.72	S	S	*	*			trans	-173.5	155.7	136.7	-97.2	-19.7	0	0	0	113.1
352	N	28.7	Very low	28	Very low	135 Å²	135	128.3 Å²	128.3	72%	0.722	72%	0.719	S	S	*	*			trans	-70.7	160.8	178.3	-48.8	-54.9	0	0	0	112.1
353	L	31.6	Very low	28.2	Very low	115 Å²	115	128.5 Å²	128.5	60%	0.602	72%	0.715	S	S	*	*			trans	-126	121.8	140.5	-99.1	163.1	0	0	0	107.9
354	N	27.3	Very low	28.5	Very low	142 Å²	142	125.9 Å²	125.9	76%	0.759	71%	0.714	S	S	*	*			trans	-67.8	157.6	154.7	-65.2	-34.8	0	0	0	107.5
355	D	30.2	Very low	28.5	Very low	134 Å²	134	129.2 Å²	129.2	72%	0.717	72%	0.721	S	S	*	*			trans	-163	138.5	130.3	-116.1	-8.5	0	0	0	115.7
356	N	29.6	Very low	28.7	Very low	123 Å²	123	129.9 Å²	129.9	66%	0.658	71%	0.714	S	S	*	*			trans	73.5	135.1	142.8	-72.2	-45	0	0	0	124
357	L	31.7	Very low	28.9	Very low	152 Å²	152	131.8 Å²	131.8	80%	0.796	71%	0.71	S	S	*	*			trans	68.5	94.9	155.8	-59.3	160.7	0	0	0	116.6
358	S	25.9	Very low	28.8	Very low	80 Å²	80	128.2 Å²	128.2	56%	0.559	70%	0.701	S	S	*	*			cis	82.1	138.8	48.9	84.2	0	0	0	0	115.3
359	N	30.5	Very low	28.8	Very low	131 Å²	131	128.4 Å²	128.4	70%	0.701	70%	0.703	S	S	*	*			trans	73.4	146.2	165.8	-48.7	-35.7	0	0	0	116.8
360	N	28.5	Very low	28.9	Very low	107 Å²	107	126.6 Å²	126.6	57%	0.572	69%	0.693	S	S	*	*			cis	-170	165.7	-25.3	-96.1	-25.5	0	0	0	107
361	Y	29.7	Very low	29.1	Very low	199 Å²	199	129.9 Å²	129.9	78%	0.78	70%	0.704	S	S	*	*			trans	66.1	142.3	160.6	-56.1	-57.6	0	0	0	117.2
362	E	29.8	Very low	29.4	Very low	141 Å²	141	127.9 Å²	127.9	66%	0.659	70%	0.7	S	S	*	*			cis	-164.9	168.5	-20.4	-131.4	179.3	142.6	0	0	110.8
363	N	30.6	Very low	29.6	Very low	137 Å²	137	129.2 Å²	129.2	73%	0.733	71%	0.707	S	S	*	*			trans	38.3	135.8	147.3	-58.6	-27	0	0	0	122.6
364	G	31	Very low	29.6	Very low	73 Å²	73	127.2 Å²	127.2	75%	0.753	71%	0.714	S	S	*	*			trans	148.3	38.8	161.4	0	0	0	0	0	116.9
365	M	27.8	Very low	30	Very low	168 Å²	168	126.9 Å²	126.9	83%	0.828	72%	0.723	S	S	*	*				64.8	123.8	104.5	-101.8	-160.6	163.7	0	0	118.9
366	L	28.8	Very low	30.1	Very low	133 Å²	133	124 Å²	124	70%	0.696	73%	0.725	S	S	*	*			trans	89.8	143.2	135.5	-70.8	172.7	0	0	0	123.7
367	I	29.9	Very low	30.1	Very low	134 Å²	134	126.4 Å²	126.4	69%	0.687	74%	0.738	S	S	*	*			trans	67.5	96.8	148.9	-68.3	159.2	0	0	0	116.3
368	T	26.2	Very low	30.1	Very low	108 Å²	108	122.7 Å²	122.7	66%	0.663	74%	0.737	S	S	*	*				87.5	145.2	52.9	69.5	0	0	0	0	116.1
369	N	27.8	Very low	30.2	Very low	146 Å²	146	124.2 Å²	124.2	78%	0.781	75%	0.747	S	S	*	*			trans	71.1	156.7	166.5	-58.8	-13.8	0	0	0	117.9
370	S	29.3	Very low	30.1	Very low	86 Å²	86	124 Å²	124	60%	0.601	75%	0.751	S	S	*	*			cis	-175.5	157.4	-28.9	-88.3	0	0	0	0	109
371	N	29.5	Very low	30.1	Very low	154 Å²	154	123.6 Å²	123.6	82%	0.824	76%	0.756	S	S	*	*			trans	70.4	153	156.5	-61.8	-26.4	0	0	0	118.5
372	S	32.9	Very low	30	Very low	87 Å²	87	120.2 Å²	120.2	61%	0.608	76%	0.757	S	S	*	*			cis	-170.2	157	-20.4	56.1	0	0	0	0	114
373	N	32.5	Very low	30	Very low	164 Å²	164	119.8 Å²	119.8	88%	0.877	77%	0.769	S	S	*	*			trans	68.5	140.6	146.6	-61.2	-18.5	0	0	0	123.2
374	G	32.5	Very low	30	Very low	73 Å²	73	119.3 Å²	119.3	75%	0.753	77%	0.771	S	S	*	*			trans	127.8	59.1	152.9	0	0	0	0	0	117.3
375	S	34.6	Very low	29.9	Very low	135 Å²	135	122 Å²	122	94%	0.944	77%	0.773	S	S	*	*				68.1	121.2	89.4	-168.5	0	0	0	0	116.6
376	G	32.1	Very low	29.9	Very low	73 Å²	73	119.9 Å²	119.9	75%	0.753	78%	0.775	S	S	*	*			trans	163.7	72.2	172	0	0	0	0	0	117.5
377	N	30.7	Very low	29.9	Very low	173 Å²	173	119.3 Å²	119.3	93%	0.925	78%	0.781	S	S	*	*			trans	-68.3	153.5	177.2	-61.1	-20	0	0	0	113.3
378	G	31	Very low	29.7	Very low	75 Å²	75	121.2 Å²	121.2	77%	0.773	79%	0.79	S	S	*	*			trans	-168.5	2.5	-178.7	0	0	0	0	0	123.4
379	S	29	Very low	29.8	Very low	112 Å²	112	122.2 Å²	122.2	78%	0.783	80%	0.797	S	S	*	*			trans	41.3	118.5	157.7	-54.6	0	0	0	0	123.1
380	T	28.6	Very low	29.8	Very low	126 Å²	126	122.2 Å²	122.2	77%	0.773	80%	0.797	S	S	*	*			trans	66.1	96.6	142.5	37	0	0	0	0	122.6
381	S	27.1	Very low	29.9	Very low	98 Å²	98	125.5 Å²	125.5	69%	0.685	81%	0.806	S	S	*	*				80	154.3	105	80.2	0	0	0	0	123.7
382	T	29	Very low	29.8	Very low	129 Å²	129	125 Å²	125	79%	0.791	80%	0.803	S	S	*	*			trans	70.7	107.5	168.6	64.1	0	0	0	0	119.3
383	S	29.2	Very low	29.8	Very low	131 Å²	131	128 Å²	128	92%	0.916	81%	0.812	S	S	*	*			trans	-151	142.1	147.8	-82.3	0	0	0	0	109.4
384	T	30.2	Very low	29.7	Very low	128 Å²	128	126.5 Å²	126.5	79%	0.785	81%	0.805	S	S	*	*			trans	-102.9	140.9	-166.5	39.5	0	0	0	0	113.3
385	T	28.3	Very low	29.7	Very low	128 Å²	128	129.7 Å²	129.7	79%	0.785	80%	0.803	S	S	*	*			trans	41.5	99.8	152.2	55.6	0	0	0	0	118.1
386	S	27.8	Very low	29.5	Very low	124 Å²	124	128 Å²	128	87%	0.867	79%	0.787	S	S	*	*				169.3	120.3	110	46.6	0	0	0	0	114.1
387	C	28.7	Very low	29.5	Very low	122 Å²	122	131.5 Å²	131.5	82%	0.824	79%	0.787	S	S	*	*			trans	-158.4	125.4	152.2	42	0	0	0	0	109.5
388	I	25.8	Very low	29.6	Very low	173 Å²	173	130.4 Å²	130.4	89%	0.887	78%	0.782	S	S	*	*			trans	-117.3	109.3	159.7	-63.9	171.4	0	0	0	104.4
389	T	28.9	Very low	29.7	Very low	129 Å²	129	135.6 Å²	135.6	79%	0.791	78%	0.783	S	S	*	*			trans	-165.1	138.9	161.6	25.1	0	0	0	0	109.1
390	N	27.8	Very low	30.1	Very low	147 Å²	147	140.2 Å²	140.2	79%	0.786	79%	0.789	S	S	*	*			trans	-59.8	156.9	171.2	-42.8	-0.4	0	0	0	111.2
391	I	31.6	Very low	30.3	Very low	154 Å²	154	140.3 Å²	140.3	79%	0.79	78%	0.784	S	S	*	*			trans	-159.4	131.7	133.5	-96.8	145.2	0	0	0	105.9
392	N	27.5	Very low	30.7	Very low	143 Å²	143	141.5 Å²	141.5	77%	0.765	79%	0.789	S	S	*	*			trans	-87.1	140.3	162.9	-61.6	-10.8	0	0	0	106.7
393	D	33.5	Very low	30.7	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	78%	0.783	S	S	*	*			trans	179	152.3	154	-82.1	-32	0	0	0	106.9
394	D	29.1	Very low	31	Very low	133 Å²	133	142.2 Å²	142.2	71%	0.711	78%	0.778	S	S	*	*			cis	-164.7	-178.3	-40.2	-167.9	11	0	0	0	106.6
395	L	33.2	Very low	31	Very low	139 Å²	139	142.6 Å²	142.6	73%	0.728	78%	0.775	S	S	*	*			trans	75.4	137.8	162.8	-53	-179.6	0	0	0	118.4
396	T	29.8	Very low	31.3	Very low	99 Å²	99	143 Å²	143	61%	0.607	77%	0.771	S	S	*	*			cis	-175.2	144.5	-35	17.9	0	0	0	0	108.6
397	I	32	Very low	31.6	Very low	147 Å²	147	144 Å²	144	75%	0.754	76%	0.762	S	S	*	*			trans	68.1	135.2	147.1	-66.1	165.2	0	0	0	114.4
398	D	32.7	Very low	31.9	Very low	151 Å²	151	143.8 Å²	143.8	81%	0.807	75%	0.752	S	S	*	*			cis	-142.7	173.6	48.8	-141.1	-27.7	0	0	0	116
399	K	34.3	Very low	32.3	Very low	184 Å²	184	140 Å²	140	80%	0.8	74%	0.741	S	S	*	*			trans	-127.8	149.6	-174.3	-64.7	177.7	179.8	176.3	0	112.5
400	K	36.5	Very low	32.5	Very low	208 Å²	208	139.4 Å²	139.4	90%	0.904	74%	0.742	S	S	*	*			trans	-149.1	118.8	150.1	-135.1	167.8	-175.7	174.7	0	112.8
401	L	33.4	Very low	32.8	Very low	128 Å²	128	136.1 Å²	136.1	67%	0.67	74%	0.735	S	S	*	*			trans	-101.6	164.2	164.9	-96.3	81.4	0	0	0	109.1	N403	L401-N403 WeakPolarHBondContact CD2-OD1 3.25Å
402	P	36.3	Very low	32.7	Very low	123 Å²	123	133.3 Å²	133.3	80%	0.799	73%	0.73	S	S	*	*				-127.2	146.1	95.3	35.9	-28.6	0	0	0	111.9
403	N	29	Very low	32.9	Very low	122 Å²	122	133 Å²	133	65%	0.652	73%	0.728	S	S	*	*			cis	79.7	119.9	43	-78.3	7	0	0	0	115.5	L401	L401-N403 WeakPolarHBondContact CD2-OD1 3.25Å
404	L	34.8	Very low	32.6	Very low	154 Å²	154	131.5 Å²	131.5	81%	0.806	72%	0.724	S	S	*	*			trans	166.5	111.7	138	-86.7	165	0	0	0	106.2
405	N	30.5	Very low	32.5	Very low	135 Å²	135	129.8 Å²	129.8	72%	0.722	72%	0.723	S	S	*	*				67.8	138.4	79	-69.4	14.9	0	0	0	112.2
406	I	34.9	Very low	32.3	Very low	138 Å²	138	132.6 Å²	132.6	71%	0.708	73%	0.732	S	S	*	*			cis	-161.2	155.8	12.1	-129.2	169	0	0	0	107.1
407	E	33.5	Very low	32.1	Very low	144 Å²	144	133.5 Å²	133.5	67%	0.673	74%	0.743	S	S	*	*			cis	-150.9	-145.4	-6.3	-141.5	174.4	-51.4	0	0	105.8
408	N	34.8	Very low	32	Very low	118 Å²	118	131.5 Å²	131.5	63%	0.631	74%	0.742	S	S	*	*			cis	-155.6	179	-2.9	-143.1	-52.9	0	0	0	111.3
409	S	34.6	Very low	31.8	Very low	93 Å²	93	132 Å²	132	65%	0.65	74%	0.744	S	S	*	*			trans	4.9	143.8	154	65	0	0	0	0	121.5
410	S	33.8	Very low	31.6	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	74%	0.744	S	S	*	*			cis	-172.2	166.9	-7.8	57.5	0	0	0	0	108.2
411	A	33.7	Very low	31.5	Very low	78 Å²	78	124.6 Å²	124.6	65%	0.645	74%	0.737	S	S	*	*			cis	-138.4	141.5	2.5	0	0	0	0	0	108.1
412	S	29.7	Very low	31.4	Very low	96 Å²	96	128 Å²	128	67%	0.671	75%	0.75	S	S	*	*				57.5	126.6	91.1	118.5	0	0	0	0	113.5
413	N	30.1	Very low	31.2	Very low	135 Å²	135	129 Å²	129	72%	0.722	74%	0.741	S	S	*	*			cis	-162.1	152.6	17.3	-111.3	-19.8	0	0	0	113.1
414	T	27.9	Very low	31.3	Very low	120 Å²	120	128.7 Å²	128.7	74%	0.736	75%	0.747	S	S	*	*			trans	36.3	146.6	142.9	61.7	0	0	0	0	122
415	S	26.6	Very low	31.2	Very low	98 Å²	98	127.1 Å²	127.1	69%	0.685	74%	0.744	S	S	*	*			cis	172.9	141.4	-18.3	50.1	0	0	0	0	106.6
416	E	29.8	Very low	31.6	Very low	197 Å²	197	125 Å²	125	92%	0.921	74%	0.74	S	S	*	*			trans	178.9	139.6	133.6	-104	169.9	-175.5	0	0	111.8
417	S	25.7	Very low	32.3	Very low	119 Å²	119	125.6 Å²	125.6	83%	0.832	74%	0.744	S	S	*	*			trans	-104.2	117.9	178.1	52.8	0	0	0	0	110.8
418	S	30.3	Very low	33.2	Very low	104 Å²	104	120.4 Å²	120.4	73%	0.727	72%	0.723	S	S	*	*			trans	-163	112	154.9	62.8	0	0	0	0	114.7
419	N	27.6	Very low	34.1	Very low	161 Å²	161	125 Å²	125	86%	0.861	73%	0.731	S	S	*	*				20.3	106.2	127.8	-52.5	-37.6	0	0	0	118.6
420	A	31.1	Very low	35.1	Very low	96 Å²	96	124.6 Å²	124.6	79%	0.793	72%	0.721	S	S	*	*			trans	-162	116	146	0	0	0	0	0	112.7
421	D	32.8	Very low	36.5	Very low	142 Å²	142	122.9 Å²	122.9	76%	0.759	70%	0.703	S	S	*	*			trans	35.3	94.9	159.9	-68.9	4	0	0	0	119.1	K423	D421-K423 PolarHBondContact O-N 3.18Å
422	E	31.5	Very low	38.1	Very low	200 Å²	200	124.9 Å²	124.9	94%	0.935	70%	0.702	S	S	*	*			trans	-59.3	85.1	149.6	-86	-159.9	109.1	0	0	110.4	C424	E422-C424 VanDerWaalsContact C-N 3.27Å; E422-C424 PolarHBondContact O-N 2.68Å
423	K	33.8	Very low	39.7	Very low	143 Å²	143	130.1 Å²	130.1	62%	0.622	71%	0.707	S	S	*	*			trans	-93.4	55.6	177.2	-155.8	168.2	-169.8	165.8	0	111.8	D421 T425	D421-K423 PolarHBondContact O-N 3.18Å; K423-T425 WeakPolarHBondContact O-CG2 3.33Å; K423-T425 PolarHBondContact O-N 3.33Å
424	C	29.2	Very low	41.2	Very low	115 Å²	115	131 Å²	131	78%	0.777	70%	0.701	S	S	*	*			trans	-54.6	108.1	168.5	-178.3	0	0	0	0	108.9	E422 S426	E422-C424 VanDerWaalsContact C-N 3.27Å; E422-C424 PolarHBondContact O-N 2.68Å; C424-S426 VanDerWaalsContact C-N 3.27Å; C424-S426 PolarHBondContact O-N 2.99Å
425	T	34.5	Very low	42.8	Very low	122 Å²	122	126.9 Å²	126.9	75%	0.748	68%	0.676	S	S	*	*			trans	-78	78.9	-170.8	53.3	0	0	0	0	110.8	K423 L427	K423-T425 WeakPolarHBondContact O-CG2 3.33Å; K423-T425 PolarHBondContact O-N 3.33Å; T425-L427 PolarHBondContact O-N 3.11Å
426	S	38.8	Very low	44.7	Very low	89 Å²	89	127.1 Å²	127.1	62%	0.622	67%	0.67	S	S	*	*			trans	-47.1	132.4	175.9	67	0	0	0	0	111.3	C424	C424-S426 VanDerWaalsContact C-N 3.27Å; C424-S426 PolarHBondContact O-N 2.99Å
427	L	48.8	Very low	46.5	Very low	152 Å²	152	121.1 Å²	121.1	80%	0.796	65%	0.647	S	S	*	*			trans	-58.6	135.7	-169.2	-69.6	170.1	0	0	0	111.9	T425 R429	T425-L427 PolarHBondContact O-N 3.11Å; L427-R429 PolarHBondContact O-N 3.49Å
428	P	52.5	Low	48.1	Very low	35 Å²	35	118.3 Å²	118.3	23%	0.227	62%	0.622	C	S	.	*			trans	-57.7	107.2	-177.7	18.4	-30.7	0	0	0	111.9	L430 G459 I461 L470	P428-L430 PolarHBondContact O-N 3.27Å; P428-G459 WeakPolarHBondContact CB-O 3.42Å; P428-I461 HydrophobicContact CB-CB 4.34Å; P428-I461 HydrophobicContact CB-CD1 3.91Å; P428-I461 HydrophobicContact CB-CG1 3.71Å; P428-I461 HydrophobicContact CG-CD1 3.57Å; P428-I461 HydrophobicContact CG-CG1 3.88Å; P428-L470 HydrophobicContact CG-CD2 3.84Å
429	R	53.3	Low	49.6	Very low	214 Å²	214	119.8 Å²	119.8	81%	0.808	62%	0.617	S	S	*	*			trans	-66.8	97.7	178.7	-71.5	-178.6	172.5	174.2	-2.5	110.7	L427 N431 L460	L427-R429 PolarHBondContact O-N 3.49Å; R429-N431 PolarHBondContact O-N 2.94Å; R429-L460 HydrophobicContact CB-CD2 4.09Å; R429-L460 WeakPolarHBondContact O-CD2 3.22Å
430	L	55	Low	50.7	Low	85 Å²	85	118.6 Å²	118.6	45%	0.445	60%	0.601	S	S	.	*			trans	-59.2	90.5	178	-70.8	174.9	0	0	0	112	P428 T467 L470	P428-L430 PolarHBondContact O-N 3.27Å; L430-T467 HydrophobicContact CD2-CG2 3.87Å; L430-L470 HydrophobicContact CD1-CD2 4.3Å; L430-L470 HydrophobicContact CD2-CD2 4.28Å; L430-L470 HydrophobicContact CG-CD2 4.35Å
431	N	63.2	Low	51.9	Low	79 Å²	79	118.9 Å²	118.9	42%	0.422	60%	0.595	S	S	.	*			trans	-114.1	89.3	-178.1	-164.1	-32.4	0	0	0	111.4	R429 R433 Y434 T435	R429-N431 PolarHBondContact O-N 2.94Å; N431-R433 PolarHBondContact O-N 2.56Å; N431-R433 WeakPolarHBondContact OD1-CB 3.45Å; N431-R433 PolarHBondContact OD1-N 3.31Å; N431-Y434 HydrophobicContact CB-CD2 4.01Å; N431-Y434 PolarHBondContact O-N 3.32Å; N431-T435 PolarHBondContact O-N 3.23Å
432	L	67.2	Low	53.2	Low	120 Å²	120	116.8 Å²	116.8	63%	0.628	58%	0.579	S	S	*	*	H	α-helix	trans	-55.8	-22.6	-178	-76.9	78.3	0	0	0	113.5	Y434 T435 N436	L432-Y434 VanDerWaalsContact C-N 3.3Å; L432-Y434 PolarHBondContact O-N 2.88Å; L432-T435 VanDerWaalsContact CA-OG1 3.28Å; L432-T435 WeakPolarHBondContact CA-OG1 3.41Å; L432-T435 PolarHBondContact O-N 3.38Å; L432-T435 PolarHBondContact O-OG1 3.23Å; L432-N436 WeakPolarHBondContact O-CB 3.36Å; L432-N436 PolarHBondContact O-N 3.31Å; L432-N436 PolarHBondContact O-OD1 2.82Å; L432-N436 VanDerWaalsContact O-OD1 3.11Å
433	R	63.3	Low	54.3	Low	207 Å²	207	114 Å²	114	78%	0.781	56%	0.561	S	S	*	*	H	α-helix	trans	-66.1	-33.7	177.3	-161.7	175.5	-175.3	-170.8	-0.8	112.1	N431 V437	N431-R433 PolarHBondContact O-N 2.56Å; N431-R433 WeakPolarHBondContact OD1-CB 3.45Å; N431-R433 PolarHBondContact OD1-N 3.31Å; R433-V437 WeakPolarHBondContact O-CG2 3.37Å; R433-V437 PolarHBondContact O-N 3.31Å
434	Y	62	Low	55.3	Low	152 Å²	152	111.5 Å²	111.5	60%	0.596	56%	0.562	S	S	*	*	H	α-helix	trans	-83.3	-31.9	176.9	-69.8	-83.2	0	0	0	112.7	N431 L432 N436 V437 L438	N431-Y434 HydrophobicContact CB-CD2 4.01Å; N431-Y434 PolarHBondContact O-N 3.32Å; L432-Y434 VanDerWaalsContact C-N 3.3Å; L432-Y434 PolarHBondContact O-N 2.88Å; Y434-N436 VanDerWaalsContact C-N 3.28Å; Y434-N436 PolarHBondContact O-N 3.47Å; Y434-V437 PolarHBondContact O-N 3.33Å; Y434-L438 PolarHBondContact O-N 3.44Å
435	T	61.8	Low	56.6	Low	35 Å²	35	110.4 Å²	110.4	22%	0.215	56%	0.556	C	S	.	*	H	α-helix	trans	-61.7	-40.3	170.9	59.5	0	0	0	0	110.5	N431 L432 V437 L438 H439	N431-T435 PolarHBondContact O-N 3.23Å; L432-T435 VanDerWaalsContact CA-OG1 3.28Å; L432-T435 WeakPolarHBondContact CA-OG1 3.41Å; L432-T435 PolarHBondContact O-N 3.38Å; L432-T435 PolarHBondContact O-OG1 3.23Å; T435-V437 PolarHBondContact O-N 2.9Å; T435-L438 WeakPolarHBondContact O-CB 3.3Å; T435-L438 PolarHBondContact O-N 2.67Å; T435-H439 PolarHBondContact O-N 3.01Å; T435-H439 PolarHBondContact O-ND1 2.87Å
436	N	65.9	Low	57.6	Low	102 Å²	102	113.6 Å²	113.6	55%	0.545	55%	0.554	S	S	.	*	H	α-helix	trans	-69.8	-33.2	180	-65.7	10.7	0	0	0	112.1	L432 Y434 H439	L432-N436 WeakPolarHBondContact O-CB 3.36Å; L432-N436 PolarHBondContact O-N 3.31Å; L432-N436 PolarHBondContact O-OD1 2.82Å; L432-N436 VanDerWaalsContact O-OD1 3.11Å; Y434-N436 VanDerWaalsContact C-N 3.28Å; Y434-N436 PolarHBondContact O-N 3.47Å; N436-H439 PolarHBondContact O-N 3.48Å
437	V	67.5	Low	58.4	Low	72 Å²	72	118.8 Å²	118.8	44%	0.436	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-37.5	170.6	170	0	0	0	0	111.7	R433 Y434 T435 H439 Y440 Y443	R433-V437 WeakPolarHBondContact O-CG2 3.37Å; R433-V437 PolarHBondContact O-N 3.31Å; Y434-V437 PolarHBondContact O-N 3.33Å; T435-V437 PolarHBondContact O-N 2.9Å; V437-H439 VanDerWaalsContact C-N 3.35Å; V437-H439 PolarHBondContact O-N 3.46Å; V437-Y440 PolarHBondContact O-N 3.38Å; V437-Y443 HydrophobicContact CG1-CD2 4.4Å; V437-Y443 HydrophobicContact CG1-CE2 4.13Å; V437-Y443 VanDerWaalsContact O-CD2 3.23Å; V437-Y443 WeakPolarHBondContact O-CD2 3.25Å
438	L	60.9	Low	58.7	Low	59 Å²	59	116.8 Å²	116.8	31%	0.309	56%	0.555	S	S	.	*	H	α-helix	trans	-66.6	-31.8	177.8	-86.1	164.6	0	0	0	113.8	Y434 T435 Y440 F451 L455 L462	Y434-L438 PolarHBondContact O-N 3.44Å; T435-L438 WeakPolarHBondContact O-CB 3.3Å; T435-L438 PolarHBondContact O-N 2.67Å; L438-Y440 VanDerWaalsContact C-N 3.31Å; L438-Y440 PolarHBondContact O-N 2.87Å; L438-F451 HydrophobicContact CD2-CD1 4.49Å; L438-F451 HydrophobicContact CD2-CE1 3.82Å; L438-L455 HydrophobicContact CD1-CD1 4.43Å; L438-L462 HydrophobicContact CD1-CD2 4Å
439	H	61.2	Low	59.3	Low	136 Å²	136	118.2 Å²	118.2	63%	0.63	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-4.5	179.6	-69.3	88.2	0	0	0	114.1	T435 N436 V437	T435-H439 PolarHBondContact O-N 3.01Å; T435-H439 PolarHBondContact O-ND1 2.87Å; N436-H439 PolarHBondContact O-N 3.48Å; V437-H439 VanDerWaalsContact C-N 3.35Å; V437-H439 PolarHBondContact O-N 3.46Å
440	Y	50.1	Low	60.1	Low	135 Å²	135	109.6 Å²	109.6	53%	0.529	54%	0.544	S	S	.	.	S	Bend	trans	-64.5	131.8	175.1	-107.8	-99.5	0	0	0	111.2	V437 L438 K442 Y443 S444	V437-Y440 PolarHBondContact O-N 3.38Å; L438-Y440 VanDerWaalsContact C-N 3.31Å; L438-Y440 PolarHBondContact O-N 2.87Å; Y440-K442 PolarHBondContact O-N 2.85Å; Y440-Y443 PolarHBondContact O-N 3.46Å; Y440-S444 PolarHBondContact O-N 3.42Å
441	P	57.1	Low	60.5	Low	102 Å²	102	110.6 Å²	110.6	66%	0.662	55%	0.545	S	S	*	.	H	α-helix	trans	-55.5	-28.6	-177.2	-29.6	35.7	0	0	0	115	Y443 S445	P441-Y443 PolarHBondContact O-N 3.21Å; P441-S445 PolarHBondContact O-OG 3.04Å
442	K	58.8	Low	60.5	Low	98 Å²	98	111.1 Å²	111.1	43%	0.426	55%	0.545	S	S	.	.	H	α-helix	trans	-64.7	-20.3	176.7	-62.6	175.8	-174	170.6	0	113.5	Y440 F741	Y440-K442 PolarHBondContact O-N 2.85Å; K442-F741 HydrophobicContact CD-CE1 4.21Å; K442-F741 HydrophobicContact CD-CE2 4.18Å; K442-F741 HydrophobicContact CD-CZ 3.89Å; K442-F741 VanDerWaalsContact NZ-CE1 3.29Å
443	Y	55.1	Low	60.4	Low	141 Å²	141	112.9 Å²	112.9	55%	0.553	54%	0.543	S	S	*	.	H	α-helix	trans	-106.6	-35.4	177	-57.5	-68.4	0	0	0	112.9	V437 Y440 P441 S445 R446	V437-Y443 HydrophobicContact CG1-CD2 4.4Å; V437-Y443 HydrophobicContact CG1-CE2 4.13Å; V437-Y443 VanDerWaalsContact O-CD2 3.23Å; V437-Y443 WeakPolarHBondContact O-CD2 3.25Å; Y440-Y443 PolarHBondContact O-N 3.46Å; P441-Y443 PolarHBondContact O-N 3.21Å; Y443-S445 PolarHBondContact O-N 2.86Å; Y443-S445 VanDerWaalsContact O-N 3.1Å; Y443-R446 PolarHBondContact O-N 3.32Å
444	S	55.7	Low	60.5	Low	91 Å²	91	111.2 Å²	111.2	64%	0.636	54%	0.537	S	S	*	.	H	α-helix	trans	-50.7	-35.4	175.8	-178.5	0	0	0	0	113.4	Y440 R446	Y440-S444 PolarHBondContact O-N 3.42Å; S444-R446 PolarHBondContact O-N 3.32Å
445	S	56.3	Low	60.4	Low	93 Å²	93	105.1 Å²	105.1	65%	0.65	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.5	-179	51.1	0	0	0	0	115.9	P441 Y443	P441-S445 PolarHBondContact O-OG 3.04Å; Y443-S445 PolarHBondContact O-N 2.86Å; Y443-S445 VanDerWaalsContact O-N 3.1Å
446	R	55.8	Low	60.4	Low	188 Å²	188	109.8 Å²	109.8	71%	0.709	53%	0.532	S	S	*	.			trans	-125.4	92.8	179.4	-65.2	-166.5	-171.9	-152.5	4.6	112.4	Y443 S444 N448	Y443-R446 PolarHBondContact O-N 3.32Å; S444-R446 PolarHBondContact O-N 3.32Å; R446-N448 PolarHBondContact O-N 2.94Å
447	K	55.5	Low	60.1	Low	199 Å²	199	111.8 Å²	111.8	87%	0.865	54%	0.537	S	S	*	.			trans	-68.6	59.6	170.3	-64.1	-173.7	178.4	-177	0	112.7	S449	K447-S449 PolarHBondContact O-N 2.81Å
448	N	54.7	Low	59.9	Low	110 Å²	110	112.1 Å²	112.1	59%	0.588	54%	0.539	S	S	*	.			trans	-70.8	94.7	175.5	-81.8	3	0	0	0	109.6	R446 G450 F451	R446-N448 PolarHBondContact O-N 2.94Å; N448-G450 PolarHBondContact O-N 2.83Å; N448-F451 PolarHBondContact O-N 3.13Å
449	S	65.7	Low	60	Low	65 Å²	65	111.1 Å²	111.1	46%	0.455	54%	0.543	S	S	.	.	H	α-helix	trans	-57.3	-20.7	-173.5	73.2	0	0	0	0	114.9	K447 R453	K447-S449 PolarHBondContact O-N 2.81Å; S449-R453 WeakPolarHBondContact O-CB 3.5Å; S449-R453 PolarHBondContact O-N 3.4Å; S449-R453 PolarHBondContact OG-NH2 3.22Å; S449-R453 VanDerWaalsContact OG-NH2 3.14Å
450	G	69.7	Low	60	Low	33 Å²	33	107.2 Å²	107.2	34%	0.34	53%	0.527	S	S	.	.	H	α-helix	trans	-76.6	-13	173.2	0	0	0	0	0	115.3	N448 R454	N448-G450 PolarHBondContact O-N 2.83Å; G450-R454 PolarHBondContact O-NE 3.3Å; G450-R454 PolarHBondContact O-NH2 2.82Å
451	F	62.6	Low	60.7	Low	106 Å²	106	103.2 Å²	103.2	47%	0.465	51%	0.514	S	S	.	.	H	α-helix	trans	-85.4	-47.9	167.2	-175.3	-126.2	0	0	0	110.2	L438 N448 R453 R454 L455	L438-F451 HydrophobicContact CD2-CD1 4.49Å; L438-F451 HydrophobicContact CD2-CE1 3.82Å; N448-F451 PolarHBondContact O-N 3.13Å; F451-R453 VanDerWaalsContact C-N 3.34Å; F451-R453 PolarHBondContact O-N 3.46Å; F451-R454 PolarHBondContact O-N 2.79Å; F451-R454 VanDerWaalsContact O-N 3.14Å; F451-L455 HydrophobicContact CD1-CD1 3.82Å; F451-L455 HydrophobicContact CD2-CD1 4.46Å; F451-L455 HydrophobicContact CE1-CD1 3.58Å; F451-L455 HydrophobicContact CE1-CG 4.48Å; F451-L455 HydrophobicContact CE2-CD1 4.23Å; F451-L455 HydrophobicContact CE2-CD2 4.47Å; F451-L455 HydrophobicContact CE2-CG 4.29Å; F451-L455 HydrophobicContact CG-CD1 4.26Å; F451-L455 HydrophobicContact CZ-CD1 3.8Å; F451-L455 HydrophobicContact CZ-CD2 4.35Å; F451-L455 HydrophobicContact CZ-CG 4.27Å; F451-L455 WeakPolarHBondContact O-CG 3.07Å; F451-L455 PolarHBondContact O-N 3.39Å
452	E	64.4	Low	61.2	Low	89 Å²	89	101.1 Å²	101.1	42%	0.416	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-38.6	178.1	-161	-170.9	135.6	0	0	112.6	L455 K456 L462	E452-L455 PolarHBondContact O-N 3.2Å; E452-K456 WeakPolarHBondContact O-CG 3.41Å; E452-K456 PolarHBondContact O-N 3.06Å; E452-K456 VanDerWaalsContact OE1-CE 3.25Å; E452-K456 WeakPolarHBondContact OE1-CE 3.36Å; E452-K456 IonicContact OE1-NZ 3.89Å; E452-K456 PolarHBondContact OE1-NZ 3.4Å; E452-L462 HydrophobicContact CG-CD1 4.32Å
453	R	65.1	Low	61.9	Low	157 Å²	157	100 Å²	100	59%	0.592	50%	0.496	S	S	*	.	H	α-helix	trans	-58.7	-53.2	170.2	-102	178.8	-77.9	-179.5	-7	111.8	S449 F451 L455 K456 H457	S449-R453 WeakPolarHBondContact O-CB 3.5Å; S449-R453 PolarHBondContact O-N 3.4Å; S449-R453 PolarHBondContact OG-NH2 3.22Å; S449-R453 VanDerWaalsContact OG-NH2 3.14Å; F451-R453 VanDerWaalsContact C-N 3.34Å; F451-R453 PolarHBondContact O-N 3.46Å; R453-L455 VanDerWaalsContact C-N 3.27Å; R453-L455 PolarHBondContact O-N 2.87Å; R453-K456 PolarHBondContact O-N 2.88Å; R453-H457 PolarHBondContact O-CD2 3.22Å; R453-H457 PolarHBondContact O-N 3.33Å
454	R	64.7	Low	63	Low	173 Å²	173	95.8 Å²	95.8	65%	0.653	49%	0.49	S	S	*	.	H	α-helix	trans	-56.9	-41.2	-179.8	-81.2	-177.7	-75.5	-175.4	-2.2	112	G450 F451 H457 T458	G450-R454 PolarHBondContact O-NE 3.3Å; G450-R454 PolarHBondContact O-NH2 2.82Å; F451-R454 PolarHBondContact O-N 2.79Å; F451-R454 VanDerWaalsContact O-N 3.14Å; R454-H457 PolarHBondContact O-N 2.94Å; R454-T458 PolarHBondContact O-N 3.09Å; R454-T458 VanDerWaalsContact O-N 3.13Å
455	L	58.9	Low	64.2	Low	24 Å²	24	99 Å²	99	13%	0.126	49%	0.493	C	S	.	.	H	α-helix	trans	-62.6	-42.7	174.7	-70.8	168	0	0	0	112.9	L438 F451 E452 R453 H457 T458 L460 L462	L438-L455 HydrophobicContact CD1-CD1 4.43Å; F451-L455 HydrophobicContact CD1-CD1 3.82Å; F451-L455 HydrophobicContact CD2-CD1 4.46Å; F451-L455 HydrophobicContact CE1-CD1 3.58Å; F451-L455 HydrophobicContact CE1-CG 4.48Å; F451-L455 HydrophobicContact CE2-CD1 4.23Å; F451-L455 HydrophobicContact CE2-CD2 4.47Å; F451-L455 HydrophobicContact CE2-CG 4.29Å; F451-L455 HydrophobicContact CG-CD1 4.26Å; F451-L455 HydrophobicContact CZ-CD1 3.8Å; F451-L455 HydrophobicContact CZ-CD2 4.35Å; F451-L455 HydrophobicContact CZ-CG 4.27Å; F451-L455 WeakPolarHBondContact O-CG 3.07Å; F451-L455 PolarHBondContact O-N 3.39Å; E452-L455 PolarHBondContact O-N 3.2Å; R453-L455 VanDerWaalsContact C-N 3.27Å; R453-L455 PolarHBondContact O-N 2.87Å; L455-H457 VanDerWaalsContact C-N 3.27Å; L455-H457 PolarHBondContact O-N 3.39Å; L455-T458 WeakPolarHBondContact CA-OG1 3.37Å; L455-T458 PolarHBondContact O-N 3.22Å; L455-T458 PolarHBondContact O-OG1 3.18Å; L455-L460 HydrophobicContact CD2-CD1 4.46Å; L455-L462 HydrophobicContact CB-CD1 3.68Å; L455-L462 HydrophobicContact CB-CD2 4.01Å; L455-L462 HydrophobicContact CB-CG 4.3Å; L455-L462 HydrophobicContact CD1-CD1 3.89Å; L455-L462 HydrophobicContact CD1-CD2 3.85Å; L455-L462 HydrophobicContact CD2-CD2 4.26Å; L455-L462 HydrophobicContact CG-CD1 4.42Å; L455-L462 HydrophobicContact CG-CD2 4.27Å
456	K	61.9	Low	65.1	Low	133 Å²	133	96.4 Å²	96.4	58%	0.578	47%	0.474	S	S	*	.	H	α-helix	trans	-63.6	-29.6	174.5	-71.3	174.4	-174.6	173.4	0	113.1	E452 R453	E452-K456 WeakPolarHBondContact O-CG 3.41Å; E452-K456 PolarHBondContact O-N 3.06Å; E452-K456 VanDerWaalsContact OE1-CE 3.25Å; E452-K456 WeakPolarHBondContact OE1-CE 3.36Å; E452-K456 IonicContact OE1-NZ 3.89Å; E452-K456 PolarHBondContact OE1-NZ 3.4Å; R453-K456 PolarHBondContact O-N 2.88Å
457	H	60.8	Low	66.3	Low	144 Å²	144	89 Å²	89	67%	0.667	45%	0.45	S	S	*	.	H	α-helix	trans	-72.8	-27.4	170.3	-75.8	-86.8	0	0	0	113.3	R453 R454 L455 G459	R453-H457 PolarHBondContact O-CD2 3.22Å; R453-H457 PolarHBondContact O-N 3.33Å; R454-H457 PolarHBondContact O-N 2.94Å; L455-H457 VanDerWaalsContact C-N 3.27Å; L455-H457 PolarHBondContact O-N 3.39Å; H457-G459 PolarHBondContact O-N 3.43Å
458	T	63	Low	67.8	Low	78 Å²	78	84.7 Å²	84.7	48%	0.479	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	5.7	177	56.9	0	0	0	0	115.1	R454 L455 L460	R454-T458 PolarHBondContact O-N 3.09Å; R454-T458 VanDerWaalsContact O-N 3.13Å; L455-T458 WeakPolarHBondContact CA-OG1 3.37Å; L455-T458 PolarHBondContact O-N 3.22Å; L455-T458 PolarHBondContact O-OG1 3.18Å; T458-L460 PolarHBondContact O-N 3.42Å; T458-L460 WeakPolarHBondContact OG1-CG 3.35Å
459	G	63.1	Low	69.3	Low	38 Å²	38	88.5 Å²	88.5	39%	0.392	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	3.3	-179.1	0	0	0	0	0	115.1	P428 H457	P428-G459 WeakPolarHBondContact CB-O 3.42Å; H457-G459 PolarHBondContact O-N 3.43Å
460	L	61.2	Low	70.1	Confident	54 Å²	54	88.2 Å²	88.2	28%	0.283	44%	0.435	S	S	.	.			trans	-77.1	128.2	-176	-62.2	179.2	0	0	0	111.6	R429 L455 T458 L462	R429-L460 HydrophobicContact CB-CD2 4.09Å; R429-L460 WeakPolarHBondContact O-CD2 3.22Å; L455-L460 HydrophobicContact CD2-CD1 4.46Å; T458-L460 PolarHBondContact O-N 3.42Å; T458-L460 WeakPolarHBondContact OG1-CG 3.35Å; L460-L462 PolarHBondContact O-N 2.79Å
461	I	64.5	Low	71.1	Confident	52 Å²	52	90.2 Å²	90.2	27%	0.267	44%	0.438	S	S	.	.			trans	-68.2	125.2	168.4	-66.8	171.5	0	0	0	108.9	P428 D463 S466 T467 L470	P428-I461 HydrophobicContact CB-CB 4.34Å; P428-I461 HydrophobicContact CB-CD1 3.91Å; P428-I461 HydrophobicContact CB-CG1 3.71Å; P428-I461 HydrophobicContact CG-CD1 3.57Å; P428-I461 HydrophobicContact CG-CG1 3.88Å; I461-D463 WeakPolarHBondContact CG2-O 3.29Å; I461-S466 VanDerWaalsContact CG2-OG 3.23Å; I461-S466 WeakPolarHBondContact CG2-OG 3.49Å; I461-T467 WeakPolarHBondContact CG2-OG1 3.3Å; I461-L470 HydrophobicContact CD1-CD2 3.82Å
462	L	66.4	Low	72.4	Confident	57 Å²	57	93.6 Å²	93.6	30%	0.298	45%	0.447	S	S	.	.			trans	-104.4	-23.8	178.6	-57.2	179.3	0	0	0	113.7	L438 E452 L455 L460	L438-L462 HydrophobicContact CD1-CD2 4Å; E452-L462 HydrophobicContact CG-CD1 4.32Å; L455-L462 HydrophobicContact CB-CD1 3.68Å; L455-L462 HydrophobicContact CB-CD2 4.01Å; L455-L462 HydrophobicContact CB-CG 4.3Å; L455-L462 HydrophobicContact CD1-CD1 3.89Å; L455-L462 HydrophobicContact CD1-CD2 3.85Å; L455-L462 HydrophobicContact CD2-CD2 4.26Å; L455-L462 HydrophobicContact CG-CD1 4.42Å; L455-L462 HydrophobicContact CG-CD2 4.27Å; L460-L462 PolarHBondContact O-N 2.79Å
463	D	74.9	Confident	73.6	Confident	76 Å²	76	97.4 Å²	97.4	41%	0.406	46%	0.462	S	S	.	.			trans	-81.4	128.9	-179.5	155.3	51.7	0	0	0	110.3	I461 K465 S466 T467	I461-D463 WeakPolarHBondContact CG2-O 3.29Å; D463-K465 VanDerWaalsContact C-N 3.27Å; D463-K465 PolarHBondContact O-N 3.09Å; D463-K465 WeakPolarHBondContact OD1-CB 3.48Å; D463-K465 PolarHBondContact OD1-N 3.1Å; D463-S466 WeakPolarHBondContact CB-OG 3.43Å; D463-S466 PolarHBondContact O-N 2.69Å; D463-S466 PolarHBondContact O-OG 2.81Å; D463-S466 VanDerWaalsContact OD2-CB 3.3Å; D463-S466 WeakPolarHBondContact OD2-CB 3.41Å; D463-S466 PolarHBondContact OD2-N 3.03Å; D463-S466 PolarHBondContact OD2-OG 2.89Å; D463-T467 WeakPolarHBondContact O-CB 3.47Å; D463-T467 PolarHBondContact O-N 2.92Å; D463-T467 PolarHBondContact O-OG1 3.18Å
464	A	77.8	Confident	74.7	Confident	52 Å²	52	96.3 Å²	96.3	43%	0.43	46%	0.462	S	S	.	.	H	α-helix	trans	-62.8	-32.4	178.6	0	0	0	0	0	112.2	T467 L468	A464-T467 PolarHBondContact O-N 2.78Å; A464-L468 WeakPolarHBondContact O-CB 3.44Å; A464-L468 VanDerWaalsContact O-CG 3.25Å; A464-L468 WeakPolarHBondContact O-CG 3.49Å; A464-L468 PolarHBondContact O-N 3.29Å
465	K	81.4	Confident	76	Confident	158 Å²	158	92 Å²	92	69%	0.687	45%	0.452	S	S	*	.	H	α-helix	trans	-70.5	-44.4	-179.1	-65.3	-177	177.8	-178.9	0	111.8	D463 L468 R469	D463-K465 VanDerWaalsContact C-N 3.27Å; D463-K465 PolarHBondContact O-N 3.09Å; D463-K465 WeakPolarHBondContact OD1-CB 3.48Å; D463-K465 PolarHBondContact OD1-N 3.1Å; K465-L468 PolarHBondContact O-N 3Å; K465-R469 WeakPolarHBondContact O-CB 3.49Å; K465-R469 VanDerWaalsContact O-CG 3.31Å; K465-R469 WeakPolarHBondContact O-CG 3.24Å; K465-R469 PolarHBondContact O-N 3.44Å
466	S	75.8	Confident	77.5	Confident	38 Å²	38	94.8 Å²	94.8	27%	0.266	46%	0.464	S	S	.	.	H	α-helix	trans	-69.2	-35.2	173.1	43.6	0	0	0	0	112.3	I461 D463 R469 L470	I461-S466 VanDerWaalsContact CG2-OG 3.23Å; I461-S466 WeakPolarHBondContact CG2-OG 3.49Å; D463-S466 WeakPolarHBondContact CB-OG 3.43Å; D463-S466 PolarHBondContact O-N 2.69Å; D463-S466 PolarHBondContact O-OG 2.81Å; D463-S466 VanDerWaalsContact OD2-CB 3.3Å; D463-S466 WeakPolarHBondContact OD2-CB 3.41Å; D463-S466 PolarHBondContact OD2-N 3.03Å; D463-S466 PolarHBondContact OD2-OG 2.89Å; S466-R469 PolarHBondContact O-N 3.34Å; S466-L470 WeakPolarHBondContact O-CB 3.26Å; S466-L470 PolarHBondContact O-N 2.85Å
467	T	79.5	Confident	78.9	Confident	32 Å²	32	92.3 Å²	92.3	20%	0.196	46%	0.461	C	S	.	.	H	α-helix	trans	-57.7	-50.2	169.6	-59.8	0	0	0	0	111.4	L430 I461 D463 A464 R469 L470 L471	L430-T467 HydrophobicContact CD2-CG2 3.87Å; I461-T467 WeakPolarHBondContact CG2-OG1 3.3Å; D463-T467 WeakPolarHBondContact O-CB 3.47Å; D463-T467 PolarHBondContact O-N 2.92Å; D463-T467 PolarHBondContact O-OG1 3.18Å; A464-T467 PolarHBondContact O-N 2.78Å; T467-R469 PolarHBondContact O-N 3.48Å; T467-L470 PolarHBondContact O-N 3.21Å; T467-L471 WeakPolarHBondContact O-CB 3.19Å; T467-L471 PolarHBondContact O-N 2.9Å
468	L	87.1	Confident	80.3	Confident	110 Å²	110	90.4 Å²	90.4	58%	0.576	45%	0.452	S	S	*	.	H	α-helix	trans	-66.7	-33.9	178.3	-72.5	168.6	0	0	0	112.6	A464 K465 R472	A464-L468 WeakPolarHBondContact O-CB 3.44Å; A464-L468 VanDerWaalsContact O-CG 3.25Å; A464-L468 WeakPolarHBondContact O-CG 3.49Å; A464-L468 PolarHBondContact O-N 3.29Å; K465-L468 PolarHBondContact O-N 3Å; L468-R472 WeakPolarHBondContact O-CB 3.35Å; L468-R472 PolarHBondContact O-N 3.2Å
469	R	85.8	Confident	81.5	Confident	190 Å²	190	89.5 Å²	89.5	72%	0.717	45%	0.446	S	S	*	.	H	α-helix	trans	-65.3	-41.1	172.4	-77.5	170.6	172.7	169.9	-2.9	112.2	K465 S466 T467 R472 K473	K465-R469 WeakPolarHBondContact O-CB 3.49Å; K465-R469 VanDerWaalsContact O-CG 3.31Å; K465-R469 WeakPolarHBondContact O-CG 3.24Å; K465-R469 PolarHBondContact O-N 3.44Å; S466-R469 PolarHBondContact O-N 3.34Å; T467-R469 PolarHBondContact O-N 3.48Å; R469-R472 PolarHBondContact O-N 3Å; R469-K473 PolarHBondContact O-N 3.47Å
470	L	84.2	Confident	82.7	Confident	59 Å²	59	91.4 Å²	91.4	31%	0.309	45%	0.447	S	S	.	.	H	α-helix	trans	-67.6	-43.4	175.9	-177	60.7	0	0	0	111.3	P428 L430 I461 S466 T467 R472 K473 F474	P428-L470 HydrophobicContact CG-CD2 3.84Å; L430-L470 HydrophobicContact CD1-CD2 4.3Å; L430-L470 HydrophobicContact CD2-CD2 4.28Å; L430-L470 HydrophobicContact CG-CD2 4.35Å; I461-L470 HydrophobicContact CD1-CD2 3.82Å; S466-L470 WeakPolarHBondContact O-CB 3.26Å; S466-L470 PolarHBondContact O-N 2.85Å; T467-L470 PolarHBondContact O-N 3.21Å; L470-R472 VanDerWaalsContact C-N 3.34Å; L470-R472 PolarHBondContact O-N 2.81Å; L470-K473 PolarHBondContact O-N 2.84Å; L470-F474 PolarHBondContact O-N 3.47Å
471	L	89	Confident	84.1	Confident	74 Å²	74	96.4 Å²	96.4	39%	0.387	46%	0.462	S	S	.	.	H	α-helix	trans	-59.6	-43.2	174.1	-178	62	0	0	0	111.6	T467 F474 L475	T467-L471 WeakPolarHBondContact O-CB 3.19Å; T467-L471 PolarHBondContact O-N 2.9Å; L471-F474 PolarHBondContact O-N 3.38Å; L471-L475 HydrophobicContact CD1-CD1 3.91Å; L471-L475 HydrophobicContact CD1-CG 4.14Å; L471-L475 HydrophobicContact CG-CD1 3.94Å; L471-L475 HydrophobicContact CG-CG 4.49Å; L471-L475 WeakPolarHBondContact O-CG 3.45Å; L471-L475 PolarHBondContact O-N 3.47Å
472	R	90.6	Very high	85.3	Confident	177 Å²	177	98.4 Å²	98.4	67%	0.668	47%	0.473	S	S	*	.	H	α-helix	trans	-59.8	-47.5	172.8	-173	-178.3	-65.3	-175	-3.5	111.4	L468 R469 L470 F474 L475 Q476	L468-R472 WeakPolarHBondContact O-CB 3.35Å; L468-R472 PolarHBondContact O-N 3.2Å; R469-R472 PolarHBondContact O-N 3Å; L470-R472 VanDerWaalsContact C-N 3.34Å; L470-R472 PolarHBondContact O-N 2.81Å; R472-F474 PolarHBondContact O-N 3.01Å; R472-L475 PolarHBondContact O-N 2.81Å; R472-Q476 WeakPolarHBondContact O-CB 3.46Å; R472-Q476 PolarHBondContact O-N 3.33Å
473	K	89.3	Confident	86.3	Confident	169 Å²	169	101 Å²	101	74%	0.735	48%	0.482	S	S	*	.	H	α-helix	trans	-59.9	-33.7	177.5	-170.4	179.3	179	-175.4	0	112.4	R469 L470	R469-K473 PolarHBondContact O-N 3.47Å; L470-K473 PolarHBondContact O-N 2.84Å
474	F	89.4	Confident	87	Confident	135 Å²	135	100.9 Å²	100.9	59%	0.592	48%	0.482	S	S	*	.	H	α-helix	trans	-75.2	-38.3	176.7	-177	-94.9	0	0	0	113.3	L470 L471 R472 P477 F478	L470-F474 PolarHBondContact O-N 3.47Å; L471-F474 PolarHBondContact O-N 3.38Å; R472-F474 PolarHBondContact O-N 3.01Å; F474-P477 WeakPolarHBondContact O-CD 3.46Å; F474-F478 HydrophobicContact CE1-CE2 4.4Å; F474-F478 WeakPolarHBondContact O-CD2 3.45Å
475	L	92	Very high	87.5	Confident	83 Å²	83	103.8 Å²	103.8	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-82.6	-28.5	-178.7	-67.7	174.8	0	0	0	113.7	L471 R472 P477 F478 V479	L471-L475 HydrophobicContact CD1-CD1 3.91Å; L471-L475 HydrophobicContact CD1-CG 4.14Å; L471-L475 HydrophobicContact CG-CD1 3.94Å; L471-L475 HydrophobicContact CG-CG 4.49Å; L471-L475 WeakPolarHBondContact O-CG 3.45Å; L471-L475 PolarHBondContact O-N 3.47Å; R472-L475 PolarHBondContact O-N 2.81Å; L475-P477 VanDerWaalsContact C-CD 3.44Å; L475-F478 PolarHBondContact O-N 3.26Å; L475-F478 VanDerWaalsContact O-N 3.09Å; L475-V479 PolarHBondContact O-N 2.94Å; L475-V479 VanDerWaalsContact O-N 3.08Å
476	Q	89.9	Confident	87.9	Confident	82 Å²	82	100.4 Å²	100.4	38%	0.383	48%	0.476	S	S	.	.	H	α-helix	trans	-53.3	-40.2	-174.9	-162.3	69.5	60.7	0	0	114.5	R472 F478 V479 N480	R472-Q476 WeakPolarHBondContact O-CB 3.46Å; R472-Q476 PolarHBondContact O-N 3.33Å; Q476-F478 VanDerWaalsContact C-N 3.34Å; Q476-F478 PolarHBondContact O-N 3.24Å; Q476-V479 PolarHBondContact O-N 3.11Å; Q476-N480 PolarHBondContact NE2-OD1 3.05Å; Q476-N480 WeakPolarHBondContact O-CB 3.31Å; Q476-N480 PolarHBondContact O-N 3.43Å; Q476-N480 PolarHBondContact O-OD1 2.91Å; Q476-N480 VanDerWaalsContact O-OD1 3.09Å
477	P	90.6	Very high	88.4	Confident	80 Å²	80	99.6 Å²	99.6	52%	0.519	47%	0.468	S	S	.	.	H	α-helix	trans	-64	-35.5	178.3	-23.2	35.5	0	0	0	113.7	F474 L475 R481	F474-P477 WeakPolarHBondContact O-CD 3.46Å; L475-P477 VanDerWaalsContact C-CD 3.44Å; P477-R481 WeakPolarHBondContact O-CB 3.43Å; P477-R481 PolarHBondContact O-N 3.31Å; P477-R481 VanDerWaalsContact O-N 3.11Å
478	F	89.9	Confident	88.8	Confident	105 Å²	105	104.1 Å²	104.1	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-70.8	-48.6	176.1	-59.6	-86.5	0	0	0	110.4	F474 L475 Q476 N480 R481 D482	F474-F478 HydrophobicContact CE1-CE2 4.4Å; F474-F478 WeakPolarHBondContact O-CD2 3.45Å; L475-F478 PolarHBondContact O-N 3.26Å; L475-F478 VanDerWaalsContact O-N 3.09Å; Q476-F478 VanDerWaalsContact C-N 3.34Å; Q476-F478 PolarHBondContact O-N 3.24Å; F478-N480 VanDerWaalsContact C-N 3.3Å; F478-N480 PolarHBondContact O-N 2.86Å; F478-R481 WeakPolarHBondContact O-CB 3.37Å; F478-R481 PolarHBondContact O-N 3.15Å; F478-R481 VanDerWaalsContact O-N 3.11Å; F478-D482 VanDerWaalsContact O-CG 3.28Å; F478-D482 PolarHBondContact O-N 3.41Å
479	V	88.6	Confident	88.9	Confident	59 Å²	59	104.9 Å²	104.9	36%	0.358	48%	0.484	S	S	.	.	H	α-helix	trans	-57.7	-41.8	176.5	172.6	0	0	0	0	111.7	L475 Q476 D482 F483	L475-V479 PolarHBondContact O-N 2.94Å; L475-V479 VanDerWaalsContact O-N 3.08Å; Q476-V479 PolarHBondContact O-N 3.11Å; V479-D482 PolarHBondContact O-N 2.81Å; V479-F483 HydrophobicContact CG1-CD2 3.66Å; V479-F483 HydrophobicContact CG1-CE2 3.46Å; V479-F483 VanDerWaalsContact CG1-CE2 3.46Å; V479-F483 WeakPolarHBondContact O-CD2 3.45Å; V479-F483 PolarHBondContact O-N 3.36Å
480	N	89.6	Confident	89	Confident	77 Å²	77	101.7 Å²	101.7	41%	0.412	47%	0.472	S	S	.	.	H	α-helix	trans	-63.6	-45.2	175.5	-73.2	12.8	0	0	0	111.8	Q476 F478 D482 F483 D484	Q476-N480 PolarHBondContact NE2-OD1 3.05Å; Q476-N480 WeakPolarHBondContact O-CB 3.31Å; Q476-N480 PolarHBondContact O-N 3.43Å; Q476-N480 PolarHBondContact O-OD1 2.91Å; Q476-N480 VanDerWaalsContact O-OD1 3.09Å; F478-N480 VanDerWaalsContact C-N 3.3Å; F478-N480 PolarHBondContact O-N 2.86Å; N480-D482 VanDerWaalsContact C-N 3.32Å; N480-D482 PolarHBondContact O-N 3.32Å; N480-F483 PolarHBondContact O-N 3.35Å; N480-D484 WeakPolarHBondContact O-CB 3.33Å; N480-D484 PolarHBondContact O-N 2.67Å
481	R	90.9	Very high	89.2	Confident	160 Å²	160	100.1 Å²	100.1	60%	0.604	46%	0.464	S	S	*	.	H	α-helix	trans	-58.4	-44.6	176.9	171.9	-179.6	175.6	150.3	0.6	111.8	P477 F478 D484 Q485	P477-R481 WeakPolarHBondContact O-CB 3.43Å; P477-R481 PolarHBondContact O-N 3.31Å; P477-R481 VanDerWaalsContact O-N 3.11Å; F478-R481 WeakPolarHBondContact O-CB 3.37Å; F478-R481 PolarHBondContact O-N 3.15Å; F478-R481 VanDerWaalsContact O-N 3.11Å; R481-D484 PolarHBondContact O-N 2.89Å; R481-Q485 WeakPolarHBondContact O-CG 3.48Å; R481-Q485 PolarHBondContact O-N 3.05Å
482	D	89.6	Confident	89.1	Confident	94 Å²	94	100.5 Å²	100.5	50%	0.503	47%	0.466	S	S	.	.	H	α-helix	trans	-69.4	-38.3	-178.6	-60.5	-17.8	0	0	0	110.8	F478 V479 N480 Q485 L486	F478-D482 VanDerWaalsContact O-CG 3.28Å; F478-D482 PolarHBondContact O-N 3.41Å; V479-D482 PolarHBondContact O-N 2.81Å; N480-D482 VanDerWaalsContact C-N 3.32Å; N480-D482 PolarHBondContact O-N 3.32Å; D482-Q485 PolarHBondContact O-N 3.39Å; D482-L486 WeakPolarHBondContact O-CB 3.24Å; D482-L486 PolarHBondContact O-N 3.2Å
483	F	87.4	Confident	88.9	Confident	111 Å²	111	95.8 Å²	95.8	49%	0.487	45%	0.454	S	S	.	.	H	α-helix	trans	-63.1	-42.7	170.1	-82.4	-54.9	0	0	0	112.8	V479 N480 Q485 L486 I487	V479-F483 HydrophobicContact CG1-CD2 3.66Å; V479-F483 HydrophobicContact CG1-CE2 3.46Å; V479-F483 VanDerWaalsContact CG1-CE2 3.46Å; V479-F483 WeakPolarHBondContact O-CD2 3.45Å; V479-F483 PolarHBondContact O-N 3.36Å; N480-F483 PolarHBondContact O-N 3.35Å; F483-Q485 VanDerWaalsContact C-N 3.34Å; F483-Q485 PolarHBondContact O-N 3.02Å; F483-L486 PolarHBondContact O-N 2.75Å; F483-I487 WeakPolarHBondContact O-CB 3.32Å; F483-I487 WeakPolarHBondContact O-CD1 3.26Å; F483-I487 WeakPolarHBondContact O-CG1 3.45Å; F483-I487 PolarHBondContact O-N 3.45Å
484	D	87.9	Confident	88.8	Confident	74 Å²	74	93.8 Å²	93.8	40%	0.396	45%	0.446	S	S	.	.	H	α-helix	trans	-67.5	-34.5	179	-79.6	-35.3	0	0	0	112.2	N480 R481 K488 R520	N480-D484 WeakPolarHBondContact O-CB 3.33Å; N480-D484 PolarHBondContact O-N 2.67Å; R481-D484 PolarHBondContact O-N 2.89Å; D484-K488 VanDerWaalsContact O-CB 3.31Å; D484-K488 WeakPolarHBondContact O-CB 3.25Å; D484-K488 PolarHBondContact O-N 3.17Å; D484-R520 IonicContact OD1-CZ 2.72Å; D484-R520 IonicContact OD1-NH2 3.83Å; D484-R520 PolarHBondContact OD1-NH2 2.74Å
485	Q	89.6	Confident	88.7	Confident	113 Å²	113	88.9 Å²	88.9	53%	0.528	43%	0.425	S	S	.	.	H	α-helix	trans	-65.9	-44.6	170.7	-72.6	-175.3	0.3	0	0	112	R481 D482 F483 K488 K489	R481-Q485 WeakPolarHBondContact O-CG 3.48Å; R481-Q485 PolarHBondContact O-N 3.05Å; D482-Q485 PolarHBondContact O-N 3.39Å; F483-Q485 VanDerWaalsContact C-N 3.34Å; F483-Q485 PolarHBondContact O-N 3.02Å; Q485-K488 PolarHBondContact O-N 3.32Å; Q485-K489 PolarHBondContact O-N 2.8Å
486	L	89.2	Confident	88.4	Confident	87 Å²	87	88 Å²	88	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-62.6	-46.8	177.2	-175.8	65.6	0	0	0	111.6	D482 F483 K489 Y490	D482-L486 WeakPolarHBondContact O-CB 3.24Å; D482-L486 PolarHBondContact O-N 3.2Å; F483-L486 PolarHBondContact O-N 2.75Å; L486-K489 PolarHBondContact O-N 2.97Å; L486-Y490 HydrophobicContact CD1-CD2 4.14Å; L486-Y490 HydrophobicContact CD1-CE2 3.76Å; L486-Y490 HydrophobicContact CG-CD2 4.1Å; L486-Y490 HydrophobicContact CG-CE2 4.02Å; L486-Y490 WeakPolarHBondContact O-CD2 3.26Å; L486-Y490 PolarHBondContact O-N 3.03Å
487	I	86.9	Confident	88.3	Confident	20 Å²	20	88.9 Å²	88.9	10%	0.103	43%	0.428	C	S	.	.	H	α-helix	trans	-62.4	-46.7	177.2	-69.9	163.2	0	0	0	110	F483 K489 Y490 M491 R520 I524	F483-I487 WeakPolarHBondContact O-CB 3.32Å; F483-I487 WeakPolarHBondContact O-CD1 3.26Å; F483-I487 WeakPolarHBondContact O-CG1 3.45Å; F483-I487 PolarHBondContact O-N 3.45Å; I487-K489 VanDerWaalsContact C-N 3.31Å; I487-K489 PolarHBondContact O-N 3.44Å; I487-Y490 PolarHBondContact O-N 3.4Å; I487-M491 HydrophobicContact CG2-CE 3.99Å; I487-M491 HydrophobicContact CG2-CG 4.23Å; I487-M491 VanDerWaalsContact O-CG 3.25Å; I487-M491 WeakPolarHBondContact O-CG 3.39Å; I487-M491 PolarHBondContact O-N 2.81Å; I487-R520 HydrophobicContact CG2-CG 3.91Å; I487-I524 HydrophobicContact CD1-CD1 3.89Å; I487-I524 HydrophobicContact CD1-CG1 3.7Å
488	K	87.6	Confident	88.2	Confident	128 Å²	128	87.3 Å²	87.3	56%	0.557	42%	0.421	S	S	*	.	H	α-helix	trans	-56.8	-46.4	176.6	177.6	169.8	174.8	173.5	0	111.1	D484 Q485 Y490 M491 D492	D484-K488 VanDerWaalsContact O-CB 3.31Å; D484-K488 WeakPolarHBondContact O-CB 3.25Å; D484-K488 PolarHBondContact O-N 3.17Å; Q485-K488 PolarHBondContact O-N 3.32Å; K488-Y490 PolarHBondContact O-N 3.06Å; K488-M491 WeakPolarHBondContact O-CB 3.33Å; K488-M491 PolarHBondContact O-N 2.77Å; K488-M491 VanDerWaalsContact O-N 3.08Å; K488-D492 WeakPolarHBondContact CE-OD2 3.41Å; K488-D492 WeakPolarHBondContact CG-OD2 3.4Å; K488-D492 IonicContact NZ-OD2 3.77Å; K488-D492 PolarHBondContact O-N 2.78Å
489	K	89.1	Confident	88.1	Confident	126 Å²	126	82.8 Å²	82.8	55%	0.548	40%	0.402	S	S	.	.	H	α-helix	trans	-57.5	-46.4	176.7	-178.7	173.8	175.8	178.7	0	112.1	Q485 L486 I487 M491 D492 D493	Q485-K489 PolarHBondContact O-N 2.8Å; L486-K489 PolarHBondContact O-N 2.97Å; I487-K489 VanDerWaalsContact C-N 3.31Å; I487-K489 PolarHBondContact O-N 3.44Å; K489-M491 VanDerWaalsContact C-N 3.28Å; K489-M491 PolarHBondContact O-N 2.63Å; K489-D492 PolarHBondContact O-N 3.36Å; K489-D493 WeakPolarHBondContact CE-OD2 3.3Å; K489-D493 VanDerWaalsContact CG-OD2 3.27Å; K489-D493 WeakPolarHBondContact CG-OD2 2.95Å; K489-D493 IonicContact NZ-OD2 2.76Å; K489-D493 VanDerWaalsContact O-CB 3.26Å; K489-D493 WeakPolarHBondContact O-CB 3.18Å; K489-D493 VanDerWaalsContact O-CG 3.27Å; K489-D493 PolarHBondContact O-N 3.14Å
490	Y	88.6	Confident	88.1	Confident	122 Å²	122	83.2 Å²	83.2	48%	0.478	40%	0.402	S	S	.	.	H	α-helix	trans	-64.4	-31.1	176	-84.1	-70.5	0	0	0	113.6	L486 I487 K488 F494 I495	L486-Y490 HydrophobicContact CD1-CD2 4.14Å; L486-Y490 HydrophobicContact CD1-CE2 3.76Å; L486-Y490 HydrophobicContact CG-CD2 4.1Å; L486-Y490 HydrophobicContact CG-CE2 4.02Å; L486-Y490 WeakPolarHBondContact O-CD2 3.26Å; L486-Y490 PolarHBondContact O-N 3.03Å; I487-Y490 PolarHBondContact O-N 3.4Å; K488-Y490 PolarHBondContact O-N 3.06Å; Y490-F494 AromaticContact CD1-CD2 3.73Å; Y490-F494 HydrophobicContact CD1-CD2 3.73Å; Y490-F494 AromaticContact CD1-CE2 3.82Å; Y490-F494 HydrophobicContact CD1-CE2 3.82Å; Y490-F494 HydrophobicContact CE1-CD2 4.31Å; Y490-F494 AromaticContact CE1-CE2 3.97Å; Y490-F494 HydrophobicContact CE1-CE2 3.97Å; Y490-F494 PolarHBondContact O-N 2.63Å; Y490-I495 PolarHBondContact O-N 3Å
491	M	86.9	Confident	88	Confident	26 Å²	26	83.9 Å²	83.9	13%	0.128	41%	0.406	C	S	.	.	I	π-helix	trans	-67	-53.3	173.2	-64.4	-71	152.3	0	0	110.5	I487 K488 K489 I495 L496 F519 R520 L523	I487-M491 HydrophobicContact CG2-CE 3.99Å; I487-M491 HydrophobicContact CG2-CG 4.23Å; I487-M491 VanDerWaalsContact O-CG 3.25Å; I487-M491 WeakPolarHBondContact O-CG 3.39Å; I487-M491 PolarHBondContact O-N 2.81Å; K488-M491 WeakPolarHBondContact O-CB 3.33Å; K488-M491 PolarHBondContact O-N 2.77Å; K488-M491 VanDerWaalsContact O-N 3.08Å; K489-M491 VanDerWaalsContact C-N 3.28Å; K489-M491 PolarHBondContact O-N 2.63Å; M491-I495 HydrophobicContact CE-CD1 3.63Å; M491-I495 HydrophobicContact CG-CD1 4.45Å; M491-I495 PolarHBondContact O-N 2.77Å; M491-I495 HydrophobicContact SD-CB 4.26Å; M491-I495 HydrophobicContact SD-CD1 3.55Å; M491-I495 VanDerWaalsContact SD-CD1 3.55Å; M491-I495 HydrophobicContact SD-CG2 4.18Å; M491-L496 VanDerWaalsContact O-CB 3.32Å; M491-L496 WeakPolarHBondContact O-CB 3.38Å; M491-L496 PolarHBondContact O-N 2.91Å; M491-F519 HydrophobicContact CE-CD1 4.11Å; M491-F519 HydrophobicContact CE-CE1 4.34Å; M491-R520 HydrophobicContact CE-CB 3.94Å; M491-R520 HydrophobicContact CE-CG 4.26Å; M491-L523 HydrophobicContact CE-CD2 3.92Å
492	D	87.2	Confident	87.8	Confident	82 Å²	82	79.8 Å²	79.8	44%	0.439	40%	0.395	S	S	.	.	I	π-helix	trans	-64.2	-46.8	-177.1	-62.6	-11.9	0	0	0	112	K488 K489	K488-D492 WeakPolarHBondContact CE-OD2 3.41Å; K488-D492 WeakPolarHBondContact CG-OD2 3.4Å; K488-D492 IonicContact NZ-OD2 3.77Å; K488-D492 PolarHBondContact O-N 2.78Å; K489-D492 PolarHBondContact O-N 3.36Å
493	D	86.8	Confident	87.9	Confident	79 Å²	79	78.3 Å²	78.3	42%	0.422	38%	0.383	S	S	.	.	I	π-helix	trans	-72.2	-37.2	-173	-72.9	-1.8	0	0	0	114	K489	K489-D493 WeakPolarHBondContact CE-OD2 3.3Å; K489-D493 VanDerWaalsContact CG-OD2 3.27Å; K489-D493 WeakPolarHBondContact CG-OD2 2.95Å; K489-D493 IonicContact NZ-OD2 2.76Å; K489-D493 VanDerWaalsContact O-CB 3.26Å; K489-D493 WeakPolarHBondContact O-CB 3.18Å; K489-D493 VanDerWaalsContact O-CG 3.27Å; K489-D493 PolarHBondContact O-N 3.14Å
494	F	86.6	Confident	87.9	Confident	126 Å²	126	79.2 Å²	79.2	55%	0.553	39%	0.393	S	S	*	.	I	π-helix	trans	-126	-47.4	-167.8	-59.3	-83.6	0	0	0	113.8	Y490 A498	Y490-F494 AromaticContact CD1-CD2 3.73Å; Y490-F494 HydrophobicContact CD1-CD2 3.73Å; Y490-F494 AromaticContact CD1-CE2 3.82Å; Y490-F494 HydrophobicContact CD1-CE2 3.82Å; Y490-F494 HydrophobicContact CE1-CD2 4.31Å; Y490-F494 AromaticContact CE1-CE2 3.97Å; Y490-F494 HydrophobicContact CE1-CE2 3.97Å; Y490-F494 PolarHBondContact O-N 2.63Å; F494-A498 PolarHBondContact O-N 2.95Å
495	I	87.4	Confident	87.8	Confident	32 Å²	32	81.5 Å²	81.5	16%	0.164	41%	0.409	C	S	.	.	I	π-helix	trans	-81	-40.1	-167.8	-61.4	157.3	0	0	0	110.4	Y490 M491 L497 A498 V499 F519	Y490-I495 PolarHBondContact O-N 3Å; M491-I495 HydrophobicContact CE-CD1 3.63Å; M491-I495 HydrophobicContact CG-CD1 4.45Å; M491-I495 PolarHBondContact O-N 2.77Å; M491-I495 HydrophobicContact SD-CB 4.26Å; M491-I495 HydrophobicContact SD-CD1 3.55Å; M491-I495 VanDerWaalsContact SD-CD1 3.55Å; M491-I495 HydrophobicContact SD-CG2 4.18Å; I495-L497 VanDerWaalsContact C-N 3.31Å; I495-L497 PolarHBondContact O-N 3.18Å; I495-A498 PolarHBondContact O-N 3.5Å; I495-V499 HydrophobicContact CG2-CG2 4.28Å; I495-V499 WeakPolarHBondContact O-CB 3.27Å; I495-V499 VanDerWaalsContact O-CG2 3.32Å; I495-V499 WeakPolarHBondContact O-CG2 3.14Å; I495-V499 PolarHBondContact O-N 3.47Å; I495-F519 HydrophobicContact CD1-CD1 4.3Å; I495-F519 HydrophobicContact CD1-CE1 3.57Å; I495-F519 HydrophobicContact CD1-CZ 4.39Å; I495-F519 HydrophobicContact CG1-CE1 4.19Å; I495-F519 HydrophobicContact CG2-CE1 4.44Å
496	L	86.6	Confident	87.5	Confident	64 Å²	64	82 Å²	82	34%	0.335	42%	0.415	S	S	.	.	H	α-helix	trans	-67.6	-34.1	178.1	-165.5	64.9	0	0	0	111.3	M491 V499 N500	M491-L496 VanDerWaalsContact O-CB 3.32Å; M491-L496 WeakPolarHBondContact O-CB 3.38Å; M491-L496 PolarHBondContact O-N 2.91Å; L496-V499 PolarHBondContact O-N 3.26Å; L496-N500 WeakPolarHBondContact O-CB 3.13Å; L496-N500 PolarHBondContact O-N 3.47Å; L496-N500 PolarHBondContact O-ND2 2.84Å; L496-N500 PolarHBondContact O-OD1 3.09Å
497	L	87.3	Confident	87.2	Confident	102 Å²	102	79.7 Å²	79.7	53%	0.534	41%	0.412	S	S	.	.	H	α-helix	trans	-61.1	-46.3	170.4	-177.5	61.1	0	0	0	111.5	I495 N500 N501	I495-L497 VanDerWaalsContact C-N 3.31Å; I495-L497 PolarHBondContact O-N 3.18Å; L497-N500 PolarHBondContact O-N 2.89Å; L497-N501 PolarHBondContact O-N 2.68Å; L497-N501 PolarHBondContact O-OD1 3.33Å
498	A	87.7	Confident	86.9	Confident	47 Å²	47	86.1 Å²	86.1	39%	0.388	44%	0.442	S	S	.	.	H	α-helix	trans	-65.6	-39.7	175.3	0	0	0	0	0	112.9	F494 I495 N501 I502	F494-A498 PolarHBondContact O-N 2.95Å; I495-A498 PolarHBondContact O-N 3.5Å; A498-N501 PolarHBondContact O-N 3.46Å; A498-I502 WeakPolarHBondContact O-CD1 3.3Å; A498-I502 VanDerWaalsContact O-CG1 3.22Å; A498-I502 WeakPolarHBondContact O-CG1 3.25Å; A498-I502 PolarHBondContact O-N 2.95Å
499	V	88.1	Confident	86.6	Confident	10 Å²	10	87.9 Å²	87.9	6%	0.061	45%	0.452	C	S	.	.	H	α-helix	trans	-65.6	-40.2	176.9	165.4	0	0	0	0	111.6	I495 L496 I502 R503 V511 L516	I495-V499 HydrophobicContact CG2-CG2 4.28Å; I495-V499 WeakPolarHBondContact O-CB 3.27Å; I495-V499 VanDerWaalsContact O-CG2 3.32Å; I495-V499 WeakPolarHBondContact O-CG2 3.14Å; I495-V499 PolarHBondContact O-N 3.47Å; L496-V499 PolarHBondContact O-N 3.26Å; V499-I502 PolarHBondContact O-N 2.96Å; V499-R503 HydrophobicContact CG1-CG 4.49Å; V499-R503 WeakPolarHBondContact O-CB 3.47Å; V499-R503 WeakPolarHBondContact O-CG 3.34Å; V499-R503 PolarHBondContact O-N 3.46Å; V499-V511 HydrophobicContact CG1-CB 4.23Å; V499-V511 HydrophobicContact CG1-CG1 4.45Å; V499-V511 HydrophobicContact CG2-CG1 4.31Å; V499-L516 HydrophobicContact CG1-CD1 4.24Å; V499-L516 HydrophobicContact CG2-CD1 4.29Å; V499-L516 HydrophobicContact CG2-CG 4.41Å
500	N	88.3	Confident	86.3	Confident	67 Å²	67	84.1 Å²	84.1	36%	0.358	44%	0.441	S	S	.	.	H	α-helix	trans	-63.4	-51.2	174.9	-68.6	-9.6	0	0	0	110.1	L496 L497 I502 R503 D504	L496-N500 WeakPolarHBondContact O-CB 3.13Å; L496-N500 PolarHBondContact O-N 3.47Å; L496-N500 PolarHBondContact O-ND2 2.84Å; L496-N500 PolarHBondContact O-OD1 3.09Å; L497-N500 PolarHBondContact O-N 2.89Å; N500-I502 PolarHBondContact O-N 3.43Å; N500-I502 VanDerWaalsContact O-N 3.11Å; N500-R503 CarbonylContact O-C 3.55Å; N500-R503 WeakPolarHBondContact O-CA 3.37Å; N500-R503 PolarHBondContact O-N 2.88Å; N500-D504 PolarHBondContact O-N 2.81Å
501	N	87.5	Confident	86.1	Confident	92 Å²	92	79.5 Å²	79.5	49%	0.492	43%	0.425	S	S	.	.	H	α-helix	trans	-55.2	-34.3	175.7	-65.1	-3.3	0	0	0	113.1	L497 A498 V505	L497-N501 PolarHBondContact O-N 2.68Å; L497-N501 PolarHBondContact O-OD1 3.33Å; A498-N501 PolarHBondContact O-N 3.46Å; N501-V505 WeakPolarHBondContact O-CG2 3.33Å; N501-V505 PolarHBondContact O-N 3.04Å
502	I	88	Confident	86	Confident	73 Å²	73	80.3 Å²	80.3	37%	0.374	43%	0.434	S	S	.	.	H	α-helix	trans	-72.6	-42.2	174.7	-68.2	163	0	0	0	111.2	A498 V499 N500 D504 V505 L506 V511	A498-I502 WeakPolarHBondContact O-CD1 3.3Å; A498-I502 VanDerWaalsContact O-CG1 3.22Å; A498-I502 WeakPolarHBondContact O-CG1 3.25Å; A498-I502 PolarHBondContact O-N 2.95Å; V499-I502 PolarHBondContact O-N 2.96Å; N500-I502 PolarHBondContact O-N 3.43Å; N500-I502 VanDerWaalsContact O-N 3.11Å; I502-D504 VanDerWaalsContact C-N 3.34Å; I502-V505 PolarHBondContact O-N 3.1Å; I502-L506 HydrophobicContact CG2-CD1 4.17Å; I502-L506 WeakPolarHBondContact O-CB 3.23Å; I502-L506 PolarHBondContact O-N 3.42Å; I502-V511 HydrophobicContact CB-CG2 4.23Å; I502-V511 HydrophobicContact CG2-CG2 3.61Å
503	R	90.8	Very high	85.9	Confident	64 Å²	64	82.4 Å²	82.4	24%	0.242	44%	0.441	C	S	.	.	H	α-helix	trans	-66.1	-33.4	176.2	-75.5	178	173.9	155.8	1.3	113.1	V499 N500 V505 G507 E508 V511	V499-R503 HydrophobicContact CG1-CG 4.49Å; V499-R503 WeakPolarHBondContact O-CB 3.47Å; V499-R503 WeakPolarHBondContact O-CG 3.34Å; V499-R503 PolarHBondContact O-N 3.46Å; N500-R503 CarbonylContact O-C 3.55Å; N500-R503 WeakPolarHBondContact O-CA 3.37Å; N500-R503 PolarHBondContact O-N 2.88Å; R503-V505 VanDerWaalsContact C-N 3.29Å; R503-V505 PolarHBondContact O-N 3.49Å; R503-G507 WeakPolarHBondContact CA-O 3.48Å; R503-G507 CarbonylContact O-C 3.57Å; R503-G507 WeakPolarHBondContact O-CA 3.5Å; R503-G507 PolarHBondContact O-N 2.91Å; R503-E508 PolarHBondContact NE-O 3.29Å; R503-V511 PolarHBondContact NE-O 3.08Å; R503-V511 PolarHBondContact NH2-O 3.38Å
504	D	87.5	Confident	86	Confident	130 Å²	130	83.5 Å²	83.5	70%	0.695	45%	0.447	S	S	*	.	H	α-helix	trans	-69.2	-29.2	176.7	-62.1	-26.7	0	0	0	111.7	N500 I502	N500-D504 PolarHBondContact O-N 2.81Å; I502-D504 VanDerWaalsContact C-N 3.34Å
505	V	85.9	Confident	86	Confident	121 Å²	121	80.5 Å²	80.5	73%	0.733	44%	0.436	S	S	*	.	H	α-helix	trans	-94.6	-35.5	-179.1	174.2	0	0	0	0	113.2	N501 I502 R503	N501-V505 WeakPolarHBondContact O-CG2 3.33Å; N501-V505 PolarHBondContact O-N 3.04Å; I502-V505 PolarHBondContact O-N 3.1Å; R503-V505 VanDerWaalsContact C-N 3.29Å; R503-V505 PolarHBondContact O-N 3.49Å
506	L	84	Confident	86	Confident	125 Å²	125	80 Å²	80	65%	0.654	43%	0.434	S	S	*	.	H	α-helix	trans	-115.7	7	-174.1	-59.6	-178.7	0	0	0	113.9	I502	I502-L506 HydrophobicContact CG2-CD1 4.17Å; I502-L506 WeakPolarHBondContact O-CB 3.23Å; I502-L506 PolarHBondContact O-N 3.42Å
507	G	82.4	Confident	86	Confident	38 Å²	38	79.5 Å²	79.5	39%	0.392	43%	0.434	S	S	.	.			trans	83.2	157.4	-177.1	0	0	0	0	0	113.8	R503 Q509 S510	R503-G507 WeakPolarHBondContact CA-O 3.48Å; R503-G507 CarbonylContact O-C 3.57Å; R503-G507 WeakPolarHBondContact O-CA 3.5Å; R503-G507 PolarHBondContact O-N 2.91Å; G507-Q509 PolarHBondContact O-N 3.39Å; G507-S510 VanDerWaalsContact O-CB 3.25Å; G507-S510 WeakPolarHBondContact O-CB 3.39Å; G507-S510 PolarHBondContact O-N 2.9Å; G507-S510 PolarHBondContact O-OG 3.36Å
508	E	81.6	Confident	86.1	Confident	155 Å²	155	79.7 Å²	79.7	72%	0.724	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-52.5	-33.5	-173.3	-60.6	-176.8	157.4	0	0	114.5	R503 S510	R503-E508 PolarHBondContact NE-O 3.29Å; E508-S510 VanDerWaalsContact C-N 3.32Å; E508-S510 PolarHBondContact O-N 2.87Å
509	Q	79.8	Confident	86.1	Confident	165 Å²	165	82.2 Å²	82.2	77%	0.771	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-81.6	-6.9	-175.7	-53.9	-58.1	-32	0	0	113.8	G507 V511	G507-Q509 PolarHBondContact O-N 3.39Å; Q509-V511 PolarHBondContact O-N 3.19Å
510	S	83.5	Confident	86	Confident	47 Å²	47	86.5 Å²	86.5	33%	0.329	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-62	-24.9	-178.3	56.6	0	0	0	0	114.4	G507 E508	G507-S510 VanDerWaalsContact O-CB 3.25Å; G507-S510 WeakPolarHBondContact O-CB 3.39Å; G507-S510 PolarHBondContact O-N 2.9Å; G507-S510 PolarHBondContact O-OG 3.36Å; E508-S510 VanDerWaalsContact C-N 3.32Å; E508-S510 PolarHBondContact O-N 2.87Å
511	V	84.4	Confident	85.9	Confident	24 Å²	24	89.1 Å²	89.1	15%	0.145	46%	0.458	C	S	.	.	S	Bend	trans	-137.2	112.9	173.9	-163.4	0	0	0	0	109.2	V499 I502 R503 Q509 D515 L516	V499-V511 HydrophobicContact CG1-CB 4.23Å; V499-V511 HydrophobicContact CG1-CG1 4.45Å; V499-V511 HydrophobicContact CG2-CG1 4.31Å; I502-V511 HydrophobicContact CB-CG2 4.23Å; I502-V511 HydrophobicContact CG2-CG2 3.61Å; R503-V511 PolarHBondContact NE-O 3.08Å; R503-V511 PolarHBondContact NH2-O 3.38Å; Q509-V511 PolarHBondContact O-N 3.19Å; V511-D515 HydrophobicContact CG1-CB 4.35Å; V511-L516 HydrophobicContact CB-CD1 4.49Å; V511-L516 HydrophobicContact CG1-CD1 3.62Å
512	S	85.4	Confident	85.9	Confident	43 Å²	43	87.5 Å²	87.5	30%	0.301	45%	0.454	S	S	.	.			trans	-85.3	158	178.8	84	0	0	0	0	112.4	N514 D515 L516	S512-N514 PolarHBondContact O-N 3.42Å; S512-N514 WeakPolarHBondContact OG-CB 3.17Å; S512-N514 PolarHBondContact OG-N 3.22Å; S512-D515 WeakPolarHBondContact CB-OD2 3.2Å; S512-D515 PolarHBondContact N-OD2 2.87Å; S512-D515 WeakPolarHBondContact O-CA 3.35Å; S512-D515 WeakPolarHBondContact O-CB 3.25Å; S512-D515 PolarHBondContact O-N 3.21Å; S512-D515 PolarHBondContact OG-N 3.04Å; S512-D515 PolarHBondContact OG-OD2 2.84Å; S512-L516 VanDerWaalsContact O-CD1 3.24Å; S512-L516 WeakPolarHBondContact O-CD1 3.38Å; S512-L516 PolarHBondContact O-N 2.79Å; S512-L516 VanDerWaalsContact O-N 3.1Å
513	E	84.3	Confident	85.8	Confident	127 Å²	127	87.2 Å²	87.2	59%	0.593	45%	0.453	S	S	*	.	H	α-helix	trans	-59.8	-26.7	173.7	-171.3	58.6	-157.8	0	0	112.5	D515 T517	E513-D515 VanDerWaalsContact C-N 3.28Å; E513-D515 PolarHBondContact O-N 3.42Å; E513-T517 WeakPolarHBondContact O-CB 3.35Å; E513-T517 PolarHBondContact O-N 3.33Å; E513-T517 PolarHBondContact O-OG1 2.99Å
514	N	88.1	Confident	85.6	Confident	101 Å²	101	87.9 Å²	87.9	54%	0.54	46%	0.46	S	S	.	.	H	α-helix	trans	-68.3	-30.2	173.6	-163	23.7	0	0	0	111.3	S512 T517 K518	S512-N514 PolarHBondContact O-N 3.42Å; S512-N514 WeakPolarHBondContact OG-CB 3.17Å; S512-N514 PolarHBondContact OG-N 3.22Å; N514-T517 PolarHBondContact O-N 3.23Å; N514-K518 VanDerWaalsContact O-CG 3.25Å; N514-K518 WeakPolarHBondContact O-CG 3.43Å; N514-K518 PolarHBondContact O-N 3.28Å
515	D	87.6	Confident	85.5	Confident	63 Å²	63	87.9 Å²	87.9	34%	0.337	46%	0.456	S	S	.	.	H	α-helix	trans	-81.4	-35.2	176.9	-54.8	-54.5	0	0	0	112.1	V511 S512 E513 T517 K518 F519	V511-D515 HydrophobicContact CG1-CB 4.35Å; S512-D515 WeakPolarHBondContact CB-OD2 3.2Å; S512-D515 PolarHBondContact N-OD2 2.87Å; S512-D515 WeakPolarHBondContact O-CA 3.35Å; S512-D515 WeakPolarHBondContact O-CB 3.25Å; S512-D515 PolarHBondContact O-N 3.21Å; S512-D515 PolarHBondContact OG-N 3.04Å; S512-D515 PolarHBondContact OG-OD2 2.84Å; E513-D515 VanDerWaalsContact C-N 3.28Å; E513-D515 PolarHBondContact O-N 3.42Å; D515-T517 VanDerWaalsContact C-N 3.26Å; D515-T517 PolarHBondContact O-N 3.42Å; D515-K518 PolarHBondContact O-N 2.88Å; D515-K518 IonicContact OD1-NZ 2.68Å; D515-K518 PolarHBondContact OD1-NZ 2.93Å; D515-F519 VanDerWaalsContact O-CB 3.3Å; D515-F519 WeakPolarHBondContact O-CB 3.44Å; D515-F519 PolarHBondContact O-N 2.81Å
516	L	87.3	Confident	85.5	Confident	21 Å²	21	90.7 Å²	90.7	11%	0.11	45%	0.453	C	S	.	.	H	α-helix	trans	-59.6	-40.1	165.2	-80.1	80.8	0	0	0	110.7	V499 V511 S512 F519 R520	V499-L516 HydrophobicContact CG1-CD1 4.24Å; V499-L516 HydrophobicContact CG2-CD1 4.29Å; V499-L516 HydrophobicContact CG2-CG 4.41Å; V511-L516 HydrophobicContact CB-CD1 4.49Å; V511-L516 HydrophobicContact CG1-CD1 3.62Å; S512-L516 VanDerWaalsContact O-CD1 3.24Å; S512-L516 WeakPolarHBondContact O-CD1 3.38Å; S512-L516 PolarHBondContact O-N 2.79Å; S512-L516 VanDerWaalsContact O-N 3.1Å; L516-F519 PolarHBondContact O-N 2.79Å; L516-R520 WeakPolarHBondContact O-CB 3.35Å; L516-R520 PolarHBondContact O-N 3.1Å
517	T	86.7	Confident	85.4	Confident	55 Å²	55	86.8 Å²	86.8	34%	0.337	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-46.8	176.8	-62.2	0	0	0	0	111.8	E513 N514 D515 F519 R520 Q521	E513-T517 WeakPolarHBondContact O-CB 3.35Å; E513-T517 PolarHBondContact O-N 3.33Å; E513-T517 PolarHBondContact O-OG1 2.99Å; N514-T517 PolarHBondContact O-N 3.23Å; D515-T517 VanDerWaalsContact C-N 3.26Å; D515-T517 PolarHBondContact O-N 3.42Å; T517-F519 VanDerWaalsContact C-N 3.32Å; T517-F519 PolarHBondContact O-N 2.82Å; T517-R520 PolarHBondContact O-N 3.07Å; T517-Q521 WeakPolarHBondContact O-CG 3.48Å; T517-Q521 PolarHBondContact O-N 2.63Å
518	K	88.3	Confident	85.4	Confident	105 Å²	105	87 Å²	87	46%	0.457	44%	0.437	S	S	.	.	H	α-helix	trans	-59.5	-41.9	171.8	-69.2	165	-157	164.4	0	111.6	N514 D515 Q521 S522	N514-K518 VanDerWaalsContact O-CG 3.25Å; N514-K518 WeakPolarHBondContact O-CG 3.43Å; N514-K518 PolarHBondContact O-N 3.28Å; D515-K518 PolarHBondContact O-N 2.88Å; D515-K518 IonicContact OD1-NZ 2.68Å; D515-K518 PolarHBondContact OD1-NZ 2.93Å; K518-Q521 PolarHBondContact O-N 3.3Å; K518-S522 WeakPolarHBondContact O-CB 3.25Å; K518-S522 PolarHBondContact O-N 3.25Å
519	F	87.9	Confident	85.6	Confident	100 Å²	100	83 Å²	83	44%	0.439	42%	0.423	S	S	.	.	H	α-helix	trans	-62.4	-46.2	177.7	-177.2	-85	0	0	0	111.2	M491 I495 D515 L516 T517 Q521 S522 L523	M491-F519 HydrophobicContact CE-CD1 4.11Å; M491-F519 HydrophobicContact CE-CE1 4.34Å; I495-F519 HydrophobicContact CD1-CD1 4.3Å; I495-F519 HydrophobicContact CD1-CE1 3.57Å; I495-F519 HydrophobicContact CD1-CZ 4.39Å; I495-F519 HydrophobicContact CG1-CE1 4.19Å; I495-F519 HydrophobicContact CG2-CE1 4.44Å; D515-F519 VanDerWaalsContact O-CB 3.3Å; D515-F519 WeakPolarHBondContact O-CB 3.44Å; D515-F519 PolarHBondContact O-N 2.81Å; L516-F519 PolarHBondContact O-N 2.79Å; T517-F519 VanDerWaalsContact C-N 3.32Å; T517-F519 PolarHBondContact O-N 2.82Å; F519-Q521 PolarHBondContact O-N 3.3Å; F519-S522 PolarHBondContact O-N 3.39Å; F519-L523 HydrophobicContact CE1-CB 4.44Å; F519-L523 HydrophobicContact CE1-CD2 4.3Å; F519-L523 WeakPolarHBondContact O-CB 3.32Å; F519-L523 PolarHBondContact O-N 3.5Å
520	R	85.9	Confident	85.6	Confident	100 Å²	100	85.2 Å²	85.2	38%	0.377	42%	0.424	S	S	.	.	H	α-helix	trans	-58.1	-44.6	174	178.7	173	174.7	-175.4	-0.1	111.8	D484 I487 M491 L516 T517 L523 I524	D484-R520 IonicContact OD1-CZ 2.72Å; D484-R520 IonicContact OD1-NH2 3.83Å; D484-R520 PolarHBondContact OD1-NH2 2.74Å; I487-R520 HydrophobicContact CG2-CG 3.91Å; M491-R520 HydrophobicContact CE-CB 3.94Å; M491-R520 HydrophobicContact CE-CG 4.26Å; L516-R520 WeakPolarHBondContact O-CB 3.35Å; L516-R520 PolarHBondContact O-N 3.1Å; T517-R520 PolarHBondContact O-N 3.07Å; R520-L523 PolarHBondContact O-N 2.93Å; R520-I524 HydrophobicContact CG-CD1 3.98Å; R520-I524 WeakPolarHBondContact O-CD1 3.27Å; R520-I524 VanDerWaalsContact O-CG1 3.24Å; R520-I524 WeakPolarHBondContact O-CG1 3.18Å; R520-I524 PolarHBondContact O-N 3.14Å
521	Q	86.3	Confident	85.2	Confident	122 Å²	122	91.5 Å²	91.5	57%	0.57	44%	0.442	S	S	*	.	H	α-helix	trans	-62.6	-44.2	175.8	-69.5	173.3	15.2	0	0	112	T517 K518 F519 I524 H525	T517-Q521 WeakPolarHBondContact O-CG 3.48Å; T517-Q521 PolarHBondContact O-N 2.63Å; K518-Q521 PolarHBondContact O-N 3.3Å; F519-Q521 PolarHBondContact O-N 3.3Å; Q521-I524 PolarHBondContact O-N 3.28Å; Q521-H525 WeakPolarHBondContact O-CB 3.34Å; Q521-H525 PolarHBondContact O-N 3.34Å
522	S	88.1	Confident	84.9	Confident	59 Å²	59	97.9 Å²	97.9	41%	0.413	47%	0.468	S	S	.	.	H	α-helix	trans	-63	-41.4	176.2	-174.7	0	0	0	0	112.2	K518 F519 H525 R526	K518-S522 WeakPolarHBondContact O-CB 3.25Å; K518-S522 PolarHBondContact O-N 3.25Å; F519-S522 PolarHBondContact O-N 3.39Å; S522-H525 PolarHBondContact O-N 3.03Å; S522-R526 WeakPolarHBondContact O-CB 3.16Å; S522-R526 VanDerWaalsContact O-CG 3.24Å; S522-R526 WeakPolarHBondContact O-CG 3.28Å; S522-R526 PolarHBondContact O-N 3.16Å
523	L	86.6	Confident	84.3	Confident	66 Å²	66	100 Å²	100	35%	0.346	48%	0.481	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175.8	-174.4	67	0	0	0	111.4	M491 F519 R520 R526 A527	M491-L523 HydrophobicContact CE-CD2 3.92Å; F519-L523 HydrophobicContact CE1-CB 4.44Å; F519-L523 HydrophobicContact CE1-CD2 4.3Å; F519-L523 WeakPolarHBondContact O-CB 3.32Å; F519-L523 PolarHBondContact O-N 3.5Å; R520-L523 PolarHBondContact O-N 2.93Å; L523-R526 PolarHBondContact O-N 2.75Å; L523-A527 WeakPolarHBondContact O-CB 3.22Å; L523-A527 PolarHBondContact O-N 3.22Å
524	I	85.9	Confident	83	Confident	79 Å²	79	99.6 Å²	99.6	41%	0.405	48%	0.483	S	S	.	.	H	α-helix	trans	-61	-45.5	174.7	-66.9	162.4	0	0	0	110.7	I487 R520 Q521 A527 A528	I487-I524 HydrophobicContact CD1-CD1 3.89Å; I487-I524 HydrophobicContact CD1-CG1 3.7Å; R520-I524 HydrophobicContact CG-CD1 3.98Å; R520-I524 WeakPolarHBondContact O-CD1 3.27Å; R520-I524 VanDerWaalsContact O-CG1 3.24Å; R520-I524 WeakPolarHBondContact O-CG1 3.18Å; R520-I524 PolarHBondContact O-N 3.14Å; Q521-I524 PolarHBondContact O-N 3.28Å; I524-A527 PolarHBondContact O-N 3.06Å; I524-A528 WeakPolarHBondContact O-CB 3.34Å; I524-A528 PolarHBondContact O-N 3.02Å
525	H	85.3	Confident	81.1	Confident	130 Å²	130	102.4 Å²	102.4	60%	0.602	50%	0.497	S	S	*	.	H	α-helix	trans	-62.4	-46.6	179.1	-171.4	-81.2	0	0	0	111.9	Q521 S522 A527 A528 V529	Q521-H525 WeakPolarHBondContact O-CB 3.34Å; Q521-H525 PolarHBondContact O-N 3.34Å; S522-H525 PolarHBondContact O-N 3.03Å; H525-A527 VanDerWaalsContact C-N 3.3Å; H525-A527 PolarHBondContact O-N 3.41Å; H525-A528 PolarHBondContact O-N 3.02Å; H525-V529 WeakPolarHBondContact O-CG2 3.37Å; H525-V529 PolarHBondContact O-N 2.87Å
526	R	85.3	Confident	78.9	Confident	180 Å²	180	105 Å²	105	68%	0.679	52%	0.518	S	S	*	.	H	α-helix	trans	-66.3	-30.6	177.7	-69	173.1	73.6	126.5	2.7	112.6	S522 L523	S522-R526 WeakPolarHBondContact O-CB 3.16Å; S522-R526 VanDerWaalsContact O-CG 3.24Å; S522-R526 WeakPolarHBondContact O-CG 3.28Å; S522-R526 PolarHBondContact O-N 3.16Å; L523-R526 PolarHBondContact O-N 2.75Å
527	A	83	Confident	76.8	Confident	42 Å²	42	111.1 Å²	111.1	35%	0.347	55%	0.546	S	S	.	.	H	α-helix	trans	-70.7	-45.2	170.2	0	0	0	0	0	111.6	L523 I524 H525 V529 R530 Y531	L523-A527 WeakPolarHBondContact O-CB 3.22Å; L523-A527 PolarHBondContact O-N 3.22Å; I524-A527 PolarHBondContact O-N 3.06Å; H525-A527 VanDerWaalsContact C-N 3.3Å; H525-A527 PolarHBondContact O-N 3.41Å; A527-V529 PolarHBondContact O-N 2.86Å; A527-R530 WeakPolarHBondContact O-CB 3.49Å; A527-R530 PolarHBondContact O-N 3.49Å; A527-Y531 VanDerWaalsContact O-CD2 3.29Å; A527-Y531 WeakPolarHBondContact O-CD2 3.41Å; A527-Y531 PolarHBondContact O-N 2.96Å
528	A	82.8	Confident	74.4	Confident	44 Å²	44	118.6 Å²	118.6	36%	0.364	57%	0.568	S	S	.	*	H	α-helix	trans	-58	-45.4	179.3	0	0	0	0	0	112.1	I524 H525 R530 Y531 F532	I524-A528 WeakPolarHBondContact O-CB 3.34Å; I524-A528 PolarHBondContact O-N 3.02Å; H525-A528 PolarHBondContact O-N 3.02Å; A528-R530 PolarHBondContact O-N 2.84Å; A528-Y531 PolarHBondContact O-N 2.96Å; A528-Y531 VanDerWaalsContact O-N 3.13Å; A528-F532 PolarHBondContact O-N 3.14Å
529	V	84.5	Confident	71.8	Confident	70 Å²	70	119.8 Å²	119.8	42%	0.424	58%	0.579	S	S	.	*	H	α-helix	trans	-61	-24.7	176.9	172.8	0	0	0	0	113.1	H525 A527 F532 P533	H525-V529 WeakPolarHBondContact O-CG2 3.37Å; H525-V529 PolarHBondContact O-N 2.87Å; A527-V529 PolarHBondContact O-N 2.86Å; V529-F532 CarbonylContact O-C 3.42Å; V529-P533 WeakPolarHBondContact O-CA 3.38Å; V529-P533 VanDerWaalsContact O-N 3.1Å
530	R	79.8	Confident	69.3	Low	211 Å²	211	124.2 Å²	124.2	80%	0.796	60%	0.598	S	S	*	*	H	α-helix	trans	-78.4	-30.9	175.4	-73.9	179.5	170.1	-169	-3.5	113.8	A527 A528	A527-R530 WeakPolarHBondContact O-CB 3.49Å; A527-R530 PolarHBondContact O-N 3.49Å; A528-R530 PolarHBondContact O-N 2.84Å
531	Y	75.6	Confident	67.3	Low	180 Å²	180	125.3 Å²	125.3	71%	0.706	61%	0.61	S	S	*	*	H	α-helix	trans	-93.8	-22.1	178.2	-67.2	-70.3	0	0	0	113.1	A527 A528	A527-Y531 VanDerWaalsContact O-CD2 3.29Å; A527-Y531 WeakPolarHBondContact O-CD2 3.41Å; A527-Y531 PolarHBondContact O-N 2.96Å; A528-Y531 PolarHBondContact O-N 2.96Å; A528-Y531 VanDerWaalsContact O-N 3.13Å
532	F	78.4	Confident	65.1	Low	158 Å²	158	124.3 Å²	124.3	69%	0.693	61%	0.609	S	S	*	*	S	Bend	trans	-126.1	65.7	171.5	-51.4	-72.6	0	0	0	108.9	A528 V529 D534	A528-F532 PolarHBondContact O-N 3.14Å; V529-F532 CarbonylContact O-C 3.42Å; F532-D534 PolarHBondContact O-N 3.29Å
533	P	72.9	Confident	62.7	Low	88 Å²	88	131.3 Å²	131.3	57%	0.571	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-57.7	131.3	163.4	28.3	-33.7	0	0	0	106.8	V529 L535	V529-P533 WeakPolarHBondContact O-CA 3.38Å; V529-P533 VanDerWaalsContact O-N 3.1Å; P533-L535 PolarHBondContact O-N 3.05Å
534	D	56.5	Low	60.2	Low	118 Å²	118	134.4 Å²	134.4	63%	0.631	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-53.6	124.5	-165.4	-72.1	-74.5	0	0	0	111.9	F532	F532-D534 PolarHBondContact O-N 3.29Å
535	L	49	Very low	57.8	Low	160 Å²	160	133.8 Å²	133.8	84%	0.838	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-56	128.5	152	-77.1	95.8	0	0	0	105.5	P533 Q537	P533-L535 PolarHBondContact O-N 3.05Å; L535-Q537 PolarHBondContact O-N 3.38Å
536	P	41.2	Very low	55.6	Low	118 Å²	118	134 Å²	134	77%	0.766	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-49.6	129.1	-162.2	15.5	-30.8	0	0	0	111	R538	P536-R538 PolarHBondContact O-N 3.47Å
537	Q	43.1	Very low	53.2	Low	149 Å²	149	136.9 Å²	136.9	70%	0.696	68%	0.682	S	S	*	*			trans	-55.2	104.7	174.8	-72.9	-171.8	-3.6	0	0	107.7	L535 D539	L535-Q537 PolarHBondContact O-N 3.38Å; Q537-D539 PolarHBondContact O-N 3.03Å
538	R	36.5	Very low	51.3	Low	212 Å²	212	139.4 Å²	139.4	80%	0.8	70%	0.697	S	S	*	*			trans	-55.5	119.3	170.3	-88	-172.8	164.5	-154	-7.6	107.6	P536 F540	P536-R538 PolarHBondContact O-N 3.47Å; R538-F540 PolarHBondContact O-N 2.97Å
539	D	33.2	Very low	49.3	Very low	129 Å²	129	144.9 Å²	144.9	69%	0.69	72%	0.72	S	S	*	*			trans	-58.6	102.2	-161.8	-59	-91.4	0	0	0	112.5	Q537	Q537-D539 PolarHBondContact O-N 3.03Å
540	F	36.1	Very low	47.2	Very low	194 Å²	194	147.4 Å²	147.4	85%	0.851	74%	0.738	S	S	*	*			trans	-91.7	23.2	151.5	-74.9	-76.5	0	0	0	110.7	R538 N542	R538-F540 PolarHBondContact O-N 2.97Å; F540-N542 PolarHBondContact O-N 3.39Å
541	I	43.7	Very low	45	Very low	122 Å²	122	142.7 Å²	142.7	63%	0.626	74%	0.738	S	S	*	*	S	Bend	trans	-79.4	94.8	161	-58.6	-179.3	0	0	0	107.5
542	N	40.2	Very low	43.1	Very low	101 Å²	101	138.9 Å²	138.9	54%	0.54	74%	0.735	S	S	.	*			trans	37.1	107.1	147.1	-63.7	-20.4	0	0	0	118.3	F540 Q544	F540-N542 PolarHBondContact O-N 3.39Å; N542-Q544 HydrophobicContact CB-CB 4.01Å; N542-Q544 HydrophobicContact CB-CG 3.87Å; N542-Q544 PolarHBondContact O-N 2.91Å
543	H	38.1	Very low	41.1	Very low	206 Å²	206	140.5 Å²	140.5	95%	0.954	74%	0.741	S	S	*	*			trans	-66.1	68.9	138	-79.8	-55.5	0	0	0	109.9	G545	H543-G545 PolarHBondContact O-N 2.93Å
544	Q	34.1	Very low	39.5	Very low	132 Å²	132	141.8 Å²	141.8	62%	0.617	75%	0.748	S	S	*	*			trans	-77.1	57.5	164	-95.1	176.7	-10	0	0	109.5	N542 T546	N542-Q544 HydrophobicContact CB-CB 4.01Å; N542-Q544 HydrophobicContact CB-CG 3.87Å; N542-Q544 PolarHBondContact O-N 2.91Å; Q544-T546 PolarHBondContact O-N 3.18Å
545	G	34.4	Very low	38.6	Very low	66 Å²	66	146.4 Å²	146.4	68%	0.68	76%	0.756	S	S	*	*			trans	-77	107.1	164.5	0	0	0	0	0	108.5	H543 R547	H543-G545 PolarHBondContact O-N 2.93Å; G545-R547 PolarHBondContact O-N 3.46Å
546	T	39.3	Very low	38.2	Very low	133 Å²	133	144.4 Å²	144.4	82%	0.816	75%	0.747	S	S	*	*			trans	-51.2	102.7	-178.4	25.9	0	0	0	0	112.8	Q544 S548	Q544-T546 PolarHBondContact O-N 3.18Å; T546-S548 VanDerWaalsContact C-N 3.32Å; T546-S548 PolarHBondContact O-N 3.24Å
547	R	35.3	Very low	38.1	Very low	241 Å²	241	146 Å²	146	91%	0.909	75%	0.749	S	S	*	*			trans	-93.8	65	164.4	-160.7	178	-172.1	-167.1	1.1	110.4	G545	G545-R547 PolarHBondContact O-N 3.46Å
548	S	42.9	Very low	37.8	Very low	96 Å²	96	146 Å²	146	67%	0.671	75%	0.746	S	S	*	*			trans	-63.3	153.1	165.9	40	0	0	0	0	110.7	T546 P550	T546-S548 VanDerWaalsContact C-N 3.32Å; T546-S548 PolarHBondContact O-N 3.24Å; S548-P550 WeakPolarHBondContact O-CD 3.39Å
549	N	39.9	Very low	37.8	Very low	158 Å²	158	141.5 Å²	141.5	85%	0.845	75%	0.745	S	S	*	*			trans	-68.6	124.6	-173.8	-65	-46	0	0	0	112.5	S551	N549-S551 PolarHBondContact O-N 2.94Å
550	P	40	Very low	37.8	Very low	123 Å²	123	140 Å²	140	80%	0.799	73%	0.734	S	S	*	*			trans	-87.8	89.4	162.1	33.6	-28.2	0	0	0	109.6	S548	S548-P550 WeakPolarHBondContact O-CD 3.39Å
551	S	35.4	Very low	37.8	Very low	113 Å²	113	140.6 Å²	140.6	79%	0.79	74%	0.736	S	S	*	*			trans	-74.4	147.7	164.5	-152.8	0	0	0	0	109.4	N549	N549-S551 PolarHBondContact O-N 2.94Å
552	P	35.5	Very low	37.4	Very low	99 Å²	99	142.3 Å²	142.3	64%	0.643	74%	0.741	S	S	*	*			trans	-93.5	169.4	-155.1	36.3	-37.7	0	0	0	115.3
553	K	35.5	Very low	37.1	Very low	192 Å²	192	142.9 Å²	142.9	84%	0.835	75%	0.753	S	S	*	*			trans	80.2	143.8	178.7	-46.2	160.6	-172.7	174.7	0	111.7
554	T	39.3	Very low	37	Very low	116 Å²	116	138 Å²	138	71%	0.712	74%	0.742	S	S	*	*			cis	-151	169.4	11.8	-22.6	0	0	0	0	110.1
555	R	37.8	Very low	37.2	Very low	214 Å²	214	138.3 Å²	138.3	81%	0.808	74%	0.743	S	S	*	*			trans	27.8	137.9	144.3	-76	178	174.6	153.4	-1.5	120
556	D	40.2	Very low	37.2	Very low	119 Å²	119	145.4 Å²	145.4	64%	0.636	75%	0.75	S	S	*	*			cis	-167.3	163.7	17	-111.7	-29.1	0	0	0	114
557	N	38.6	Very low	36.9	Very low	151 Å²	151	143.2 Å²	143.2	81%	0.807	74%	0.74	S	S	*	*			trans	72.6	136.8	150.4	-67.5	-36.2	0	0	0	125.6
558	K	37	Very low	36.9	Very low	148 Å²	148	138.6 Å²	138.6	64%	0.643	73%	0.733	S	S	*	*			trans	-74.6	-178.2	168.9	-111.7	-177.1	177.4	-175.6	0	112	E560	K558-E560 HydrophobicContact CD-CB 4.04Å; K558-E560 VanDerWaalsContact CE-CD 3.45Å; K558-E560 WeakPolarHBondContact CE-OE1 3.33Å; K558-E560 VanDerWaalsContact CE-OE2 3.31Å; K558-E560 WeakPolarHBondContact CE-OE2 3.47Å; K558-E560 HydrophobicContact CG-CB 4.25Å; K558-E560 IonicContact NZ-OE1 2.76Å; K558-E560 PolarHBondContact NZ-OE1 3.29Å; K558-E560 IonicContact NZ-OE2 2.66Å; K558-E560 PolarHBondContact NZ-OE2 3.24Å
559	P	37.6	Very low	36.6	Very low	118 Å²	118	139 Å²	139	77%	0.766	74%	0.736	S	S	*	*			cis	-126.6	170	23	40.4	-23.7	0	0	0	114.9
560	E	32.3	Very low	36.3	Very low	98 Å²	98	138.4 Å²	138.4	46%	0.458	73%	0.731	S	S	.	*			cis	90.1	112.8	21.5	-172.4	169.8	-110.7	0	0	118.4	K558 Q562	K558-E560 HydrophobicContact CD-CB 4.04Å; K558-E560 VanDerWaalsContact CE-CD 3.45Å; K558-E560 WeakPolarHBondContact CE-OE1 3.33Å; K558-E560 VanDerWaalsContact CE-OE2 3.31Å; K558-E560 WeakPolarHBondContact CE-OE2 3.47Å; K558-E560 HydrophobicContact CG-CB 4.25Å; K558-E560 IonicContact NZ-OE1 2.76Å; K558-E560 PolarHBondContact NZ-OE1 3.29Å; K558-E560 IonicContact NZ-OE2 2.66Å; K558-E560 PolarHBondContact NZ-OE2 3.24Å; E560-Q562 HydrophobicContact CG-CG 4.2Å; E560-Q562 PolarHBondContact OE1-NE2 2.9Å
561	K	37.1	Very low	35.9	Very low	206 Å²	206	139.9 Å²	139.9	90%	0.896	73%	0.729	S	S	*	*			trans	179.7	119.5	147.5	-98	158.3	-175.7	178.5	0	106.2
562	Q	34.7	Very low	35.7	Very low	159 Å²	159	145.3 Å²	145.3	74%	0.743	73%	0.732	S	S	*	*			cis	77.1	93.7	24.4	-65.4	-145.6	51.9	0	0	117.7	E560	E560-Q562 HydrophobicContact CG-CG 4.2Å; E560-Q562 PolarHBondContact OE1-NE2 2.9Å
563	S	34.5	Very low	35.7	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	74%	0.743	S	S	*	*			trans	-171.5	118.7	143.8	51.4	0	0	0	0	108
564	S	35.7	Very low	35.5	Very low	104 Å²	104	146.3 Å²	146.3	73%	0.727	74%	0.742	S	S	*	*				61.6	137	84.2	-74	0	0	0	0	114.1
565	Q	38.1	Very low	35.2	Very low	138 Å²	138	148 Å²	148	65%	0.645	75%	0.746	S	S	*	*			cis	-165.2	153.6	5.5	-124.7	178.6	58.3	0	0	110.3
566	R	33.5	Very low	35	Very low	215 Å²	215	144.5 Å²	144.5	81%	0.811	74%	0.743	S	S	*	*			trans	51.4	161.4	148.2	-72.3	172.2	172.1	154.6	-14	120.9
567	S	33.6	Very low	34.6	Very low	87 Å²	87	143.8 Å²	143.8	61%	0.608	75%	0.747	S	S	*	*			cis	-165.4	153.4	-38.2	51.6	0	0	0	0	109.3
568	D	35.5	Very low	34.1	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	75%	0.747	S	S	*	*			trans	64.7	131.7	156.5	-56	-45.2	0	0	0	123.5
569	S	36	Very low	33.7	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	75%	0.748	S	S	*	*			trans	102.1	107.8	131.5	75.4	0	0	0	0	122.5
570	I	33.5	Very low	33.4	Very low	147 Å²	147	138.5 Å²	138.5	75%	0.754	74%	0.742	S	S	*	*				81.2	127.7	119.8	-70.9	167.3	0	0	0	121.4
571	M	32.7	Very low	33.3	Very low	153 Å²	153	143 Å²	143	75%	0.754	76%	0.761	S	S	*	*			trans	66.7	114	157.8	-85.8	-170.7	-75	0	0	122.7
572	R	30.7	Very low	33.4	Very low	227 Å²	227	138.2 Å²	138.2	86%	0.857	75%	0.75	S	S	*	*				36.2	120.2	118.6	-62.8	177.6	172.4	-171.5	-1.1	117.6
573	S	35	Very low	33.6	Very low	124 Å²	124	135.7 Å²	135.7	87%	0.867	75%	0.75	S	S	*	*				-171.6	-171.4	87	56.1	0	0	0	0	111.8
574	K	32.1	Very low	33.5	Very low	188 Å²	188	139.4 Å²	139.4	82%	0.817	75%	0.752	S	S	*	*			trans	-85.2	154.7	-176.1	-49.8	163.2	-177.4	173.3	0	110
575	I	33.2	Very low	33.6	Very low	152 Å²	152	141.6 Å²	141.6	78%	0.779	76%	0.755	S	S	*	*				170.7	140.2	118.6	-90.1	157.1	0	0	0	112.4
576	N	33.7	Very low	33.5	Very low	140 Å²	140	141.8 Å²	141.8	75%	0.749	76%	0.761	S	S	*	*			trans	27.8	126.8	155.7	-58.5	3.4	0	0	0	123.6
577	S	30.6	Very low	33.7	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	76%	0.757	S	S	*	*			trans	9.8	122.1	133.5	60.5	0	0	0	0	121.5
578	C	28.2	Very low	33.7	Very low	118 Å²	118	140.6 Å²	140.6	80%	0.797	77%	0.766	S	S	*	*				-168.3	117.7	127.6	-104.3	0	0	0	0	106.6
579	S	28.6	Very low	33.6	Very low	95 Å²	95	140.3 Å²	140.3	66%	0.664	76%	0.763	S	S	*	*				71.2	132.8	76.3	76.4	0	0	0	0	115
580	S	32.1	Very low	33.6	Very low	92 Å²	92	140.3 Å²	140.3	64%	0.643	76%	0.76	S	S	*	*			trans	87.5	105.8	149.4	-57.7	0	0	0	0	121.1
581	F	30.1	Very low	33.6	Very low	194 Å²	194	139.5 Å²	139.5	85%	0.851	76%	0.762	S	S	*	*				69.6	169.1	125.6	-71.6	-51.1	0	0	0	120.7
582	P	39.2	Very low	34.1	Very low	104 Å²	104	137.9 Å²	137.9	68%	0.675	76%	0.763	S	S	*	*			cis	-133.8	-164.2	-22.8	27.7	-4.8	0	0	0	113.8
583	S	38.2	Very low	34.1	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	76%	0.763	S	S	*	*			trans	99.8	143	140	85.6	0	0	0	0	118.4
584	K	34.1	Very low	33.9	Very low	191 Å²	191	133 Å²	133	83%	0.83	75%	0.751	S	S	*	*			cis	-168.2	-177.4	-24.3	-122.4	175.8	-179.1	-177.2	0	110.2
585	L	37.6	Very low	33.9	Very low	149 Å²	149	131.4 Å²	131.4	78%	0.78	75%	0.751	S	S	*	*			trans	85.8	121.3	172.9	-53.7	171.7	0	0	0	113.9
586	N	35.2	Very low	33.7	Very low	143 Å²	143	132 Å²	132	77%	0.765	75%	0.751	S	S	*	*				87.4	144.1	50.7	-73.4	25.7	0	0	0	112
587	S	36.9	Very low	33.5	Very low	104 Å²	104	130.4 Å²	130.4	73%	0.727	75%	0.75	S	S	*	*			cis	179.7	160.8	-12.1	47.3	0	0	0	0	109.9
588	H	34.2	Very low	33.5	Very low	172 Å²	172	130.3 Å²	130.3	80%	0.796	75%	0.75	S	S	*	*			cis	-177.7	-176	-25.5	-170.4	34.4	0	0	0	109
589	I	33.6	Very low	33.8	Very low	140 Å²	140	132.6 Å²	132.6	72%	0.718	75%	0.751	S	S	*	*			trans	68.9	173.5	165.5	-0.6	-176.8	0	0	0	117.4
590	P	37	Very low	34	Very low	102 Å²	102	131.9 Å²	131.9	66%	0.662	75%	0.745	S	S	*	*				-137.6	-172	-107.2	49.2	-31.4	0	0	0	118.5
591	T	32.6	Very low	34.2	Very low	130 Å²	130	136.1 Å²	136.1	80%	0.798	75%	0.752	S	S	*	*			trans	21.4	148.7	149.8	49.9	0	0	0	0	123.8
592	P	42.5	Very low	34.7	Very low	120 Å²	120	133.2 Å²	133.2	78%	0.779	75%	0.746	S	S	*	*			trans	-92	163.5	-170.5	39.1	-37.4	0	0	0	114.8
593	D	31.5	Very low	34.5	Very low	159 Å²	159	134.9 Å²	134.9	85%	0.85	75%	0.749	S	S	*	*			trans	-158	155.6	144	-131.8	-30.1	0	0	0	114.7
594	S	31.3	Very low	34.3	Very low	88 Å²	88	134.4 Å²	134.4	62%	0.615	75%	0.746	S	S	*	*			trans	42.6	130.7	152.9	93.2	0	0	0	0	124.8
595	L	30.5	Very low	34.5	Very low	155 Å²	155	131.1 Å²	131.1	81%	0.812	74%	0.744	S	S	*	*			trans	85.5	150.7	131.7	-71.1	167.6	0	0	0	124
596	E	30.6	Very low	34.3	Very low	166 Å²	166	132 Å²	132	78%	0.776	74%	0.744	S	S	*	*			trans	65.2	97	154.9	-72.9	178.3	161.6	0	0	123.4
597	S	29.2	Very low	34.2	Very low	105 Å²	105	132.4 Å²	132.4	73%	0.734	75%	0.745	S	S	*	*				61.1	118.3	108.5	-59.6	0	0	0	0	122.8
598	S	29.5	Very low	34	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	74%	0.744	S	S	*	*				101.9	157.7	129.2	81.7	0	0	0	0	120.7
599	M	34.6	Very low	34.1	Very low	166 Å²	166	128.8 Å²	128.8	82%	0.818	74%	0.737	S	S	*	*			trans	73.4	93	175.1	-51.5	-153.1	-178.3	0	0	115.1
600	S	32.9	Very low	34.1	Very low	79 Å²	79	129.8 Å²	129.8	55%	0.552	74%	0.742	S	S	*	*				82.1	130.9	82.1	68.4	0	0	0	0	112.3
601	F	37.2	Very low	34.1	Very low	181 Å²	181	130 Å²	130	79%	0.794	74%	0.743	S	S	*	*			cis	-149.9	174.5	25.8	-60.1	-89.3	0	0	0	108.3
602	N	39.4	Very low	33.9	Very low	133 Å²	133	128.5 Å²	128.5	71%	0.711	74%	0.738	S	S	*	*			cis	-168.7	170.8	-15.8	-103.8	10.8	0	0	0	106.3
603	N	35.3	Very low	33.3	Very low	139 Å²	139	127.4 Å²	127.4	74%	0.743	73%	0.733	S	S	*	*			cis	-147.2	-171.7	2.5	-152.4	-5.1	0	0	0	111.5
604	S	33.5	Very low	33.5	Very low	96 Å²	96	127 Å²	127	67%	0.671	73%	0.731	S	S	*	*			trans	-109.9	-179.9	163.4	-80.1	0	0	0	0	110.5
605	P	39.7	Very low	34	Very low	122 Å²	122	127.6 Å²	127.6	79%	0.792	73%	0.733	S	S	*	*			cis	-116.8	164.6	14.3	11.8	15.1	0	0	0	114.7
606	H	32.1	Very low	34	Very low	169 Å²	169	126.3 Å²	126.3	78%	0.782	73%	0.732	S	S	*	*			cis	97.7	141.4	37.3	-160.8	-108.6	0	0	0	113.4
607	L	33.8	Very low	34	Very low	151 Å²	151	122.1 Å²	122.1	79%	0.791	72%	0.721	S	S	*	*			trans	90.7	144.1	176.6	-55.8	179.2	0	0	0	120.7
608	S	32.2	Very low	34.1	Very low	101 Å²	101	125.7 Å²	125.7	71%	0.706	72%	0.723	S	S	*	*			trans	-102	-166	-177.1	52.7	0	0	0	0	111.9
609	P	37	Very low	34.5	Very low	99 Å²	99	125.7 Å²	125.7	64%	0.643	72%	0.715	S	S	*	*			cis	-135.1	158.6	-47.6	32.3	-14.9	0	0	0	114.5
610	I	34.4	Very low	34.7	Very low	161 Å²	161	125.2 Å²	125.2	83%	0.826	71%	0.709	S	S	*	*			trans	65.2	172	157.5	-67.8	164.9	0	0	0	113.3
611	P	36.7	Very low	34.8	Very low	105 Å²	105	125.1 Å²	125.1	68%	0.682	71%	0.708	S	S	*	*			cis	-118.6	178.2	-24.6	35.5	-17.9	0	0	0	115.9
612	S	27.6	Very low	34.6	Very low	100 Å²	100	124.6 Å²	124.6	70%	0.699	71%	0.706	S	S	*	*			trans	43.1	150.7	139.2	68.2	0	0	0	0	126.7
613	S	30.6	Very low	34.2	Very low	96 Å²	96	125.1 Å²	125.1	67%	0.671	71%	0.708	S	S	*	*			trans	73.4	112.6	145.8	49.5	0	0	0	0	122
614	D	34.5	Very low	34.1	Very low	151 Å²	151	122.5 Å²	122.5	81%	0.807	70%	0.7	S	S	*	*				41.3	156.1	99.6	-68.1	13.7	0	0	0	121
615	P	42.3	Very low	34	Very low	101 Å²	101	122.9 Å²	122.9	66%	0.656	70%	0.699	S	S	*	*			cis	-141.6	-156.6	-21.7	36.3	-14.3	0	0	0	113.4
616	T	31.1	Very low	33.8	Very low	127 Å²	127	123.3 Å²	123.3	78%	0.779	69%	0.694	S	S	*	*			trans	70.7	153.4	155.2	47.8	0	0	0	0	119.2
617	S	30.7	Very low	33.8	Very low	79 Å²	79	120.6 Å²	120.6	55%	0.552	69%	0.685	S	S	*	*			cis	-169.9	176.2	-10.7	46	0	0	0	0	112
618	F	32	Very low	33.8	Very low	179 Å²	179	119.7 Å²	119.7	79%	0.785	68%	0.68	S	S	*	*			trans	75.1	151.2	163	-62.1	-57.5	0	0	0	117.9
619	D	37.2	Very low	34	Very low	104 Å²	104	120.9 Å²	120.9	56%	0.556	68%	0.683	S	S	*	*			cis	-148.8	162	3.6	-138	-5.9	0	0	0	116.5
620	K	37.8	Very low	33.6	Very low	156 Å²	156	123.1 Å²	123.1	68%	0.678	69%	0.69	S	S	*	*			trans	26.4	150.2	139.8	-80.7	173.4	-152.8	79.9	0	121.7
621	S	35.2	Very low	33.8	Very low	77 Å²	77	120.6 Å²	120.6	54%	0.538	68%	0.684	S	S	.	*			cis	179.3	174.6	9	37.5	0	0	0	0	113.8
622	F	32.9	Very low	33.5	Very low	171 Å²	171	119.5 Å²	119.5	75%	0.75	68%	0.684	S	S	*	*			trans	80.3	118.8	167.1	-55.8	-76.2	0	0	0	116.1
623	L	32.6	Very low	33.5	Very low	144 Å²	144	121 Å²	121	75%	0.754	69%	0.689	S	S	*	*				77.8	138.5	53	-67.4	158.4	0	0	0	112
624	S	32.1	Very low	33.6	Very low	84 Å²	84	121.6 Å²	121.6	59%	0.587	68%	0.684	S	S	*	*			cis	-156.5	129.2	8.7	-139.1	0	0	0	0	113.9
625	T	32	Very low	33.4	Very low	104 Å²	104	122 Å²	122	64%	0.638	68%	0.678	S	S	*	*				58.2	149.2	120	63.3	0	0	0	0	124.8
626	N	34.9	Very low	32.7	Very low	130 Å²	130	122.6 Å²	122.6	70%	0.695	68%	0.681	S	S	*	*			trans	77.6	146.1	150.7	-66.8	12.8	0	0	0	118.5
627	D	32.9	Very low	32.7	Very low	112 Å²	112	124.8 Å²	124.8	60%	0.599	68%	0.68	S	S	*	*			cis	-163.5	155.1	-7.7	-112.4	-22.4	0	0	0	115.6
628	I	33	Very low	32.5	Very low	133 Å²	133	131.7 Å²	131.7	68%	0.682	69%	0.693	S	S	*	*			trans	62.9	145.7	138.8	-61.8	161.4	0	0	0	122.5
629	T	35.7	Very low	32.4	Very low	125 Å²	125	128 Å²	128	77%	0.767	69%	0.686	S	S	*	*			trans	78	99.4	160.9	30	0	0	0	0	123.5
630	N	29.2	Very low	31.8	Very low	147 Å²	147	128.4 Å²	128.4	79%	0.786	69%	0.692	S	S	*	*				0	162.8	104.3	-87.7	-21	0	0	0	119.4
631	P	39	Very low	31.5	Very low	108 Å²	108	131.5 Å²	131.5	70%	0.701	70%	0.701	S	S	*	*			cis	-143.2	-164.3	-29.7	39.4	-19.1	0	0	0	113.2
632	A	29.2	Very low	31.2	Very low	82 Å²	82	132.5 Å²	132.5	68%	0.678	71%	0.708	S	S	*	*			trans	75.2	123.4	139.9	0	0	0	0	0	122.9
633	V	29.4	Very low	31.5	Very low	132 Å²	132	130 Å²	130	80%	0.8	71%	0.708	S	S	*	*				86.4	140.4	127.9	169.1	0	0	0	0	120.7
634	D	31.4	Very low	31.4	Very low	108 Å²	108	130.4 Å²	130.4	58%	0.578	71%	0.711	S	S	*	*			trans	65.4	105.3	162	-82.3	16.8	0	0	0	124.3
635	K	30.5	Very low	31.5	Very low	158 Å²	158	134.9 Å²	134.9	69%	0.687	72%	0.722	S	S	*	*				52.5	141.1	114	-56.8	-178.5	-170	81.5	0	120.4
636	T	28.5	Very low	31.6	Very low	114 Å²	114	136 Å²	136	70%	0.699	72%	0.724	S	S	*	*			trans	101.8	154	147.4	75.9	0	0	0	0	119.2
637	F	29.7	Very low	31.9	Very low	173 Å²	173	135.8 Å²	135.8	76%	0.759	73%	0.73	S	S	*	*			trans	60.5	93.4	165.9	-59.2	-64.4	0	0	0	122.1
638	R	28.1	Very low	31.9	Very low	224 Å²	224	135.6 Å²	135.6	85%	0.845	73%	0.732	S	S	*	*				65.9	143.9	104.6	-117.2	-173.4	-167.3	-130.6	7.5	120.9
639	T	28.5	Very low	31.9	Very low	102 Å²	102	135.3 Å²	135.3	63%	0.626	74%	0.737	S	S	*	*			trans	84.2	103.4	145.4	-49.7	0	0	0	0	118
640	V	26	Very low	31.8	Very low	112 Å²	112	132.1 Å²	132.1	68%	0.679	73%	0.729	S	S	*	*			trans	38.2	119.4	130.5	-176	0	0	0	0	118.3
641	Y	31	Very low	31.9	Very low	222 Å²	222	131.8 Å²	131.8	87%	0.871	73%	0.727	S	S	*	*				-160.9	154.8	114.6	-103.5	-68.9	0	0	0	111.7
642	S	28.7	Very low	31.4	Very low	97 Å²	97	133.2 Å²	133.2	68%	0.678	73%	0.729	S	S	*	*			trans	-120.1	147.4	176.7	-52.9	0	0	0	0	110.5
643	P	39.6	Very low	31.4	Very low	118 Å²	118	137.1 Å²	137.1	77%	0.766	73%	0.733	S	S	*	*			trans	-88.2	128.4	146	-8.8	28.1	0	0	0	108.6
644	L	29.4	Very low	31.3	Very low	153 Å²	153	135.2 Å²	135.2	80%	0.801	73%	0.726	S	S	*	*				59.9	110.6	67.1	-65.4	158.1	0	0	0	110.2
645	H	35.5	Very low	31.1	Very low	178 Å²	178	138.4 Å²	138.4	82%	0.824	74%	0.737	S	S	*	*				-157.1	147.2	62.9	-139.6	-87.2	0	0	0	114.2
646	N	34	Very low	31	Very low	129 Å²	129	141.4 Å²	141.4	69%	0.69	75%	0.745	S	S	*	*			trans	-92.2	168.7	165.2	-94	-1.1	0	0	0	110.9	V648	N646-V648 HydrophobicContact CB-CG2 4.26Å
647	P	40.5	Very low	30.9	Very low	124 Å²	124	147.2 Å²	147.2	81%	0.805	75%	0.754	S	S	*	*				-125.6	159.9	104.4	36.3	-33.3	0	0	0	112.8
648	V	32.3	Very low	30.9	Very low	108 Å²	108	145.9 Å²	145.9	66%	0.655	75%	0.754	S	S	*	*			cis	153.7	147.5	-22.2	145.6	0	0	0	0	106.5	N646	N646-V648 HydrophobicContact CB-CG2 4.26Å
649	T	34.5	Very low	30.9	Very low	128 Å²	128	145 Å²	145	79%	0.785	75%	0.751	S	S	*	*			trans	61.2	144.8	-176.4	45.9	0	0	0	0	115.2
650	G	32.2	Very low	30.8	Very low	57 Å²	57	146.6 Å²	146.6	59%	0.588	76%	0.756	S	S	*	*			cis	106	139.2	13.1	0	0	0	0	0	110.6
651	D	31.6	Very low	31.1	Very low	140 Å²	140	148.5 Å²	148.5	75%	0.749	76%	0.761	S	S	*	*			cis	-154.5	166.9	-0.3	-72.3	-58.3	0	0	0	110.2
652	N	28.6	Very low	31	Very low	138 Å²	138	141.8 Å²	141.8	74%	0.738	75%	0.746	S	S	*	*			trans	61.1	166.7	147.3	-68.3	-10	0	0	0	123.2
653	E	29.5	Very low	31.1	Very low	164 Å²	164	144.6 Å²	144.6	77%	0.766	75%	0.753	S	S	*	*			trans	64.4	95.2	143.1	-82.1	162.5	-147.8	0	0	122
654	S	27.4	Very low	30.6	Very low	93 Å²	93	145.6 Å²	145.6	65%	0.65	75%	0.752	S	S	*	*				70.6	138.1	112.4	81.5	0	0	0	0	121.8
655	H	26.7	Very low	30.6	Very low	174 Å²	174	143.7 Å²	143.7	81%	0.806	75%	0.752	S	S	*	*			trans	32.2	95.6	141.7	-70.8	-100.6	0	0	0	119.4
656	Y	29.7	Very low	30.2	Very low	222 Å²	222	139.6 Å²	139.6	87%	0.871	74%	0.743	S	S	*	*			trans	-144.9	114.8	133.6	-99.1	-67	0	0	0	113.9
657	R	24.6	Very low	30.1	Very low	235 Å²	235	140.2 Å²	140.2	89%	0.887	75%	0.746	S	S	*	*			trans	-84.9	112.3	160	-83.6	179	165.5	-177.1	-3.8	108.9
658	L	31.4	Very low	29.6	Very low	146 Å²	146	144.3 Å²	144.3	76%	0.764	75%	0.745	S	S	*	*			trans	-133.5	108.3	155.5	-68.3	175.1	0	0	0	107.3
659	R	26.9	Very low	29.4	Very low	206 Å²	206	146.1 Å²	146.1	78%	0.777	75%	0.751	S	S	*	*			cis	94.7	114.9	47	-84.1	-169.9	170.5	-177.5	-0.8	112.1
660	N	26.4	Very low	29.2	Very low	135 Å²	135	146 Å²	146	72%	0.722	75%	0.75	S	S	*	*			trans	68.3	156.2	151.3	-52.3	3.8	0	0	0	114.3
661	I	33.6	Very low	29	Very low	152 Å²	152	154.3 Å²	154.3	78%	0.779	76%	0.763	S	S	*	*			cis	-124.5	117.8	17.8	-65.3	164.4	0	0	0	107.3
662	S	28.2	Very low	29.1	Very low	80 Å²	80	157.5 Å²	157.5	56%	0.559	77%	0.771	S	S	*	*				59.8	134.9	98	-37.2	0	0	0	0	113.8
663	N	31.3	Very low	29	Very low	156 Å²	156	162 Å²	162	83%	0.834	78%	0.777	S	S	*	*			cis	-128.7	142.7	31.9	-62	-44.2	0	0	0	114.6
664	D	27.8	Very low	29.1	Very low	139 Å²	139	162.6 Å²	162.6	74%	0.743	79%	0.785	S	S	*	*			trans	-81.8	141.3	152.9	175.9	6.7	0	0	0	108.6	S666	D664-S666 PolarHBondContact OD1-N 3.42Å
665	S	30.6	Very low	29.5	Very low	113 Å²	113	166.3 Å²	166.3	79%	0.79	79%	0.792	S	S	*	*			trans	-156.4	75	153.6	69.5	0	0	0	0	111.1
666	S	27.1	Very low	30	Very low	92 Å²	92	163 Å²	163	64%	0.643	79%	0.786	S	S	*	*			trans	-56.8	137.7	143.7	67.8	0	0	0	0	109.3	D664	D664-S666 PolarHBondContact OD1-N 3.42Å
667	L	30.9	Very low	30.2	Very low	143 Å²	143	156.8 Å²	156.8	75%	0.749	77%	0.774	S	S	*	*			trans	165.5	128.9	150	-90.7	168.3	0	0	0	113.1
668	R	29.3	Very low	30.6	Very low	209 Å²	209	152.5 Å²	152.5	79%	0.789	77%	0.769	S	S	*	*			trans	36.3	117.1	140.7	-60.7	176.9	-168.4	-168.4	0.9	121.1
669	N	28.2	Very low	30.5	Very low	147 Å²	147	155.7 Å²	155.7	79%	0.786	77%	0.771	S	S	*	*				60.1	156.4	122.2	-57.2	-14.7	0	0	0	122.5
670	V	32	Very low	30.9	Very low	125 Å²	125	152.1 Å²	152.1	76%	0.758	77%	0.767	S	S	*	*			trans	72.1	75.8	160.5	-155.1	0	0	0	0	118.6
671	R	27	Very low	31	Very low	231 Å²	231	154.6 Å²	154.6	87%	0.872	77%	0.771	S	S	*	*				33.1	97.5	109.1	-173.1	-163.2	-157.3	170.4	7.9	117
672	K	33.5	Very low	31	Very low	208 Å²	208	155.3 Å²	155.3	90%	0.904	78%	0.775	S	S	*	*			trans	-166	155.8	134.1	-105.6	151.4	-171	179	0	114
673	R	27.4	Very low	31.2	Very low	232 Å²	232	156.3 Å²	156.3	88%	0.875	78%	0.781	S	S	*	*			trans	-73.3	157.1	-178.4	-51.7	160.2	178.2	160.8	-3.9	110.7
674	L	32.1	Very low	31.6	Very low	176 Å²	176	154.2 Å²	154.2	92%	0.921	78%	0.776	S	S	*	*				-165.3	151.3	111.5	-102.5	160.1	0	0	0	113.5
675	H	35.3	Very low	31.9	Very low	171 Å²	171	154.7 Å²	154.7	79%	0.792	78%	0.778	S	S	*	*			trans	-93.4	170.4	173.1	-115.2	-56.3	0	0	0	108.1
676	P	37.5	Very low	32	Very low	106 Å²	106	152.8 Å²	152.8	69%	0.688	76%	0.764	S	S	*	*				-161.2	-179.5	69	43.6	-21.6	0	0	0	119.3
677	S	33.3	Very low	32.3	Very low	90 Å²	90	158.9 Å²	158.9	63%	0.629	77%	0.774	S	S	*	*			trans	67.4	138.6	142.5	-77	0	0	0	0	121
678	N	32.2	Very low	32.4	Very low	145 Å²	145	159 Å²	159	78%	0.775	78%	0.776	S	S	*	*			cis	-148.4	-156.5	-4.6	-81.2	-38	0	0	0	107.4
679	R	30.9	Very low	32.7	Very low	214 Å²	214	157.8 Å²	157.8	81%	0.808	78%	0.776	S	S	*	*			cis	-158.3	104.7	2.5	-163.9	177.4	-169.9	-132	4.4	112.7
680	L	33.4	Very low	32.9	Very low	130 Å²	130	155.3 Å²	155.3	68%	0.681	77%	0.77	S	S	*	*			trans	66.9	125.5	159.6	-55.4	173.4	0	0	0	117.2
681	K	30.3	Very low	33	Very low	188 Å²	188	158.6 Å²	158.6	82%	0.817	78%	0.775	S	S	*	*				68.6	135.8	68	-65.2	-176.9	-177.8	-179.8	0	112.3
682	I	33	Very low	33.3	Very low	167 Å²	167	151.3 Å²	151.3	86%	0.856	76%	0.759	S	S	*	*				-148.9	150.7	62	-74	151.8	0	0	0	113.1
683	S	32.5	Very low	33.4	Very low	100 Å²	100	147.5 Å²	147.5	70%	0.699	75%	0.749	S	S	*	*			trans	-155.5	151	158	59.9	0	0	0	0	112.1
684	P	38.7	Very low	33.7	Very low	112 Å²	112	143.2 Å²	143.2	73%	0.727	74%	0.743	S	S	*	*			trans	-106.9	142.6	160.5	-1.3	23.2	0	0	0	111.7
685	I	35.2	Very low	33.6	Very low	150 Å²	150	139 Å²	139	77%	0.769	73%	0.728	S	S	*	*			cis	91.5	132.7	40.7	-69.6	166.6	0	0	0	111.8
686	S	32.2	Very low	33.6	Very low	72 Å²	72	137.6 Å²	137.6	50%	0.503	73%	0.726	S	S	.	*			cis	-171.7	-163	-16.8	60	0	0	0	0	111.8
687	Y	33.3	Very low	33.3	Very low	220 Å²	220	140.9 Å²	140.9	86%	0.863	73%	0.732	S	S	*	*			trans	91.4	150.4	163.1	-59.1	-63	0	0	0	120.5
688	D	32.7	Very low	33.4	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	74%	0.735	S	S	*	*				-170.5	-179.4	-84.9	-176.6	35.2	0	0	0	111.3
689	K	36.7	Very low	33.3	Very low	184 Å²	184	142.6 Å²	142.6	80%	0.8	74%	0.739	S	S	*	*			trans	87.3	151.5	172.5	-63.6	-177.9	177.3	178.3	0	118.4
690	S	30.8	Very low	33.4	Very low	94 Å²	94	138.8 Å²	138.8	66%	0.657	73%	0.734	S	S	*	*			cis	179.2	161.4	-46.1	50.9	0	0	0	0	110.7
691	K	35.6	Very low	33.3	Very low	195 Å²	195	138.4 Å²	138.4	85%	0.848	73%	0.732	S	S	*	*			trans	77.5	155.8	167.8	-63.3	-165.2	175.4	-165.4	0	119.1
692	S	32	Very low	33.3	Very low	78 Å²	78	134.6 Å²	134.6	55%	0.545	73%	0.725	S	S	.	*				-175.4	170	-51.8	46.7	0	0	0	0	110.6
693	D	35.6	Very low	33.4	Very low	128 Å²	128	134.5 Å²	134.5	68%	0.684	72%	0.721	S	S	*	*			trans	71	154.4	159.7	-43.9	-52.2	0	0	0	117.5
694	N	33.7	Very low	33.2	Very low	142 Å²	142	133.3 Å²	133.3	76%	0.759	71%	0.713	S	S	*	*			cis	170.5	160.5	-21.7	-86.1	-21.8	0	0	0	104.3
695	S	31.8	Very low	32.8	Very low	86 Å²	86	136.8 Å²	136.8	60%	0.601	72%	0.717	S	S	*	*			cis	-171.9	170.7	-12.4	49.1	0	0	0	0	109.3
696	N	33.3	Very low	32.4	Very low	142 Å²	142	134.6 Å²	134.6	76%	0.759	71%	0.71	S	S	*	*			trans	74.4	157	161.6	-48.3	-26.4	0	0	0	118.8
697	H	31.1	Very low	32.2	Very low	175 Å²	175	138.4 Å²	138.4	81%	0.81	72%	0.724	S	S	*	*			cis	-163.7	147.2	-45	-139	-86.2	0	0	0	109.2
698	P	36	Very low	32	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	71%	0.713	S	S	*	*			trans	-114.7	161.1	-173.4	40.3	-33.4	0	0	0	116.8
699	L	31.3	Very low	31.8	Very low	165 Å²	165	131.6 Å²	131.6	86%	0.864	71%	0.713	S	S	*	*			trans	-161.4	164.2	171.8	-73.3	-176.4	0	0	0	108.8
700	I	32.3	Very low	31.3	Very low	134 Å²	134	127.7 Å²	127.7	69%	0.687	71%	0.708	S	S	*	*			cis	-169.1	166.6	-32.1	-153	-174.8	0	0	0	108.8
701	N	31.1	Very low	31.2	Very low	122 Å²	122	129.7 Å²	129.7	65%	0.652	71%	0.711	S	S	*	*			trans	65	118.9	165.6	-73.7	23.4	0	0	0	119.4
702	T	31.5	Very low	31	Very low	107 Å²	107	127 Å²	127	66%	0.656	70%	0.704	S	S	*	*				73.2	147.7	78.4	71.7	0	0	0	0	113.9
703	E	33.3	Very low	30.9	Very low	165 Å²	165	129.7 Å²	129.7	77%	0.771	71%	0.712	S	S	*	*			cis	-156	-179.7	14.4	-108.4	134.7	-73.2	0	0	108.1
704	S	29.6	Very low	30.7	Very low	76 Å²	76	130 Å²	130	53%	0.531	71%	0.714	S	S	.	*			cis	-172.8	165.2	-35.7	60.4	0	0	0	0	111.2
705	F	29.5	Very low	30.7	Very low	185 Å²	185	129.9 Å²	129.9	81%	0.811	71%	0.713	S	S	*	*			trans	61.3	161.1	162.3	-65.8	-64.2	0	0	0	121.2
706	T	28.1	Very low	30.7	Very low	104 Å²	104	132.8 Å²	132.8	64%	0.638	72%	0.717	S	S	*	*				-165.6	158.3	-53.3	20	0	0	0	0	114.1
707	I	27.2	Very low	30.7	Very low	152 Å²	152	132.3 Å²	132.3	78%	0.779	71%	0.71	S	S	*	*			trans	76.8	138.3	141.4	-73.9	161.9	0	0	0	122.1
708	A	29.6	Very low	30.7	Very low	77 Å²	77	133 Å²	133	64%	0.636	71%	0.71	S	S	*	*			trans	65.2	155.5	156.2	0	0	0	0	0	121.2
709	D	27.7	Very low	30.4	Very low	146 Å²	146	131.9 Å²	131.9	78%	0.781	71%	0.705	S	S	*	*			cis	-166	170.7	-35.4	-102.5	-41.8	0	0	0	110.1
710	C	27.5	Very low	30.4	Very low	102 Å²	102	130 Å²	130	69%	0.689	70%	0.7	S	S	*	*			trans	63.8	108.6	157.7	-76.5	0	0	0	0	123.1
711	D	28.4	Very low	30.4	Very low	135 Å²	135	129.4 Å²	129.4	72%	0.722	71%	0.708	S	S	*	*				81.9	129.8	111.4	-68.4	-31.5	0	0	0	126.5
712	I	30.7	Very low	30.2	Very low	139 Å²	139	131.6 Å²	131.6	71%	0.713	72%	0.718	S	S	*	*			trans	79.9	98.1	138.4	-63.4	165.4	0	0	0	121.7
713	N	30.6	Very low	30.3	Very low	134 Å²	134	131.4 Å²	131.4	72%	0.717	72%	0.719	S	S	*	*				48.5	160.3	122.6	-57.7	-2.4	0	0	0	126.3
714	D	31.4	Very low	30.1	Very low	135 Å²	135	131.5 Å²	131.5	72%	0.722	72%	0.724	S	S	*	*			trans	74.2	150.3	150.3	-68.7	-11.1	0	0	0	119.3
715	L	32.4	Very low	30.1	Very low	139 Å²	139	133.4 Å²	133.4	73%	0.728	74%	0.737	S	S	*	*			cis	-155.7	-176.8	-16.7	-95.5	162.6	0	0	0	105.3
716	Q	32.4	Very low	30.1	Very low	148 Å²	148	129.1 Å²	129.1	69%	0.692	73%	0.73	S	S	*	*			cis	-160	180	-0.8	-129.9	179.5	-78.4	0	0	104.7
717	E	33.9	Very low	30.2	Very low	132 Å²	132	133 Å²	133	62%	0.617	74%	0.741	S	S	*	*			cis	-167.3	167.9	-15.4	-157.3	-150.8	-82.2	0	0	107.4	C719	E717-C719 PolarHBondContact OE2-N 3.09Å
718	K	30.8	Very low	30.3	Very low	188 Å²	188	131.3 Å²	131.3	82%	0.817	74%	0.743	S	S	*	*				-165.9	116.9	128	-141.2	134.8	-173.6	172.6	0	116
719	C	29.9	Very low	30.3	Very low	85 Å²	85	133.3 Å²	133.3	57%	0.574	75%	0.749	S	S	*	*			trans	60.8	144.2	144.3	-61.9	0	0	0	0	120	E717	E717-C719 PolarHBondContact OE2-N 3.09Å
720	T	31	Very low	30.5	Very low	125 Å²	125	132.6 Å²	132.6	77%	0.767	76%	0.756	S	S	*	*			cis	-162.4	163.5	-5.7	11.2	0	0	0	0	110.8
721	S	32.6	Very low	30.6	Very low	121 Å²	121	133.2 Å²	133.2	85%	0.846	76%	0.761	S	S	*	*			trans	76.9	149	161.6	75.7	0	0	0	0	120.3
722	L	26.9	Very low	30.9	Very low	168 Å²	168	131 Å²	131	88%	0.88	76%	0.762	S	S	*	*			trans	-126.9	-178.2	-166.5	-69.9	168.7	0	0	0	108.4
723	P	33.7	Very low	30.8	Very low	104 Å²	104	129.5 Å²	129.5	68%	0.675	76%	0.764	S	S	*	*			cis	-137.7	175.9	6.1	33.9	-11.3	0	0	0	117.4
724	L	28.4	Very low	30.8	Very low	166 Å²	166	128.4 Å²	128.4	87%	0.869	77%	0.766	S	S	*	*			trans	33.5	120.8	146.2	-66.2	155.1	0	0	0	118.4
725	S	29.5	Very low	30.8	Very low	116 Å²	116	127.3 Å²	127.3	81%	0.811	77%	0.769	S	S	*	*				-168.1	-176.1	53	56.7	0	0	0	0	112.6
726	S	28.6	Very low	30.8	Very low	95 Å²	95	125.5 Å²	125.5	66%	0.664	77%	0.768	S	S	*	*			trans	-80.4	141.7	-166.5	55.9	0	0	0	0	116.3
727	H	31.1	Very low	30.8	Very low	187 Å²	187	125.6 Å²	125.6	87%	0.866	78%	0.779	S	S	*	*				-166.8	149.3	115.1	-91.8	-53.7	0	0	0	111.8
728	S	30.2	Very low	30.8	Very low	116 Å²	116	125.8 Å²	125.8	81%	0.811	79%	0.789	S	S	*	*			trans	-83.2	151.1	-165.2	-49	0	0	0	0	114.7
729	P	29.5	Very low	30.7	Very low	119 Å²	119	119.6 Å²	119.6	77%	0.773	78%	0.779	S	S	*	*			trans	-90.5	151.4	-175.9	35.7	-36.3	0	0	0	114.3
730	S	32	Very low	30.7	Very low	131 Å²	131	124.9 Å²	124.9	92%	0.916	79%	0.792	S	S	*	*			trans	-165.6	100.1	150.5	1	0	0	0	0	111.4
731	S	29.1	Very low	30.8	Very low	114 Å²	114	126.8 Å²	126.8	80%	0.797	79%	0.79	S	S	*	*			trans	-120.8	168.8	173.2	58.6	0	0	0	0	110.8
732	A	34.8	Very low	30.8	Very low	90 Å²	90	131.7 Å²	131.7	74%	0.744	79%	0.79	S	S	*	*			trans	58.3	89	-172.6	0	0	0	0	0	114.2
733	S	28.1	Very low	31	Very low	107 Å²	107	130.5 Å²	130.5	75%	0.748	79%	0.785	S	S	*	*			cis	79.4	134.9	27.5	111.9	0	0	0	0	116.6
734	S	30.1	Very low	30.9	Very low	110 Å²	110	129.3 Å²	129.3	77%	0.769	78%	0.777	S	S	*	*			trans	79.2	76.1	152	-47.6	0	0	0	0	121.5
735	S	32.8	Very low	31	Very low	113 Å²	113	130.2 Å²	130.2	79%	0.79	77%	0.774	S	S	*	*				-167.8	129.7	125.6	42.8	0	0	0	0	109.7
736	S	30.9	Very low	31.1	Very low	101 Å²	101	130.1 Å²	130.1	71%	0.706	77%	0.774	S	S	*	*			cis	87	104.1	28.4	87.7	0	0	0	0	115.2
737	T	33	Very low	31.2	Very low	149 Å²	149	129.6 Å²	129.6	91%	0.914	77%	0.77	S	S	*	*			trans	-145.1	99.5	150.9	-70	0	0	0	0	106.6
738	V	33.6	Very low	31.3	Very low	137 Å²	137	128.5 Å²	128.5	83%	0.83	77%	0.77	S	S	*	*			trans	-94.6	143.6	178.8	171.4	0	0	0	0	109.1
739	G	29.6	Very low	31.3	Very low	58 Å²	58	128.1 Å²	128.1	60%	0.598	77%	0.768	S	S	*	*			trans	112.5	163.3	152.4	0	0	0	0	0	117.1
740	F	28.7	Very low	31.4	Very low	196 Å²	196	131.8 Å²	131.8	86%	0.86	77%	0.774	S	S	*	*			trans	66.7	56.6	169.5	-47.6	-66.7	0	0	0	117.7
741	F	34.1	Very low	31.3	Very low	165 Å²	165	128.1 Å²	128.1	72%	0.724	76%	0.758	S	S	*	*				-135.4	133.1	105.1	-90.3	-64.3	0	0	0	111.4	K442	K442-F741 HydrophobicContact CD-CE1 4.21Å; K442-F741 HydrophobicContact CD-CE2 4.18Å; K442-F741 HydrophobicContact CD-CZ 3.89Å; K442-F741 VanDerWaalsContact NZ-CE1 3.29Å
742	R	31.6	Very low	31.3	Very low	223 Å²	223	128.2 Å²	128.2	84%	0.842	75%	0.753	S	S	*	*			trans	-70.6	146.1	156.1	-77	176.3	162.2	-173	-6.6	108.2	P744	R742-P744 VanDerWaalsContact C-CD 3.47Å; R742-P744 WeakPolarHBondContact O-CD 3.49Å
743	D	32.5	Very low	30.9	Very low	144 Å²	144	131.4 Å²	131.4	77%	0.77	76%	0.757	S	S	*	*			trans	-94.1	97.8	151.1	-65.1	-41.3	0	0	0	108.8
744	P	31.7	Very low	30.9	Very low	79 Å²	79	133.7 Å²	133.7	51%	0.513	76%	0.759	S	S	.	*			trans	-69.3	158.5	137.6	34.7	-30.4	0	0	0	108.6	R742	R742-P744 VanDerWaalsContact C-CD 3.47Å; R742-P744 WeakPolarHBondContact O-CD 3.49Å
745	F	30.2	Very low	30.9	Very low	184 Å²	184	134.8 Å²	134.8	81%	0.807	76%	0.757	S	S	*	*			trans	70.2	46.8	178	-38	-67.4	0	0	0	115.6
746	S	30.9	Very low	30.6	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	76%	0.764	S	S	*	*			trans	-109.8	68.9	138	-174.6	0	0	0	0	107.5
747	S	30.9	Very low	30.5	Very low	83 Å²	83	134.9 Å²	134.9	58%	0.58	76%	0.757	S	S	*	*			trans	-133.7	55.8	-177.6	61.8	0	0	0	0	109.2	S749	S747-S749 PolarHBondContact O-N 3.41Å
748	D	32.4	Very low	30.3	Very low	164 Å²	164	135 Å²	135	88%	0.877	75%	0.753	S	S	*	*			trans	-70	85.4	163.7	-70.5	-32.1	0	0	0	107.5	E750	D748-E750 PolarHBondContact O-N 2.84Å
749	S	31	Very low	30.2	Very low	108 Å²	108	136.3 Å²	136.3	76%	0.755	75%	0.753	S	S	*	*			trans	-76.7	95.7	173.6	54.9	0	0	0	0	109.1	S747 G751	S747-S749 PolarHBondContact O-N 3.41Å; S749-G751 PolarHBondContact O-N 3.11Å
750	E	32.4	Very low	30.2	Very low	196 Å²	196	142 Å²	142	92%	0.916	76%	0.761	S	S	*	*			trans	-68.7	67.1	151.5	-71.4	-158	131.5	0	0	109.1	D748 T752	D748-E750 PolarHBondContact O-N 2.84Å; E750-T752 PolarHBondContact O-N 3.11Å; E750-T752 VanDerWaalsContact O-N 3.1Å
751	G	28.3	Very low	30.3	Very low	55 Å²	55	139.7 Å²	139.7	57%	0.567	76%	0.757	S	S	*	*			trans	-84.3	55.2	-177.4	0	0	0	0	0	112.7	S749	S749-G751 PolarHBondContact O-N 3.11Å
752	T	29.7	Very low	30.2	Very low	115 Å²	115	135.4 Å²	135.4	71%	0.706	75%	0.747	S	S	*	*			trans	-138.2	78.1	172.4	-48.5	0	0	0	0	108.9	E750	E750-T752 PolarHBondContact O-N 3.11Å; E750-T752 VanDerWaalsContact O-N 3.1Å
753	L	26.8	Very low	30.2	Very low	158 Å²	158	128.7 Å²	128.7	83%	0.827	73%	0.726	S	S	*	*				44.6	75.7	90.4	-68	173.4	0	0	0	113.2
754	I	28.2	Very low	30.2	Very low	154 Å²	154	125.8 Å²	125.8	79%	0.79	71%	0.707	S	S	*	*			trans	-118.3	86.3	161.1	-57.7	-176.6	0	0	0	109.2
755	N	29.5	Very low	30.3	Very low	134 Å²	134	127.2 Å²	127.2	72%	0.717	72%	0.715	S	S	*	*			trans	28.5	87.9	151.5	-61.8	-7.7	0	0	0	119.2	S757	N755-S757 PolarHBondContact O-N 2.84Å
756	S	26.5	Very low	30.4	Very low	136 Å²	136	124.8 Å²	124.8	95%	0.951	71%	0.71	S	S	*	*			trans	-77.4	67.6	152.3	-52.6	0	0	0	0	110.8
757	S	28.7	Very low	30.5	Very low	79 Å²	79	125.7 Å²	125.7	55%	0.552	71%	0.706	S	S	*	*			trans	-149.4	71.6	-175.1	66.6	0	0	0	0	114.7	N755	N755-S757 PolarHBondContact O-N 2.84Å
758	N	29.6	Very low	30.7	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	71%	0.712	S	S	*	*			trans	-173.4	102	155.7	-92.3	-39.6	0	0	0	105.9
759	I	32.1	Very low	30.8	Very low	163 Å²	163	127.3 Å²	127.3	84%	0.836	71%	0.707	S	S	*	*				-167.1	120.4	95.4	-79.5	150.2	0	0	0	103.7
760	K	29.5	Very low	31	Very low	179 Å²	179	128.4 Å²	128.4	78%	0.778	70%	0.703	S	S	*	*				67.7	87.2	51.7	-142.8	-173.4	-175.1	-177.2	0	110.6
761	L	30.9	Very low	30.9	Very low	147 Å²	147	124.5 Å²	124.5	77%	0.77	69%	0.689	S	S	*	*				-164.4	156.4	82.1	-92.3	80.6	0	0	0	107.4
762	S	30.5	Very low	31.1	Very low	74 Å²	74	131.8 Å²	131.8	52%	0.517	70%	0.699	S	S	.	*			cis	67.2	150.2	42.3	80.7	0	0	0	0	114.4
763	E	31.5	Very low	31.1	Very low	83 Å²	83	131.3 Å²	131.3	39%	0.388	70%	0.7	S	S	.	*			cis	-167.9	148.4	-18.8	-114.1	146.4	-141.3	0	0	107.3	S14 S15 M16 Q17	S14-E763 VanDerWaalsContact OG-CA 3.28Å; S14-E763 WeakPolarHBondContact OG-CA 3.4Å; S14-E763 VanDerWaalsContact OG-CG 3.27Å; S14-E763 WeakPolarHBondContact OG-CG 3.46Å; S15-E763 WeakPolarHBondContact OG-CG 3.37Å; M16-E763 WeakPolarHBondContact CA-OE1 3.31Å; M16-E763 PolarHBondContact N-OE1 2.76Å; Q17-E763 PolarHBondContact NE2-OE2 3.32Å
764	Q	33.4	Very low	31.2	Very low	82 Å²	82	128.2 Å²	128.2	38%	0.383	69%	0.692	S	S	.	*			cis	-159	-177.6	-7.6	178.1	165.1	-10.1	0	0	110	S14 S15	S14-Q764 WeakPolarHBondContact OG-CA 3.33Å; S14-Q764 WeakPolarHBondContact OG-CB 3.46Å; S15-Q764 PolarHBondContact OG-OE1 3.43Å
765	T	32.9	Very low	31.3	Very low	109 Å²	109	126.1 Å²	126.1	67%	0.669	69%	0.687	S	S	*	*			trans	105	149.2	154.5	74	0	0	0	0	118.3
766	N	32.7	Very low	31.2	Very low	134 Å²	134	130.5 Å²	130.5	72%	0.717	70%	0.695	S	S	*	*			cis	-159.8	-176.3	-4.9	-118.8	-1.6	0	0	0	114.7
767	N	34	Very low	31.2	Very low	134 Å²	134	127.8 Å²	127.8	72%	0.717	68%	0.681	S	S	*	*			trans	86.3	99.8	164.5	-65.7	-4.5	0	0	0	117.7
768	T	34.5	Very low	31.1	Very low	116 Å²	116	128.6 Å²	128.6	71%	0.712	69%	0.686	S	S	*	*				72.2	141.6	88.2	56.2	0	0	0	0	114.5
769	Q	34.6	Very low	31.1	Very low	164 Å²	164	128.5 Å²	128.5	77%	0.766	68%	0.681	S	S	*	*			cis	-159.3	156.3	4.3	-113.3	172.4	19	0	0	104.9
770	I	33.8	Very low	31	Very low	132 Å²	132	130.9 Å²	130.9	68%	0.677	68%	0.68	S	S	*	*			cis	-177.3	154	49.6	-123.8	154.8	0	0	0	109.3
771	N	31.9	Very low	31.1	Very low	113 Å²	113	127.3 Å²	127.3	60%	0.604	68%	0.678	S	S	*	*			trans	-0.5	156.2	151.1	-63.8	-53.3	0	0	0	121.6
772	R	32	Very low	31.4	Very low	208 Å²	208	125.2 Å²	125.2	79%	0.785	67%	0.674	S	S	*	*			cis	-169.1	167	5.6	-116	164.1	-158.3	175	-1.4	112
773	S	29.8	Very low	31.4	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	69%	0.685	S	S	*	*			trans	24.6	150.4	135.9	-53.5	0	0	0	0	122.8
774	S	28.9	Very low	31.4	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	70%	0.703	S	S	*	*			cis	-179.3	-172.9	-7.8	52.1	0	0	0	0	111.1
775	T	29.9	Very low	31.2	Very low	109 Å²	109	132.4 Å²	132.4	67%	0.669	72%	0.719	S	S	*	*			trans	75.1	122.5	147	27	0	0	0	0	121.4
776	Y	27.4	Very low	31.3	Very low	226 Å²	226	132 Å²	132	89%	0.886	72%	0.721	S	S	*	*				49.7	148	127	-76.6	-126	0	0	0	120.2
777	A	27.1	Very low	31.3	Very low	80 Å²	80	130.6 Å²	130.6	66%	0.661	72%	0.717	S	S	*	*			cis	-166	-174	-11.1	0	0	0	0	0	109.8
778	S	26.1	Very low	31.4	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	72%	0.718	S	S	*	*			trans	-24.9	136.4	166.6	-46.1	0	0	0	0	117.4
779	H	29.3	Very low	31.4	Very low	152 Å²	152	133.3 Å²	133.3	70%	0.704	72%	0.718	S	S	*	*				172.1	152.5	102.6	-95.1	-70.3	0	0	0	115.4
780	Y	30.3	Very low	31.5	Very low	212 Å²	212	131 Å²	131	83%	0.831	71%	0.711	S	S	*	*			trans	48	130	150.3	-70.3	-61.1	0	0	0	123.8
781	S	30.6	Very low	31.4	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	71%	0.714	S	S	*	*			trans	-73.4	-173.6	152	-35.9	0	0	0	0	110.6
782	P	39.1	Very low	31.6	Very low	103 Å²	103	130 Å²	130	67%	0.669	71%	0.713	S	S	*	*			cis	-143	-171.2	3	37.7	-15	0	0	0	116.6
783	N	28.9	Very low	31.6	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	71%	0.714	S	S	*	*			trans	86.6	148.9	133.6	-89.9	-7.8	0	0	0	124.6
784	L	31.9	Very low	31.6	Very low	144 Å²	144	126.4 Å²	126.4	75%	0.754	71%	0.714	S	S	*	*			trans	83.9	109.5	145.7	-76.8	159.7	0	0	0	122.2
785	S	29	Very low	31.9	Very low	103 Å²	103	127 Å²	127	72%	0.72	72%	0.715	S	S	*	*			trans	65.6	145.5	133.4	-63.4	0	0	0	0	119.6
786	S	35.5	Very low	31.8	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	72%	0.718	S	S	*	*			cis	-147.8	139.6	37.9	47.6	0	0	0	0	113.3
787	T	32.6	Very low	32.1	Very low	104 Å²	104	125.7 Å²	125.7	64%	0.638	71%	0.712	S	S	*	*				64	117.4	101	-37.6	0	0	0	0	112.9	K789	T787-K789 HydrophobicContact CG2-CG 4.45Å
788	I	35.8	Very low	32.1	Very low	146 Å²	146	131.4 Å²	131.4	75%	0.749	72%	0.717	S	S	*	*				-159.6	117.6	84.8	-87.7	169.9	0	0	0	107.2
789	K	35.7	Very low	32.3	Very low	160 Å²	160	133.1 Å²	133.1	70%	0.696	72%	0.718	S	S	*	*				61.9	140.2	100	-63.9	180	179.9	177.3	0	114	T787	T787-K789 HydrophobicContact CG2-CG 4.45Å
790	N	35.2	Very low	32.4	Very low	116 Å²	116	133.9 Å²	133.9	62%	0.62	72%	0.719	S	S	*	*			cis	-164.3	154.6	7.6	-118.8	6.6	0	0	0	111
791	N	32.6	Very low	32.5	Very low	138 Å²	138	128.7 Å²	128.7	74%	0.738	71%	0.714	S	S	*	*			trans	57.8	150.8	138.9	-65.4	2	0	0	0	121.1
792	S	35.2	Very low	32.6	Very low	85 Å²	85	132.9 Å²	132.9	59%	0.594	72%	0.719	S	S	*	*			cis	-172.9	155.9	-10	46.3	0	0	0	0	111.1
793	N	33.8	Very low	32.2	Very low	151 Å²	151	133.7 Å²	133.7	81%	0.807	73%	0.727	S	S	*	*			trans	64.9	125.6	154.4	-56.4	-13.7	0	0	0	117.4
794	A	29.8	Very low	32.5	Very low	88 Å²	88	131.9 Å²	131.9	73%	0.727	73%	0.726	S	S	*	*				84.1	160.8	52.8	0	0	0	0	0	112.5
795	P	35.3	Very low	32.7	Very low	106 Å²	106	136.6 Å²	136.6	69%	0.688	73%	0.733	S	S	*	*				-138.5	-168.7	-98.5	35.4	-12.7	0	0	0	115.3
796	I	26.8	Very low	32.9	Very low	142 Å²	142	135.4 Å²	135.4	73%	0.728	74%	0.737	S	S	*	*			trans	69.5	102.3	162.2	-47	160.1	0	0	0	117.4
797	H	33.3	Very low	32.7	Very low	165 Å²	165	141.5 Å²	141.5	76%	0.764	75%	0.745	S	S	*	*				179.6	126.6	126.5	-112.1	-106.3	0	0	0	107.4
798	R	27	Very low	32.7	Very low	201 Å²	201	145.1 Å²	145.1	76%	0.758	75%	0.752	S	S	*	*			cis	82.4	118.1	37	-154.7	-162.9	-174.3	170.1	3.4	113.1
799	L	31.7	Very low	33	Very low	130 Å²	130	144 Å²	144	68%	0.681	75%	0.752	S	S	*	*			trans	78.4	146.9	175.4	-44.6	-175.1	0	0	0	114.6
800	K	31	Very low	32.9	Very low	169 Å²	169	141 Å²	141	74%	0.735	75%	0.749	S	S	*	*			cis	-164.5	123.7	-10.8	-120.4	173	-179	175	0	111.7
801	S	31.8	Very low	33.2	Very low	103 Å²	103	146.3 Å²	146.3	72%	0.72	76%	0.76	S	S	*	*			trans	62.8	167.3	142.2	75.9	0	0	0	0	119
802	K	33	Very low	33.3	Very low	192 Å²	192	149 Å²	149	84%	0.835	76%	0.76	S	S	*	*			cis	-142.5	159.7	2.6	-63	172.6	-176.5	171.2	0	110
803	S	31.5	Very low	33.3	Very low	121 Å²	121	150.5 Å²	150.5	85%	0.846	76%	0.761	S	S	*	*			trans	68.1	152.6	159	-122.6	0	0	0	0	117.1
804	S	34.5	Very low	33.1	Very low	104 Å²	104	152.7 Å²	152.7	73%	0.727	76%	0.758	S	S	*	*			cis	-134.9	-176.7	8	74.4	0	0	0	0	114.3
805	R	35.9	Very low	33.4	Very low	243 Å²	243	155 Å²	155	92%	0.917	76%	0.763	S	S	*	*			trans	-56.2	153.4	-172.9	-57.6	150.5	-179.9	161.9	-2.7	112.5
806	G	32.3	Very low	33.1	Very low	78 Å²	78	162.1 Å²	162.1	80%	0.804	78%	0.776	S	S	*	*			cis	-163.8	160.2	1.6	0	0	0	0	0	111.8
807	R	32.7	Very low	33.4	Very low	230 Å²	230	158.6 Å²	158.6	87%	0.868	78%	0.775	S	S	*	*			trans	-148.1	162.7	-172.7	-162.8	-158	-68.8	-158.3	-0.3	109.1
808	K	32.4	Very low	33.3	Very low	179 Å²	179	161 Å²	161	78%	0.778	78%	0.783	S	S	*	*			trans	94.5	147.3	166.5	-54.9	163.5	-175.9	177.6	0	114
809	T	41.7	Very low	33.6	Very low	123 Å²	123	161.5 Å²	161.5	76%	0.755	79%	0.791	S	S	*	*			cis	-158.4	164.1	-4	9	0	0	0	0	111.1
810	P	34.3	Very low	33.7	Very low	97 Å²	97	161.3 Å²	161.3	63%	0.63	80%	0.801	S	S	*	*			trans	-63	151.9	171.8	-21.3	34.7	0	0	0	114	W812	P810-W812 VanDerWaalsContact C-N 3.35Å; P810-W812 PolarHBondContact O-N 3.05Å; P810-W812 VanDerWaalsContact O-N 3.15Å
811	W	40.6	Very low	33.7	Very low	227 Å²	227	163 Å²	163	86%	0.86	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	16.4	-160.3	60.3	-74.6	0	0	0	117.4
812	W	35.1	Very low	33.7	Very low	196 Å²	196	163.9 Å²	163.9	74%	0.742	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	29.6	-171.2	63.5	63.8	0	0	0	117.9	P810	P810-W812 VanDerWaalsContact C-N 3.35Å; P810-W812 PolarHBondContact O-N 3.05Å; P810-W812 VanDerWaalsContact O-N 3.15Å
813	D	34.1	Very low	33.6	Very low	115 Å²	115	162.1 Å²	162.1	62%	0.615	81%	0.806	S	S	*	*	S	Bend	trans	-145.8	143.5	165	-153.9	2.5	0	0	0	115.4
814	R	31.2	Very low	33.6	Very low	198 Å²	198	162.9 Å²	162.9	75%	0.747	81%	0.806	S	S	*	*			trans	43.4	101.4	168	-71.8	148.5	-139.8	-132.5	6.7	120.5
815	T	35.1	Very low	33.5	Very low	135 Å²	135	161 Å²	161	83%	0.828	79%	0.79	S	S	*	*				-166.1	131.6	102.6	23.6	0	0	0	0	107.5
816	R	29.5	Very low	33.3	Very low	256 Å²	256	156.1 Å²	156.1	97%	0.966	79%	0.787	S	S	*	*			cis	60.5	45.1	18.9	-151.2	-178	-79.8	-140.4	1.8	114.7
817	G	33.5	Very low	33.2	Very low	68 Å²	68	157.9 Å²	157.9	70%	0.701	78%	0.778	S	S	*	*			trans	-124	133.5	163.7	0	0	0	0	0	110.2
818	K	31.5	Very low	33.1	Very low	215 Å²	215	153.7 Å²	153.7	94%	0.935	77%	0.773	S	S	*	*			trans	-70.6	135.1	-169.8	-55.1	169.9	-177.4	175.5	0	112.7
819	K	33.3	Very low	33.1	Very low	212 Å²	212	150.5 Å²	150.5	92%	0.922	77%	0.765	S	S	*	*			trans	-155.7	167.8	144.5	-111.2	170.8	-175.4	-175.1	0	110.9
820	S	32.7	Very low	32.5	Very low	126 Å²	126	150.7 Å²	150.7	88%	0.881	76%	0.761	S	S	*	*			trans	-74.6	170.7	-145.5	-59.3	0	0	0	0	118.2
821	K	31	Very low	32.3	Very low	206 Å²	206	152.4 Å²	152.4	90%	0.896	76%	0.763	S	S	*	*			trans	-79.1	148.3	-176.6	-50	164.1	-175.4	168.8	0	112.3
822	S	31.5	Very low	31.7	Very low	120 Å²	120	149.4 Å²	149.4	84%	0.839	76%	0.759	S	S	*	*				-131.1	140.6	125.2	-174.1	0	0	0	0	108.2
823	K	31.4	Very low	31.2	Very low	156 Å²	156	145.2 Å²	145.2	68%	0.678	76%	0.758	S	S	*	*			trans	-156.9	84.2	-177.4	-165	-162.1	-179.8	-121.1	0	111.3	T825	K823-T825 VanDerWaalsContact CD-OG1 3.3Å; K823-T825 WeakPolarHBondContact CD-OG1 3.49Å; K823-T825 VanDerWaalsContact CE-OG1 3.27Å; K823-T825 WeakPolarHBondContact CE-OG1 3.28Å; K823-T825 WeakPolarHBondContact CG-OG1 3.48Å; K823-T825 VanDerWaalsContact NZ-CG2 3.31Å; K823-T825 PolarHBondContact NZ-OG1 3.08Å; K823-T825 PolarHBondContact O-N 3.19Å; K823-T825 VanDerWaalsContact O-N 3.15Å; K823-T825 PolarHBondContact O-OG1 2.88Å
824	V	31.9	Very low	31	Very low	137 Å²	137	146 Å²	146	83%	0.83	76%	0.763	S	S	*	*			trans	-57.6	119.9	162.2	178.8	0	0	0	0	107.5
825	T	31.6	Very low	30.9	Very low	64 Å²	64	144.5 Å²	144.5	39%	0.393	76%	0.762	S	S	.	*			trans	-136.5	100.7	174.7	-38.6	0	0	0	0	108.8	K823 N827	K823-T825 VanDerWaalsContact CD-OG1 3.3Å; K823-T825 WeakPolarHBondContact CD-OG1 3.49Å; K823-T825 VanDerWaalsContact CE-OG1 3.27Å; K823-T825 WeakPolarHBondContact CE-OG1 3.28Å; K823-T825 WeakPolarHBondContact CG-OG1 3.48Å; K823-T825 VanDerWaalsContact NZ-CG2 3.31Å; K823-T825 PolarHBondContact NZ-OG1 3.08Å; K823-T825 PolarHBondContact O-N 3.19Å; K823-T825 VanDerWaalsContact O-N 3.15Å; K823-T825 PolarHBondContact O-OG1 2.88Å; T825-N827 VanDerWaalsContact CG2-OD1 3.26Å; T825-N827 WeakPolarHBondContact CG2-OD1 3.39Å; T825-N827 PolarHBondContact O-N 3.46Å
826	T	32.4	Very low	30.8	Very low	141 Å²	141	146.1 Å²	146.1	87%	0.865	76%	0.759	S	S	*	*			trans	-78.5	99.5	164.3	-40.7	0	0	0	0	107.1
827	N	29	Very low	30.8	Very low	114 Å²	114	140.3 Å²	140.3	61%	0.61	75%	0.747	S	S	*	*			trans	-84.4	129.4	178.4	-96.6	1.5	0	0	0	110.6	T825	T825-N827 VanDerWaalsContact CG2-OD1 3.26Å; T825-N827 WeakPolarHBondContact CG2-OD1 3.39Å; T825-N827 PolarHBondContact O-N 3.46Å
828	N	32.3	Very low	30.5	Very low	142 Å²	142	146.5 Å²	146.5	76%	0.759	76%	0.758	S	S	*	*				-166.5	132.4	128.4	-92.2	-23.9	0	0	0	107.5
829	N	31.8	Very low	30.3	Very low	113 Å²	113	139.3 Å²	139.3	60%	0.604	75%	0.745	S	S	*	*				63.4	128	54	-54.4	-36.2	0	0	0	111
830	N	29.5	Very low	30.1	Very low	127 Å²	127	137 Å²	137	68%	0.679	74%	0.742	S	S	*	*			cis	-165.8	171.6	-4.8	-130.1	-8.6	0	0	0	109.4
831	I	28.5	Very low	30	Very low	132 Å²	132	135.6 Å²	135.6	68%	0.677	73%	0.732	S	S	*	*			trans	36.4	136.4	137.1	-65.7	168.9	0	0	0	118.9
832	Q	28	Very low	29.9	Very low	164 Å²	164	135.9 Å²	135.9	77%	0.766	73%	0.729	S	S	*	*			cis	-172.1	171	-5.8	172.8	168.6	-51.6	0	0	108.4
833	C	25	Very low	30.1	Very low	109 Å²	109	137.5 Å²	137.5	74%	0.736	72%	0.723	S	S	*	*			trans	-39.9	148.4	174.8	-44.2	0	0	0	0	116.4
834	D	30.4	Very low	30.4	Very low	131 Å²	131	139.3 Å²	139.3	70%	0.701	73%	0.731	S	S	*	*				-147	176	98.8	-133.5	-42.1	0	0	0	112.2
835	K	28.9	Very low	30.7	Very low	167 Å²	167	139.5 Å²	139.5	73%	0.726	73%	0.728	S	S	*	*			trans	-78.4	151.1	-170.7	-41.2	116.5	-168.7	129.2	0	112.4
836	H	32.1	Very low	31.1	Very low	168 Å²	168	140.6 Å²	140.6	78%	0.778	74%	0.738	S	S	*	*				-166.9	146.5	116.3	-103.7	-71.8	0	0	0	112.2
837	N	29.8	Very low	31.5	Very low	134 Å²	134	139.6 Å²	139.6	72%	0.717	73%	0.726	S	S	*	*			trans	49	115.1	155.1	-56.6	9.3	0	0	0	121.2
838	E	27.2	Very low	32	Very low	198 Å²	198	138.7 Å²	138.7	93%	0.925	73%	0.725	S	S	*	*			trans	12.9	137.9	132.6	-51.3	-175.7	141.5	0	0	120.2
839	G	28.2	Very low	32.4	Very low	64 Å²	64	136.1 Å²	136.1	66%	0.66	71%	0.708	S	S	*	*			trans	162.5	-32.1	157.3	0	0	0	0	0	118.3
840	L	29.2	Very low	32.9	Very low	164 Å²	164	133 Å²	133	86%	0.859	70%	0.698	S	S	*	*			trans	-120.9	80.6	-160.8	-66	175.1	0	0	0	115
841	S	29.1	Very low	33.7	Very low	96 Å²	96	131.1 Å²	131.1	67%	0.671	69%	0.688	S	S	*	*	S	Bend	trans	-147.6	28.1	167.1	72.1	0	0	0	0	115.2
842	Y	29.4	Very low	34.2	Very low	213 Å²	213	132.3 Å²	132.3	84%	0.835	69%	0.685	S	S	*	*	S	Bend	trans	-130.8	14.1	-172.4	-68.1	-72.8	0	0	0	116.5
843	E	35.8	Very low	34.9	Very low	153 Å²	153	127 Å²	127	72%	0.715	66%	0.658	S	S	*	*	S	Bend	trans	-107.5	-33.4	-178.8	-91.3	176.6	142.8	0	0	115.9	N845 S846	E843-N845 PolarHBondContact O-N 3.33Å; E843-S846 PolarHBondContact O-N 2.96Å; E843-S846 VanDerWaalsContact O-N 3.11Å
844	K	38.1	Very low	35.9	Very low	194 Å²	194	128 Å²	128	84%	0.843	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	1.9	-171.1	-83.4	-172	172.4	-178.9	0	116.7
845	N	37.9	Very low	36.4	Very low	142 Å²	142	127.6 Å²	127.6	76%	0.759	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-17.4	172	-68.2	-13.6	0	0	0	113.2	E843 E849	E843-N845 PolarHBondContact O-N 3.33Å; N845-E849 PolarHBondContact O-N 3.33Å
846	S	41.3	Very low	37	Very low	86 Å²	86	122.8 Å²	122.8	60%	0.601	63%	0.626	S	S	*	*	H	α-helix	trans	-77.8	-37.8	-177.4	-162.7	0	0	0	0	112.1	E843 E849 A850	E843-S846 PolarHBondContact O-N 2.96Å; E843-S846 VanDerWaalsContact O-N 3.11Å; S846-E849 PolarHBondContact O-N 2.98Å; S846-A850 WeakPolarHBondContact O-CB 3.23Å; S846-A850 PolarHBondContact O-N 3.31Å
847	L	39.4	Very low	37.4	Very low	120 Å²	120	117.4 Å²	117.4	63%	0.628	60%	0.602	S	S	*	*	H	α-helix	trans	-64.1	-45	178.5	-159.4	70.8	0	0	0	111	E849 A850 D851	L847-E849 VanDerWaalsContact C-N 3.32Å; L847-E849 PolarHBondContact O-N 3Å; L847-A850 CarbonylContact O-C 3.41Å; L847-A850 WeakPolarHBondContact O-CA 3.43Å; L847-A850 WeakPolarHBondContact O-CB 3.26Å; L847-A850 PolarHBondContact O-N 3.48Å; L847-A850 VanDerWaalsContact O-N 3.09Å; L847-D851 WeakPolarHBondContact O-CB 3.38Å; L847-D851 VanDerWaalsContact O-CG 3.23Å; L847-D851 PolarHBondContact O-N 2.97Å
848	V	41	Very low	38	Very low	95 Å²	95	114.2 Å²	114.2	58%	0.576	59%	0.588	S	S	*	*	H	α-helix	trans	-63.6	-34.7	178.6	-176.2	0	0	0	0	112.5	Y852	V848-Y852 WeakPolarHBondContact O-CB 2.77Å; V848-Y852 PolarHBondContact O-N 3.47Å
849	E	39	Very low	38.7	Very low	89 Å²	89	110.1 Å²	110.1	42%	0.416	57%	0.572	S	S	.	*	H	α-helix	trans	-81.5	-21.7	175.3	-166.8	161.4	168.4	0	0	112.9	N845 S846 L847 R853	N845-E849 PolarHBondContact O-N 3.33Å; S846-E849 PolarHBondContact O-N 2.98Å; L847-E849 VanDerWaalsContact C-N 3.32Å; L847-E849 PolarHBondContact O-N 3Å; E849-R853 VanDerWaalsContact O-CB 3.3Å; E849-R853 WeakPolarHBondContact O-CB 3.31Å; E849-R853 WeakPolarHBondContact O-CD 3.43Å; E849-R853 WeakPolarHBondContact O-CG 2.85Å; E849-R853 PolarHBondContact O-N 2.99Å; E849-R853 IonicContact OE1-CZ 3.38Å; E849-R853 IonicContact OE1-NE 3.22Å; E849-R853 PolarHBondContact OE1-NE 2.77Å; E849-R853 IonicContact OE1-NH2 2.69Å; E849-R853 PolarHBondContact OE1-NH2 3.18Å
850	A	42.7	Very low	39.3	Very low	48 Å²	48	109.3 Å²	109.3	40%	0.397	56%	0.556	S	S	.	*	H	α-helix	trans	-70.3	-53.9	166.3	0	0	0	0	0	110.8	S846 L847 Y852 R853 Q854	S846-A850 WeakPolarHBondContact O-CB 3.23Å; S846-A850 PolarHBondContact O-N 3.31Å; L847-A850 CarbonylContact O-C 3.41Å; L847-A850 WeakPolarHBondContact O-CA 3.43Å; L847-A850 WeakPolarHBondContact O-CB 3.26Å; L847-A850 PolarHBondContact O-N 3.48Å; L847-A850 VanDerWaalsContact O-N 3.09Å; A850-Y852 VanDerWaalsContact C-N 3.35Å; A850-Y852 PolarHBondContact O-N 3.41Å; A850-R853 CarbonylContact O-C 3.53Å; A850-R853 PolarHBondContact O-N 2.9Å; A850-Q854 WeakPolarHBondContact O-CB 3.49Å; A850-Q854 PolarHBondContact O-N 2.78Å
851	D	46.4	Very low	39.7	Very low	86 Å²	86	106.6 Å²	106.6	46%	0.46	54%	0.543	S	S	.	.	H	α-helix	trans	-57.3	-45.7	177.9	-63.6	-28.5	0	0	0	111.2	L847 R853 Q854 F855	L847-D851 WeakPolarHBondContact O-CB 3.38Å; L847-D851 VanDerWaalsContact O-CG 3.23Å; L847-D851 PolarHBondContact O-N 2.97Å; D851-R853 VanDerWaalsContact C-N 3.32Å; D851-R853 PolarHBondContact O-N 3.01Å; D851-Q854 PolarHBondContact O-N 3.39Å; D851-F855 VanDerWaalsContact O-CB 3.26Å; D851-F855 WeakPolarHBondContact O-CB 3.27Å; D851-F855 PolarHBondContact O-N 3.47Å
852	Y	40.5	Very low	40.1	Very low	157 Å²	157	109.5 Å²	109.5	62%	0.616	55%	0.545	S	S	*	.	H	α-helix	trans	-64.4	-35.6	177	-169.8	-98.4	0	0	0	112.1	V848 A850 I856	V848-Y852 WeakPolarHBondContact O-CB 2.77Å; V848-Y852 PolarHBondContact O-N 3.47Å; A850-Y852 VanDerWaalsContact C-N 3.35Å; A850-Y852 PolarHBondContact O-N 3.41Å; Y852-I856 HydrophobicContact CD1-CG1 4.38Å; Y852-I856 HydrophobicContact CE1-CG1 4.19Å; Y852-I856 WeakPolarHBondContact O-CB 3.35Å; Y852-I856 WeakPolarHBondContact O-CG1 3.44Å; Y852-I856 PolarHBondContact O-N 3.26Å
853	R	42.4	Very low	40.3	Very low	54 Å²	54	103.9 Å²	103.9	20%	0.204	54%	0.538	C	S	.	.	H	α-helix	trans	-75.2	-31.8	173.8	-73.3	176.5	-169.8	-74.6	-1.6	112.2	E849 A850 D851 I856 N857 N1183 T1185	E849-R853 VanDerWaalsContact O-CB 3.3Å; E849-R853 WeakPolarHBondContact O-CB 3.31Å; E849-R853 WeakPolarHBondContact O-CD 3.43Å; E849-R853 WeakPolarHBondContact O-CG 2.85Å; E849-R853 PolarHBondContact O-N 2.99Å; E849-R853 IonicContact OE1-CZ 3.38Å; E849-R853 IonicContact OE1-NE 3.22Å; E849-R853 PolarHBondContact OE1-NE 2.77Å; E849-R853 IonicContact OE1-NH2 2.69Å; E849-R853 PolarHBondContact OE1-NH2 3.18Å; A850-R853 CarbonylContact O-C 3.53Å; A850-R853 PolarHBondContact O-N 2.9Å; D851-R853 VanDerWaalsContact C-N 3.32Å; D851-R853 PolarHBondContact O-N 3.01Å; R853-I856 CarbonylContact O-C 3.13Å; R853-I856 PolarHBondContact O-N 3.47Å; R853-N857 PolarHBondContact O-N 3.21Å; R853-N857 PolarHBondContact O-ND2 3.48Å; R853-N1183 PolarHBondContact NH1-OD1 2.88Å; R853-T1185 PolarHBondContact NE-OG1 3.11Å; R853-T1185 PolarHBondContact NH1-OG1 3.02Å
854	Q	45.5	Very low	40.1	Very low	128 Å²	128	102.3 Å²	102.3	60%	0.598	54%	0.538	S	S	*	.	H	α-helix	trans	-73.6	-38.6	177.4	-166.4	164	1.3	0	0	111.5	A850 D851 N857 T858	A850-Q854 WeakPolarHBondContact O-CB 3.49Å; A850-Q854 PolarHBondContact O-N 2.78Å; D851-Q854 PolarHBondContact O-N 3.39Å; Q854-N857 WeakPolarHBondContact O-CA 3.35Å; Q854-N857 WeakPolarHBondContact O-CB 3.47Å; Q854-N857 PolarHBondContact O-N 2.82Å; Q854-T858 PolarHBondContact O-N 3.02Å; Q854-T858 PolarHBondContact O-OG1 3.06Å
855	F	40.3	Very low	39.7	Very low	124 Å²	124	99.7 Å²	99.7	54%	0.544	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-41.6	168.5	-175.3	-109.6	0	0	0	112.1	D851 N857 T858 L859	D851-F855 VanDerWaalsContact O-CB 3.26Å; D851-F855 WeakPolarHBondContact O-CB 3.27Å; D851-F855 PolarHBondContact O-N 3.47Å; F855-N857 VanDerWaalsContact C-N 3.25Å; F855-N857 PolarHBondContact O-N 2.94Å; F855-T858 PolarHBondContact O-N 3.37Å; F855-T858 PolarHBondContact O-OG1 2.96Å; F855-L859 HydrophobicContact CD1-CD1 3.76Å; F855-L859 HydrophobicContact CD2-CD1 4.5Å; F855-L859 HydrophobicContact CE1-CD1 3.4Å; F855-L859 VanDerWaalsContact CE1-CD1 3.4Å; F855-L859 HydrophobicContact CE2-CD1 4.2Å; F855-L859 HydrophobicContact CG-CD1 4.3Å; F855-L859 HydrophobicContact CZ-CD1 3.65Å; F855-L859 HydrophobicContact CZ-CG 4.48Å; F855-L859 WeakPolarHBondContact O-CB 3.47Å; F855-L859 WeakPolarHBondContact O-CG 3.42Å; F855-L859 PolarHBondContact O-N 3.22Å
856	I	42.3	Very low	39.3	Very low	66 Å²	66	98.4 Å²	98.4	34%	0.338	54%	0.54	S	S	.	.	H	α-helix	trans	-70.5	-17.2	171.2	-68.5	-73.4	0	0	0	112.5	Y852 R853 R1182	Y852-I856 HydrophobicContact CD1-CG1 4.38Å; Y852-I856 HydrophobicContact CE1-CG1 4.19Å; Y852-I856 WeakPolarHBondContact O-CB 3.35Å; Y852-I856 WeakPolarHBondContact O-CG1 3.44Å; Y852-I856 PolarHBondContact O-N 3.26Å; R853-I856 CarbonylContact O-C 3.13Å; R853-I856 PolarHBondContact O-N 3.47Å; I856-R1182 PolarHBondContact O-NE 3.22Å; I856-R1182 PolarHBondContact O-NH2 3.36Å
857	N	40.4	Very low	38.8	Very low	54 Å²	54	98.6 Å²	98.6	29%	0.289	54%	0.542	S	S	.	.	H	α-helix	trans	-74.8	-60.1	166.6	-80.4	-86.3	0	0	0	110.4	R853 Q854 F855 L859 S860 D861 R1182	R853-N857 PolarHBondContact O-N 3.21Å; R853-N857 PolarHBondContact O-ND2 3.48Å; Q854-N857 WeakPolarHBondContact O-CA 3.35Å; Q854-N857 WeakPolarHBondContact O-CB 3.47Å; Q854-N857 PolarHBondContact O-N 2.82Å; F855-N857 VanDerWaalsContact C-N 3.25Å; F855-N857 PolarHBondContact O-N 2.94Å; N857-L859 VanDerWaalsContact C-N 3.26Å; N857-L859 PolarHBondContact O-N 2.94Å; N857-L859 VanDerWaalsContact O-N 3.16Å; N857-S860 WeakPolarHBondContact O-CB 3.39Å; N857-S860 PolarHBondContact O-N 2.86Å; N857-D861 PolarHBondContact O-N 3.44Å; N857-R1182 VanDerWaalsContact CA-CZ 3.41Å; N857-R1182 PolarHBondContact ND2-NE 3.45Å; N857-R1182 WeakPolarHBondContact OD1-CD 3.14Å; N857-R1182 PolarHBondContact OD1-NE 3.38Å; N857-R1182 PolarHBondContact OD1-NH1 3.22Å
858	T	42.4	Very low	38.4	Very low	68 Å²	68	96.8 Å²	96.8	42%	0.417	54%	0.544	S	S	.	.	H	α-helix	trans	-59.1	-33.4	-176.9	46.3	0	0	0	0	113.6	Q854 F855 S860 D861 Q862	Q854-T858 PolarHBondContact O-N 3.02Å; Q854-T858 PolarHBondContact O-OG1 3.06Å; F855-T858 PolarHBondContact O-N 3.37Å; F855-T858 PolarHBondContact O-OG1 2.96Å; T858-S860 PolarHBondContact O-N 3.13Å; T858-D861 PolarHBondContact O-N 2.68Å; T858-Q862 WeakPolarHBondContact O-CG 3.46Å; T858-Q862 PolarHBondContact O-N 3.03Å
859	L	41.3	Very low	37.8	Very low	112 Å²	112	97 Å²	97	59%	0.586	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-5.7	173.4	-77.5	173.5	0	0	0	115.9	F855 N857	F855-L859 HydrophobicContact CD1-CD1 3.76Å; F855-L859 HydrophobicContact CD2-CD1 4.5Å; F855-L859 HydrophobicContact CE1-CD1 3.4Å; F855-L859 VanDerWaalsContact CE1-CD1 3.4Å; F855-L859 HydrophobicContact CE2-CD1 4.2Å; F855-L859 HydrophobicContact CG-CD1 4.3Å; F855-L859 HydrophobicContact CZ-CD1 3.65Å; F855-L859 HydrophobicContact CZ-CG 4.48Å; F855-L859 WeakPolarHBondContact O-CB 3.47Å; F855-L859 WeakPolarHBondContact O-CG 3.42Å; F855-L859 PolarHBondContact O-N 3.22Å; N857-L859 VanDerWaalsContact C-N 3.26Å; N857-L859 PolarHBondContact O-N 2.94Å; N857-L859 VanDerWaalsContact O-N 3.16Å
860	S	40.4	Very low	37.3	Very low	47 Å²	47	101.7 Å²	101.7	33%	0.329	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.3	-18	176.5	173.8	0	0	0	0	112.8	N857 T858 N1181 R1182	N857-S860 WeakPolarHBondContact O-CB 3.39Å; N857-S860 PolarHBondContact O-N 2.86Å; T858-S860 PolarHBondContact O-N 3.13Å; S860-N1181 PolarHBondContact OG-ND2 3.33Å; S860-R1182 PolarHBondContact OG-NH2 2.83Å
861	D	39	Very low	36.6	Very low	107 Å²	107	103.3 Å²	103.3	57%	0.572	58%	0.576	S	S	*	*	S	Bend	trans	-108.1	7.1	-172.9	-48.6	-22	0	0	0	110	N857 T858 R1182	N857-D861 PolarHBondContact O-N 3.44Å; T858-D861 PolarHBondContact O-N 2.68Å; D861-R1182 IonicContact OD1-NH1 3.91Å; D861-R1182 IonicContact OD2-NH1 3.58Å
862	Q	37.4	Very low	35.8	Very low	156 Å²	156	104.2 Å²	104.2	73%	0.729	59%	0.589	S	S	*	*			trans	-124.2	85.6	172.4	-66.7	-175.5	0.2	0	0	110.3	T858	T858-Q862 WeakPolarHBondContact O-CG 3.46Å; T858-Q862 PolarHBondContact O-N 3.03Å
863	S	32.4	Very low	35.3	Very low	96 Å²	96	104.2 Å²	104.2	67%	0.671	60%	0.6	S	S	*	*			trans	-146.8	146.3	168.2	78.1	0	0	0	0	110.9
864	V	32.4	Very low	34.7	Very low	120 Å²	120	108.1 Å²	108.1	73%	0.727	63%	0.625	S	S	*	*			trans	72.8	77.4	-180	-163.2	0	0	0	0	115.6
865	T	29.6	Very low	34.1	Very low	139 Å²	139	108 Å²	108	85%	0.853	63%	0.633	S	S	*	*				-146.2	94.9	126.6	50.6	0	0	0	0	108.9
866	S	29.1	Very low	33.7	Very low	114 Å²	114	107 Å²	107	80%	0.797	64%	0.642	S	S	*	*			trans	-148.9	122.6	172.9	-50.2	0	0	0	0	108.3
867	S	30.7	Very low	33.3	Very low	90 Å²	90	112.3 Å²	112.3	63%	0.629	66%	0.662	S	S	*	*			trans	-176.3	164	167.2	-122.3	0	0	0	0	111.8
868	A	30.8	Very low	33.1	Very low	83 Å²	83	115.6 Å²	115.6	69%	0.686	68%	0.68	S	S	*	*			trans	61.1	103.8	175	0	0	0	0	0	116.1
869	I	28.3	Very low	32.8	Very low	100 Å²	100	119.8 Å²	119.8	51%	0.513	70%	0.699	S	S	.	*			cis	86	123.2	19.3	-50.5	173.7	0	0	0	115.6
870	H	29.2	Very low	32.6	Very low	187 Å²	187	119.1 Å²	119.1	87%	0.866	70%	0.701	S	S	*	*			trans	65.9	160	175.3	-59.9	-39.6	0	0	0	115.6
871	A	28	Very low	32.2	Very low	82 Å²	82	125.3 Å²	125.3	68%	0.678	73%	0.725	S	S	*	*			cis	-150.5	175.1	11.9	0	0	0	0	0	114.2
872	S	30.2	Very low	31.8	Very low	105 Å²	105	126.2 Å²	126.2	73%	0.734	73%	0.73	S	S	*	*			trans	52.6	105	142.8	-54.8	0	0	0	0	122.4
873	N	30.1	Very low	31.4	Very low	157 Å²	157	122.4 Å²	122.4	84%	0.84	72%	0.72	S	S	*	*			trans	-92.1	134.5	130.4	-74.1	-13.1	0	0	0	106.6
874	N	28.4	Very low	31.2	Very low	135 Å²	135	125 Å²	125	72%	0.722	73%	0.726	S	S	*	*			cis	-130.1	168.7	0.9	-53.5	-74.4	0	0	0	107.2
875	T	34	Very low	31.2	Very low	125 Å²	125	127.2 Å²	127.2	77%	0.767	73%	0.729	S	S	*	*			cis	-159.7	156.2	41.9	40.5	0	0	0	0	113
876	S	30.3	Very low	31.2	Very low	105 Å²	105	127.5 Å²	127.5	73%	0.734	73%	0.725	S	S	*	*			trans	44.2	121.2	149.4	-74.7	0	0	0	0	123.2
877	K	35.6	Very low	31.2	Very low	177 Å²	177	128.9 Å²	128.9	77%	0.77	72%	0.722	S	S	*	*				98.6	116	129.6	-76.1	-176.7	176.6	-170.6	0	121.9
878	D	35.1	Very low	31.3	Very low	122 Å²	122	131.7 Å²	131.7	65%	0.652	73%	0.725	S	S	*	*				91.9	86.2	129	-54.2	-14.6	0	0	0	122.4
879	L	36.3	Very low	31.3	Very low	156 Å²	156	133.1 Å²	133.1	82%	0.817	72%	0.721	S	S	*	*				75.8	170.3	129.1	-62.1	164.7	0	0	0	118.1
880	P	36.5	Very low	31.4	Very low	99 Å²	99	134 Å²	134	64%	0.643	73%	0.726	S	S	*	*				-140.1	166.4	-79.1	40.3	-22.1	0	0	0	116.5
881	H	32.3	Very low	31.5	Very low	177 Å²	177	132 Å²	132	82%	0.819	72%	0.723	S	S	*	*			trans	58.6	155.8	147.4	-83.9	-39.5	0	0	0	120.9
882	N	30.1	Very low	31.7	Very low	126 Å²	126	132.1 Å²	132.1	67%	0.674	72%	0.718	S	S	*	*			cis	-158.8	167.6	-17.5	-165.6	14.8	0	0	0	109.8
883	S	30.7	Very low	31.8	Very low	75 Å²	75	133.6 Å²	133.6	52%	0.524	72%	0.718	S	S	.	*			trans	35.3	111.5	149.4	59.3	0	0	0	0	119.8
884	N	27.7	Very low	31.9	Very low	151 Å²	151	131.5 Å²	131.5	81%	0.807	71%	0.711	S	S	*	*				61.2	108.5	77.3	-68.9	-21.6	0	0	0	116.3
885	Q	33.1	Very low	31.9	Very low	167 Å²	167	134.8 Å²	134.8	78%	0.78	71%	0.713	S	S	*	*				179.4	122.3	124.4	-97.1	163.3	82	0	0	108
886	N	28.4	Very low	31.7	Very low	145 Å²	145	136.5 Å²	136.5	78%	0.775	71%	0.71	S	S	*	*				67.4	164	87.2	-83.1	-18.7	0	0	0	113.7
887	I	30.5	Very low	31.7	Very low	142 Å²	142	137.3 Å²	137.3	73%	0.728	71%	0.706	S	S	*	*			trans	75.5	131.3	170.6	-48.9	-176.6	0	0	0	111.3
888	H	31.4	Very low	31.5	Very low	149 Å²	149	134.1 Å²	134.1	69%	0.69	70%	0.702	S	S	*	*			cis	-156	159.1	3.6	-125.6	-36.9	0	0	0	109.4
889	N	30.4	Very low	31.3	Very low	114 Å²	114	130.8 Å²	130.8	61%	0.61	69%	0.688	S	S	*	*			trans	63.6	172.8	141	-64.6	-5.9	0	0	0	117.4
890	N	30.7	Very low	31	Very low	117 Å²	117	126.6 Å²	126.6	63%	0.626	67%	0.672	S	S	*	*			cis	-150.7	178.7	-26.8	-110.5	-1.8	0	0	0	107
891	D	32.5	Very low	30.7	Very low	147 Å²	147	131.4 Å²	131.4	79%	0.786	68%	0.677	S	S	*	*			trans	67.4	157.4	156.6	-59.7	-42.2	0	0	0	118.1
892	S	32.1	Very low	30.6	Very low	84 Å²	84	126.5 Å²	126.5	59%	0.587	66%	0.657	S	S	*	*			cis	-159	167	-37.1	65.1	0	0	0	0	110.1
893	N	31.5	Very low	30.6	Very low	135 Å²	135	124.5 Å²	124.5	72%	0.722	65%	0.652	S	S	*	*			trans	64.2	135.4	142.8	-74.7	-46.7	0	0	0	123.2
894	T	31.9	Very low	30.5	Very low	113 Å²	113	131.6 Å²	131.6	69%	0.693	67%	0.667	S	S	*	*			trans	82.6	112.7	138	52.1	0	0	0	0	123.4
895	R	29	Very low	30.8	Very low	205 Å²	205	133.8 Å²	133.8	77%	0.774	67%	0.67	S	S	*	*				70	117.1	120.9	-71.1	179.8	167.7	-171.6	0.3	121.7
896	K	30.6	Very low	30.5	Very low	160 Å²	160	135.3 Å²	135.3	70%	0.696	67%	0.674	S	S	*	*				78	136.2	117.8	-72.9	-172.5	175.3	-169.8	0	121.9
897	N	29	Very low	30.5	Very low	123 Å²	123	133.3 Å²	133.3	66%	0.658	67%	0.67	S	S	*	*			trans	76.5	132.6	133.2	-70.7	18	0	0	0	121.8
898	T	32.1	Very low	30.3	Very low	110 Å²	110	132.6 Å²	132.6	68%	0.675	67%	0.673	S	S	*	*			trans	59.2	141.9	135.4	59	0	0	0	0	120.9
899	S	30.7	Very low	30.3	Very low	52 Å²	52	133.7 Å²	133.7	36%	0.364	68%	0.678	S	S	.	*			cis	-168.9	-168.1	-3	-95.3	0	0	0	0	110.4	N1172 N1173	S899-N1172 CarbonylContact C-O 3.18Å; S899-N1172 CarbonylContact O-C 3.35Å; S899-N1173 CarbonylContact O-C 3.55Å; S899-N1173 VanDerWaalsContact O-CA 3.25Å; S899-N1173 WeakPolarHBondContact O-CA 3.33Å; S899-N1173 PolarHBondContact O-N 3.47Å; S899-N1173 VanDerWaalsContact O-O 3.14Å
900	S	30.6	Very low	30.4	Very low	68 Å²	68	134.7 Å²	134.7	48%	0.476	68%	0.682	S	S	.	*				67.7	46.5	122.6	62.3	0	0	0	0	129.9	S1171 N1172	S900-S1171 WeakPolarHBondContact CB-O 3.13Å; S900-S1171 CarbonylContact O-C 3.54Å; S900-S1171 PolarHBondContact OG-O 3.47Å; S900-N1172 VanDerWaalsContact C-C 3.4Å; S900-N1172 CarbonylContact C-O 3.58Å; S900-N1172 CarbonylContact O-C 3.52Å; S900-N1172 PolarHBondContact OG-O 3.45Å
901	R	28.8	Very low	30.4	Very low	200 Å²	200	138.2 Å²	138.2	76%	0.755	69%	0.692	S	S	*	*			trans	61.1	164.5	154.6	-47.8	158	163.7	154.6	-8.6	120.9	S1171 N1172 N1173	R901-S1171 CarbonylContact O-C 3.5Å; R901-N1172 CarbonylContact O-C 3.4Å; R901-N1172 WeakPolarHBondContact O-CA 3.46Å; R901-N1172 PolarHBondContact O-N 2.81Å; R901-N1173 VanDerWaalsContact C-OD1 3.23Å; R901-N1173 VanDerWaalsContact CA-OD1 3.26Å; R901-N1173 WeakPolarHBondContact CA-OD1 3.46Å
902	L	30.9	Very low	30.1	Very low	74 Å²	74	138.7 Å²	138.7	39%	0.387	69%	0.694	S	S	.	*			trans	122.5	146.3	148.2	-67.7	168.5	0	0	0	113.4	N1173	L902-N1173 PolarHBondContact N-OD1 3.24Å; L902-N1173 PolarHBondContact O-ND2 3.22Å; L902-N1173 VanDerWaalsContact O-ND2 3.14Å
903	S	30.2	Very low	30.1	Very low	84 Å²	84	139.6 Å²	139.6	59%	0.587	70%	0.696	S	S	*	*			cis	-174.1	146.5	-35.4	-119.4	0	0	0	0	109.6
904	R	29.5	Very low	30	Very low	223 Å²	223	142.1 Å²	142.1	84%	0.842	71%	0.706	S	S	*	*			trans	40.3	117.2	150.1	-54.2	173.3	-173.9	167.8	0.5	119
905	K	32.7	Very low	30	Very low	198 Å²	198	144 Å²	144	86%	0.861	71%	0.712	S	S	*	*				-169.3	119.3	108.7	-93.2	145.6	-172.8	-177.3	0	107.9
906	K	27.7	Very low	30	Very low	199 Å²	199	141 Å²	141	87%	0.865	71%	0.711	S	S	*	*				65.1	87.2	90	-88.9	-164.3	171.9	-171.1	0	114.4
907	C	27.3	Very low	29.9	Very low	103 Å²	103	141.8 Å²	141.8	70%	0.696	72%	0.715	S	S	*	*				-168	138.7	123.5	-132.1	0	0	0	0	107.8
908	T	27.2	Very low	30	Very low	127 Å²	127	142 Å²	142	78%	0.779	72%	0.721	S	S	*	*			cis	74.1	29.9	12.6	74.6	0	0	0	0	118.4
909	Q	30.1	Very low	29.9	Very low	172 Å²	172	141.1 Å²	141.1	80%	0.804	72%	0.715	S	S	*	*			trans	-162.9	144.3	144.9	-96.7	156.3	32	0	0	104.4
910	I	32.9	Very low	30	Very low	134 Å²	134	148.1 Å²	148.1	69%	0.687	74%	0.739	S	S	*	*			cis	-126.8	122.4	30.7	-66.9	162	0	0	0	110.6
911	K	30.5	Very low	29.9	Very low	192 Å²	192	150.1 Å²	150.1	84%	0.835	75%	0.745	S	S	*	*			trans	-80.8	149.8	144.6	-72.6	179.2	177.4	176.7	0	106.8
912	N	27.5	Very low	30.1	Very low	157 Å²	157	145.6 Å²	145.6	84%	0.84	74%	0.744	S	S	*	*	S	Bend	trans	92.5	45.1	175.6	-45.4	-16.2	0	0	0	117.8
913	T	30.6	Very low	30.5	Very low	102 Å²	102	148.6 Å²	148.6	63%	0.626	76%	0.76	S	S	*	*			trans	-144	10.8	157.5	-22.2	0	0	0	0	116
914	M	30.6	Very low	31.3	Very low	189 Å²	189	150 Å²	150	93%	0.931	77%	0.765	S	S	*	*	S	Bend	trans	-99.7	19.7	169.8	-81.8	-168.8	158.7	0	0	114.3
915	N	31.1	Very low	32.8	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	75%	0.745	S	S	*	*	S	Bend	trans	-108.3	79.2	159.8	-73.1	-12.8	0	0	0	108.2
916	N	29.4	Very low	34.4	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	74%	0.741	S	S	*	*	S	Bend	trans	-177.9	-21.4	158.8	-96.1	-17.9	0	0	0	113.6	T918	N916-T918 PolarHBondContact O-N 2.98Å
917	F	28.9	Very low	36.5	Very low	177 Å²	177	134.4 Å²	134.4	78%	0.776	71%	0.706	S	S	*	*			trans	-81.2	50.6	169.6	-81.7	-82.4	0	0	0	112.8	T919	F917-T919 HydrophobicContact CD1-CG2 3.99Å; F917-T919 PolarHBondContact O-N 3.41Å; F917-T919 VanDerWaalsContact O-N 3.07Å
918	T	29.9	Very low	39.1	Very low	127 Å²	127	134.6 Å²	134.6	78%	0.779	70%	0.704	S	S	*	*			trans	-81.1	45.4	163.7	41.3	0	0	0	0	110.6	N916 K920	N916-T918 PolarHBondContact O-N 2.98Å; T918-K920 VanDerWaalsContact C-N 3.32Å; T918-K920 PolarHBondContact O-N 3Å
919	T	30.2	Very low	41.9	Very low	91 Å²	91	128.8 Å²	128.8	56%	0.558	67%	0.668	S	S	*	*			trans	-79.6	70.6	-170.6	36.4	0	0	0	0	113.3	F917 N921	F917-T919 HydrophobicContact CD1-CG2 3.99Å; F917-T919 PolarHBondContact O-N 3.41Å; F917-T919 VanDerWaalsContact O-N 3.07Å; T919-N921 PolarHBondContact O-N 3.35Å; T919-N921 VanDerWaalsContact O-N 3.08Å
920	K	32.7	Very low	44.7	Very low	200 Å²	200	125.3 Å²	125.3	87%	0.87	66%	0.655	S	S	*	*	S	Bend	trans	53.5	40.7	134.7	-54	173.4	-178.3	174.6	0	118.1	T918	T918-K920 VanDerWaalsContact C-N 3.32Å; T918-K920 PolarHBondContact O-N 3Å
921	N	28.9	Very low	47.3	Very low	110 Å²	110	124.9 Å²	124.9	59%	0.588	65%	0.65	S	S	*	*			trans	-143.3	20.3	177.1	-131.1	-29.4	0	0	0	119	T919 K1050	T919-N921 PolarHBondContact O-N 3.35Å; T919-N921 VanDerWaalsContact O-N 3.08Å; N921-K1050 PolarHBondContact O-NZ 3.44Å; N921-K1050 PolarHBondContact OD1-NZ 3.05Å
922	S	32.8	Very low	50.1	Low	105 Å²	105	121.2 Å²	121.2	73%	0.734	64%	0.64	S	S	*	*			trans	-122.7	95.2	164.5	55	0	0	0	0	111	V924	S922-V924 PolarHBondContact O-N 3.15Å
923	N	39.5	Very low	53.2	Low	137 Å²	137	114.7 Å²	114.7	73%	0.733	61%	0.606	S	S	*	*			trans	-76.4	62.6	-177.8	-77.6	-29.3	0	0	0	112.7	I925	N923-I925 VanDerWaalsContact C-N 3.25Å; N923-I925 PolarHBondContact O-N 3.21Å
924	V	48.3	Very low	56.2	Low	114 Å²	114	113.9 Å²	113.9	69%	0.691	60%	0.595	S	S	*	*			trans	-71.4	88	159	-177.5	0	0	0	0	107	S922 K926	S922-V924 PolarHBondContact O-N 3.15Å; V924-K926 VanDerWaalsContact C-N 3.31Å; V924-K926 PolarHBondContact O-N 3.12Å
925	I	60.1	Low	59.3	Low	83 Å²	83	104.9 Å²	104.9	43%	0.426	55%	0.55	S	S	.	*			trans	-66.4	90.4	-179	-56.3	178.2	0	0	0	108.9	N923 F927	N923-I925 VanDerWaalsContact C-N 3.25Å; N923-I925 PolarHBondContact O-N 3.21Å; I925-F927 HydrophobicContact CB-CE1 4.46Å; I925-F927 HydrophobicContact CB-CZ 4.29Å; I925-F927 HydrophobicContact CG2-CD1 4.04Å; I925-F927 HydrophobicContact CG2-CE1 3.61Å; I925-F927 HydrophobicContact CG2-CZ 3.92Å; I925-F927 WeakPolarHBondContact O-CD2 3.39Å; I925-F927 PolarHBondContact O-N 3.29Å; I925-F927 VanDerWaalsContact O-N 3.11Å
926	K	65.7	Low	62.3	Low	177 Å²	177	97.7 Å²	97.7	77%	0.77	51%	0.512	S	S	*	.			trans	-71.5	102.2	174	-176.8	-179.2	178.5	-178.1	0	108.6	V924 T928	V924-K926 VanDerWaalsContact C-N 3.31Å; V924-K926 PolarHBondContact O-N 3.12Å; K926-T928 PolarHBondContact O-N 3.21Å
927	F	73.2	Confident	65.3	Low	32 Å²	32	91.5 Å²	91.5	14%	0.14	48%	0.479	C	S	.	.			trans	-66.8	91.8	-179.3	-65.9	-65.9	0	0	0	112.7	I925 F929 F962 Q994 A1032	I925-F927 HydrophobicContact CB-CE1 4.46Å; I925-F927 HydrophobicContact CB-CZ 4.29Å; I925-F927 HydrophobicContact CG2-CD1 4.04Å; I925-F927 HydrophobicContact CG2-CE1 3.61Å; I925-F927 HydrophobicContact CG2-CZ 3.92Å; I925-F927 WeakPolarHBondContact O-CD2 3.39Å; I925-F927 PolarHBondContact O-N 3.29Å; I925-F927 VanDerWaalsContact O-N 3.11Å; F927-F929 HydrophobicContact CB-CD1 4.49Å; F927-F929 HydrophobicContact CB-CE1 3.89Å; F927-F929 HydrophobicContact CB-CE2 4.12Å; F927-F929 HydrophobicContact CB-CZ 3.68Å; F927-F929 AromaticContact CD1-CE1 3.89Å; F927-F929 HydrophobicContact CD1-CE1 3.89Å; F927-F929 AromaticContact CD1-CZ 3.92Å; F927-F929 HydrophobicContact CD1-CZ 3.92Å; F927-F929 HydrophobicContact CG-CE1 4.23Å; F927-F929 AromaticContact CG-CZ 3.94Å; F927-F929 HydrophobicContact CG-CZ 3.94Å; F927-F962 HydrophobicContact CD1-CB 4.42Å; F927-F962 AromaticContact CD2-CD2 3.99Å; F927-F962 HydrophobicContact CD2-CD2 3.99Å; F927-F962 HydrophobicContact CE1-CB 3.94Å; F927-F962 HydrophobicContact CE2-CB 4.07Å; F927-F962 HydrophobicContact CE2-CD2 4.09Å; F927-F962 HydrophobicContact CE2-CG 4.49Å; F927-F962 HydrophobicContact CG-CD2 4.41Å; F927-F962 HydrophobicContact CZ-CB 3.76Å; F927-Q994 HydrophobicContact CE1-CG 4.28Å; F927-A1032 HydrophobicContact CB-CB 4.02Å
928	T	80.2	Confident	68.3	Low	106 Å²	106	83.2 Å²	83.2	65%	0.65	44%	0.443	S	S	*	.			trans	-85.2	108.8	163.7	50.1	0	0	0	0	109	K926	K926-T928 PolarHBondContact O-N 3.21Å
929	F	87.1	Confident	71.2	Confident	5 Å²	5	79.3 Å²	79.3	2%	0.022	42%	0.421	C	S	.	.			trans	-107.1	144.3	174.1	-56.2	-40.4	0	0	0	110.4	F927 T933 F935 F962 H991 L1025 V1028 K1029 A1032	F927-F929 HydrophobicContact CB-CD1 4.49Å; F927-F929 HydrophobicContact CB-CE1 3.89Å; F927-F929 HydrophobicContact CB-CE2 4.12Å; F927-F929 HydrophobicContact CB-CZ 3.68Å; F927-F929 AromaticContact CD1-CE1 3.89Å; F927-F929 HydrophobicContact CD1-CE1 3.89Å; F927-F929 AromaticContact CD1-CZ 3.92Å; F927-F929 HydrophobicContact CD1-CZ 3.92Å; F927-F929 HydrophobicContact CG-CE1 4.23Å; F927-F929 AromaticContact CG-CZ 3.94Å; F927-F929 HydrophobicContact CG-CZ 3.94Å; F929-T933 WeakPolarHBondContact CA-OG1 3.49Å; F929-T933 HydrophobicContact CB-CG2 4.29Å; F929-T933 HydrophobicContact CD1-CG2 3.82Å; F929-T933 HydrophobicContact CG-CG2 4.31Å; F929-F935 HydrophobicContact CB-CZ 4.32Å; F929-F935 HydrophobicContact CD1-CZ 4.16Å; F929-F935 HydrophobicContact CD2-CE1 4.33Å; F929-F935 AromaticContact CD2-CZ 3.84Å; F929-F935 HydrophobicContact CD2-CZ 3.84Å; F929-F935 HydrophobicContact CE1-CE1 4.45Å; F929-F935 HydrophobicContact CE1-CZ 4.39Å; F929-F935 HydrophobicContact CE2-CE1 4.09Å; F929-F935 HydrophobicContact CE2-CZ 4.07Å; F929-F935 AromaticContact CG-CZ 3.87Å; F929-F935 HydrophobicContact CG-CZ 3.87Å; F929-F935 HydrophobicContact CZ-CE1 4.16Å; F929-F935 HydrophobicContact CZ-CZ 4.34Å; F929-F962 HydrophobicContact CE2-CD1 4.09Å; F929-F962 AromaticContact CE2-CE1 3.69Å; F929-F962 HydrophobicContact CE2-CE1 3.69Å; F929-F962 HydrophobicContact CE2-CE2 4.29Å; F929-F962 AromaticContact CE2-CZ 3.8Å; F929-F962 HydrophobicContact CE2-CZ 3.8Å; F929-F962 AromaticContact CZ-CD1 3.72Å; F929-F962 HydrophobicContact CZ-CD1 3.72Å; F929-F962 HydrophobicContact CZ-CD2 4.38Å; F929-F962 AromaticContact CZ-CE1 3.82Å; F929-F962 HydrophobicContact CZ-CE1 3.82Å; F929-F962 HydrophobicContact CZ-CE2 4.48Å; F929-F962 HydrophobicContact CZ-CG 4.01Å; F929-F962 HydrophobicContact CZ-CZ 4.21Å; F929-H991 HydrophobicContact CE1-CB 4.18Å; F929-H991 AromaticContact CE1-CD2 3.65Å; F929-H991 AromaticContact CE1-CG 3.71Å; F929-H991 AromaticContact CE1-ND1 3.98Å; F929-H991 AromaticContact CE1-NE2 3.91Å; F929-H991 HydrophobicContact CZ-CB 4.37Å; F929-L1025 HydrophobicContact CB-CD1 4.09Å; F929-V1028 HydrophobicContact CD2-CG1 3.91Å; F929-V1028 HydrophobicContact CE2-CG1 3.8Å; F929-K1029 HydrophobicContact CB-CG 4.31Å; F929-K1029 WeakPolarHBondContact O-CE 3.44Å; F929-K1029 PolarHBondContact O-NZ 3.13Å; F929-A1032 HydrophobicContact CD2-CB 4.03Å; F929-A1032 HydrophobicContact CE2-CB 3.63Å; F929-A1032 HydrophobicContact CZ-CB 4.49Å
930	D	87.5	Confident	74	Confident	99 Å²	99	76.6 Å²	76.6	53%	0.529	41%	0.406	S	S	.	.			trans	-130.3	175.3	179.2	-71	-41.6	0	0	0	111.7	N932 T933 L1025 K1029	D930-N932 PolarHBondContact O-N 3.22Å; D930-N932 VanDerWaalsContact O-N 3.12Å; D930-T933 PolarHBondContact N-OG1 2.93Å; D930-T933 VanDerWaalsContact O-CB 3.26Å; D930-T933 WeakPolarHBondContact O-CB 3.46Å; D930-T933 PolarHBondContact O-N 3.17Å; D930-T933 PolarHBondContact O-OG1 3.12Å; D930-L1025 WeakPolarHBondContact O-CD2 2.96Å; D930-K1029 IonicContact OD1-NZ 3.6Å
931	Q	89	Confident	76.8	Confident	125 Å²	125	67 Å²	67	58%	0.584	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20	179.8	-57.3	-169.7	26.6	0	0	112.7	K1019 H1022 L1025	Q931-K1019 WeakPolarHBondContact O-CD 3.29Å; Q931-H1022 PolarHBondContact NE2-ND1 3.24Å; Q931-L1025 HydrophobicContact CG-CD2 4.2Å
932	N	89.1	Confident	79.8	Confident	116 Å²	116	62 Å²	62	62%	0.62	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-4.3	173.8	-73.7	-34.9	0	0	0	114.3	D930 H934 K1019	D930-N932 PolarHBondContact O-N 3.22Å; D930-N932 VanDerWaalsContact O-N 3.12Å; N932-H934 PolarHBondContact O-CE1 3.35Å; N932-H934 PolarHBondContact O-N 2.72Å; N932-H934 PolarHBondContact O-ND1 2.98Å; N932-K1019 PolarHBondContact OD1-NZ 3.46Å
933	T	92	Very high	82.4	Confident	20 Å²	20	61.3 Å²	61.3	12%	0.123	33%	0.329	C	S	.	.			trans	-67.9	129.5	177	-62.8	0	0	0	0	111	F929 D930 F935 H991	F929-T933 WeakPolarHBondContact CA-OG1 3.49Å; F929-T933 HydrophobicContact CB-CG2 4.29Å; F929-T933 HydrophobicContact CD1-CG2 3.82Å; F929-T933 HydrophobicContact CG-CG2 4.31Å; D930-T933 PolarHBondContact N-OG1 2.93Å; D930-T933 VanDerWaalsContact O-CB 3.26Å; D930-T933 WeakPolarHBondContact O-CB 3.46Å; D930-T933 PolarHBondContact O-N 3.17Å; D930-T933 PolarHBondContact O-OG1 3.12Å; T933-F935 HydrophobicContact CG2-CD2 4.18Å; T933-F935 HydrophobicContact CG2-CE2 3.52Å; T933-F935 HydrophobicContact CG2-CZ 3.73Å; T933-H991 VanDerWaalsContact CG2-CD2 3.42Å; T933-H991 WeakPolarHBondContact CG2-CD2 3.23Å; T933-H991 WeakPolarHBondContact CG2-NE2 3.11Å
934	H	93.1	Very high	84.7	Confident	84 Å²	84	58.7 Å²	58.7	39%	0.389	31%	0.309	S	S	.	.			trans	-92.9	136.4	176.8	-67.4	92.7	0	0	0	111.2	N932 A992 K1019	N932-H934 PolarHBondContact O-CE1 3.35Å; N932-H934 PolarHBondContact O-N 2.72Å; N932-H934 PolarHBondContact O-ND1 2.98Å; H934-A992 HydrophobicContact CB-CB 4.03Å; H934-A992 VanDerWaalsContact O-CB 3.22Å; H934-A992 WeakPolarHBondContact O-CB 3.37Å; H934-A992 PolarHBondContact O-N 2.87Å; H934-K1019 VanDerWaalsContact NE2-CE 3.33Å; H934-K1019 WeakPolarHBondContact NE2-CE 3.31Å
935	F	95.5	Very high	86.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	152.2	175	-67.5	-91.5	0	0	0	109.8	F929 T933 F962 V990 T1017 F1018 L1020 L1025 V1028	F929-F935 HydrophobicContact CB-CZ 4.32Å; F929-F935 HydrophobicContact CD1-CZ 4.16Å; F929-F935 HydrophobicContact CD2-CE1 4.33Å; F929-F935 AromaticContact CD2-CZ 3.84Å; F929-F935 HydrophobicContact CD2-CZ 3.84Å; F929-F935 HydrophobicContact CE1-CE1 4.45Å; F929-F935 HydrophobicContact CE1-CZ 4.39Å; F929-F935 HydrophobicContact CE2-CE1 4.09Å; F929-F935 HydrophobicContact CE2-CZ 4.07Å; F929-F935 AromaticContact CG-CZ 3.87Å; F929-F935 HydrophobicContact CG-CZ 3.87Å; F929-F935 HydrophobicContact CZ-CE1 4.16Å; F929-F935 HydrophobicContact CZ-CZ 4.34Å; T933-F935 HydrophobicContact CG2-CD2 4.18Å; T933-F935 HydrophobicContact CG2-CE2 3.52Å; T933-F935 HydrophobicContact CG2-CZ 3.73Å; F935-F962 HydrophobicContact CE1-CE1 4.37Å; F935-V990 WeakPolarHBondContact CA-O 2.94Å; F935-T1017 CarbonylContact O-C 3.02Å; F935-T1017 VanDerWaalsContact O-CA 3.29Å; F935-T1017 WeakPolarHBondContact O-CA 3.42Å; F935-F1018 PolarHBondContact N-O 2.83Å; F935-F1018 PolarHBondContact O-N 2.66Å; F935-L1020 HydrophobicContact CD1-CD1 4.41Å; F935-L1020 HydrophobicContact CD2-CD1 3.55Å; F935-L1020 HydrophobicContact CD2-CG 3.62Å; F935-L1020 HydrophobicContact CE2-CD1 3.66Å; F935-L1020 HydrophobicContact CE2-CG 4.08Å; F935-L1020 HydrophobicContact CG-CD1 3.94Å; F935-L1020 HydrophobicContact CG-CG 4.18Å; F935-L1020 HydrophobicContact CZ-CD1 4.15Å; F935-L1025 HydrophobicContact CE2-CD1 3.84Å; F935-L1025 HydrophobicContact CZ-CD1 4.19Å; F935-V1028 HydrophobicContact CE1-CG1 3.78Å; F935-V1028 HydrophobicContact CZ-CG1 3.86Å
936	A	94.1	Very high	87.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	155.5	171.7	0	0	0	0	0	109.8	V990 A992 L1015	A936-V990 HydrophobicContact CB-CG2 4.14Å; A936-V990 PolarHBondContact N-O 3.19Å; A936-V990 WeakPolarHBondContact O-CG2 3.34Å; A936-V990 PolarHBondContact O-N 3.31Å; A936-A992 HydrophobicContact CB-CB 4.47Å; A936-L1015 HydrophobicContact CB-CD1 4.2Å; A936-L1015 HydrophobicContact CB-CD2 4.08Å; A936-L1015 HydrophobicContact CB-CG 4.18Å
937	L	93.7	Very high	88.5	Confident	13 Å²	13	46.2 Å²	46.2	7%	0.068	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	132.9	167.1	-74.8	170.4	0	0	0	109.3	S939 S940 A941 L974 L979 I980 L989 F1018	L937-S939 PolarHBondContact O-N 3.26Å; L937-S940 WeakPolarHBondContact O-CA 3.37Å; L937-S940 WeakPolarHBondContact O-CB 3.49Å; L937-S940 PolarHBondContact O-N 3.36Å; L937-A941 PolarHBondContact O-N 3.45Å; L937-L974 HydrophobicContact CD2-CD1 4.35Å; L937-L974 HydrophobicContact CD2-CD2 4.42Å; L937-L979 HydrophobicContact CD1-CB 4.21Å; L937-L979 WeakPolarHBondContact CD1-O 3.48Å; L937-I980 HydrophobicContact CD1-CD1 4.36Å; L937-I980 HydrophobicContact CD1-CG1 3.72Å; L937-I980 HydrophobicContact CD2-CD1 3.79Å; L937-I980 HydrophobicContact CD2-CG1 4.06Å; L937-L989 HydrophobicContact CD2-CD2 4.12Å; L937-F1018 HydrophobicContact CD2-CZ 4.36Å; L937-F1018 HydrophobicContact CG-CE1 4.01Å; L937-F1018 HydrophobicContact CG-CZ 4.07Å
938	G	92.5	Very high	88.3	Confident	3 Å²	3	46.3 Å²	46.3	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-20.1	-179.4	0	0	0	0	0	114.6	N942 Y955 Y988	G938-N942 VanDerWaalsContact O-CB 3.22Å; G938-N942 WeakPolarHBondContact O-CB 3.45Å; G938-N942 PolarHBondContact O-N 2.97Å; G938-N942 VanDerWaalsContact O-N 3.15Å; G938-Y955 WeakPolarHBondContact CA-OH 3.47Å; G938-Y988 PolarHBondContact N-O 3.25Å
939	S	89	Confident	87.7	Confident	46 Å²	46	48.1 Å²	48.1	32%	0.322	28%	0.283	S	S	.	.	H	α-helix	trans	-76.8	-36.6	167.9	39.1	0	0	0	0	113.7	L937 N942 T943	L937-S939 PolarHBondContact O-N 3.26Å; S939-N942 PolarHBondContact O-N 3.28Å; S939-T943 PolarHBondContact O-N 3.33Å; S939-T943 VanDerWaalsContact O-N 3.11Å; S939-T943 PolarHBondContact O-OG1 3.3Å
940	S	90	Very high	86.7	Confident	33 Å²	33	49.9 Å²	49.9	23%	0.231	30%	0.298	C	S	.	.	H	α-helix	trans	-66	-46	173.7	-179.6	0	0	0	0	110.2	L937 N942 T943 W944	L937-S940 WeakPolarHBondContact O-CA 3.37Å; L937-S940 WeakPolarHBondContact O-CB 3.49Å; L937-S940 PolarHBondContact O-N 3.36Å; S940-N942 PolarHBondContact O-N 3.13Å; S940-T943 PolarHBondContact O-N 2.81Å; S940-W944 VanDerWaalsContact O-CB 3.3Å; S940-W944 WeakPolarHBondContact O-CB 3.45Å; S940-W944 PolarHBondContact O-N 3.09Å
941	A	92.4	Very high	85.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.6	-39.6	174.9	0	0	0	0	0	113.3	L937 W944 L945 I954 V990 V995	L937-A941 PolarHBondContact O-N 3.45Å; A941-W944 PolarHBondContact O-N 2.92Å; A941-L945 WeakPolarHBondContact O-CB 3.34Å; A941-L945 WeakPolarHBondContact O-CG 3.14Å; A941-L945 PolarHBondContact O-N 3.23Å; A941-I954 HydrophobicContact CB-CD1 3.72Å; A941-V990 HydrophobicContact CB-CG2 3.79Å; A941-V995 HydrophobicContact CB-CG1 3.86Å; A941-V995 HydrophobicContact CB-CG2 3.91Å
942	N	90.7	Very high	85.1	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-68.3	-32.3	177.5	-169.6	116.4	0	0	0	112.4	G938 S939 S940 M947 G948 G952 R953 I954	G938-N942 VanDerWaalsContact O-CB 3.22Å; G938-N942 WeakPolarHBondContact O-CB 3.45Å; G938-N942 PolarHBondContact O-N 2.97Å; G938-N942 VanDerWaalsContact O-N 3.15Å; S939-N942 PolarHBondContact O-N 3.28Å; S940-N942 PolarHBondContact O-N 3.13Å; N942-M947 WeakPolarHBondContact O-CB 3.19Å; N942-M947 PolarHBondContact O-N 3.37Å; N942-M947 VanDerWaalsContact O-N 3.12Å; N942-G948 PolarHBondContact ND2-O 3.19Å; N942-G952 PolarHBondContact OD1-N 3.05Å; N942-R953 PolarHBondContact OD1-N 3.2Å; N942-I954 HydrophobicContact CB-CB 4.11Å; N942-I954 HydrophobicContact CB-CG2 3.96Å; N942-I954 WeakPolarHBondContact OD1-CG2 3.47Å; N942-I954 PolarHBondContact OD1-N 2.83Å
943	T	87.9	Confident	84.9	Confident	91 Å²	91	47.5 Å²	47.5	56%	0.558	27%	0.274	S	S	*	.	H	α-helix	trans	-72.4	-47.7	171.5	-58.9	0	0	0	0	110.9	S939 S940 L945 G946	S939-T943 PolarHBondContact O-N 3.33Å; S939-T943 VanDerWaalsContact O-N 3.11Å; S939-T943 PolarHBondContact O-OG1 3.3Å; S940-T943 PolarHBondContact O-N 2.81Å; T943-L945 PolarHBondContact O-N 3.44Å; T943-G946 WeakPolarHBondContact O-CA 3.48Å; T943-G946 PolarHBondContact O-N 2.94Å
944	W	88.5	Confident	84.8	Confident	81 Å²	81	46.6 Å²	46.6	31%	0.307	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-38.1	-175.5	-171.9	74.3	0	0	0	113.3	S940 A941 G946 V995 H996 A999 E1013 L1015	S940-W944 VanDerWaalsContact O-CB 3.3Å; S940-W944 WeakPolarHBondContact O-CB 3.45Å; S940-W944 PolarHBondContact O-N 3.09Å; A941-W944 PolarHBondContact O-N 2.92Å; W944-G946 PolarHBondContact O-N 3.29Å; W944-G946 VanDerWaalsContact O-N 3.08Å; W944-V995 HydrophobicContact CE3-CG1 3.7Å; W944-V995 HydrophobicContact CZ3-CG1 3.83Å; W944-H996 AromaticContact CH2-CD2 3.58Å; W944-A999 HydrophobicContact CH2-CB 3.79Å; W944-A999 HydrophobicContact CZ3-CB 3.62Å; W944-E1013 VanDerWaalsContact CD1-O 3.3Å; W944-E1013 PolarHBondContact NE1-O 2.96Å; W944-L1015 HydrophobicContact CB-CD1 3.77Å; W944-L1015 HydrophobicContact CD2-CB 3.92Å; W944-L1015 HydrophobicContact CD2-CD1 4.09Å; W944-L1015 HydrophobicContact CD2-CG 4.39Å; W944-L1015 HydrophobicContact CE3-CB 4.46Å; W944-L1015 HydrophobicContact CE3-CD1 4.33Å; W944-L1015 HydrophobicContact CE3-CD2 4.24Å; W944-L1015 HydrophobicContact CG-CB 4.08Å; W944-L1015 HydrophobicContact CG-CD1 3.85Å; W944-L1015 HydrophobicContact CZ2-CB 4.43Å; W944-L1015 HydrophobicContact CZ3-CD2 4.48Å
945	L	88.4	Confident	84.7	Confident	26 Å²	26	44.6 Å²	44.6	14%	0.136	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	16.3	171.4	-65.9	179.3	0	0	0	114	A941 T943 M947 I954 V995 I998 A999	A941-L945 WeakPolarHBondContact O-CB 3.34Å; A941-L945 WeakPolarHBondContact O-CG 3.14Å; A941-L945 PolarHBondContact O-N 3.23Å; T943-L945 PolarHBondContact O-N 3.44Å; L945-M947 HydrophobicContact CB-CG 3.86Å; L945-M947 HydrophobicContact CB-SD 4.13Å; L945-M947 HydrophobicContact CD1-SD 4.36Å; L945-M947 VanDerWaalsContact O-CG 3.27Å; L945-M947 WeakPolarHBondContact O-CG 3.47Å; L945-M947 PolarHBondContact O-N 3.32Å; L945-M947 VanDerWaalsContact O-N 3.07Å; L945-I954 HydrophobicContact CD1-CD1 3.73Å; L945-I954 HydrophobicContact CD1-CG1 4.1Å; L945-V995 HydrophobicContact CD1-CG1 4.17Å; L945-V995 HydrophobicContact CD2-CG1 4.27Å; L945-V995 HydrophobicContact CG-CG1 4.1Å; L945-I998 HydrophobicContact CD1-CG2 3.62Å; L945-I998 HydrophobicContact CD2-CG2 4.05Å; L945-A999 HydrophobicContact CD2-CB 3.73Å
946	G	84.2	Confident	84.3	Confident	65 Å²	65	49.5 Å²	49.5	67%	0.67	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	11.1	178.6	0	0	0	0	0	115.4	T943 W944 G948	T943-G946 WeakPolarHBondContact O-CA 3.48Å; T943-G946 PolarHBondContact O-N 2.94Å; W944-G946 PolarHBondContact O-N 3.29Å; W944-G946 VanDerWaalsContact O-N 3.08Å; G946-G948 PolarHBondContact O-N 3.36Å; G946-G948 VanDerWaalsContact O-N 3.09Å
947	M	79.4	Confident	84	Confident	22 Å²	22	54.9 Å²	54.9	11%	0.108	32%	0.316	C	S	.	.			trans	-78.3	2.4	-167.9	-53.7	-171.7	66.2	0	0	114.4	N942 L945 R953 I954 K957	N942-M947 WeakPolarHBondContact O-CB 3.19Å; N942-M947 PolarHBondContact O-N 3.37Å; N942-M947 VanDerWaalsContact O-N 3.12Å; L945-M947 HydrophobicContact CB-CG 3.86Å; L945-M947 HydrophobicContact CB-SD 4.13Å; L945-M947 HydrophobicContact CD1-SD 4.36Å; L945-M947 VanDerWaalsContact O-CG 3.27Å; L945-M947 WeakPolarHBondContact O-CG 3.47Å; L945-M947 PolarHBondContact O-N 3.32Å; L945-M947 VanDerWaalsContact O-N 3.07Å; M947-R953 HydrophobicContact CB-CB 4.42Å; M947-R953 HydrophobicContact CE-CB 3.97Å; M947-R953 WeakPolarHBondContact CE-O 3.36Å; M947-R953 WeakPolarHBondContact O-CD 3.47Å; M947-R953 PolarHBondContact O-NH1 3.06Å; M947-I954 VanDerWaalsContact SD-CA 3.56Å; M947-I954 HydrophobicContact SD-CB 3.84Å; M947-I954 HydrophobicContact SD-CG1 4.05Å; M947-K957 HydrophobicContact CE-CB 3.55Å; M947-K957 HydrophobicContact CE-CD 3.65Å; M947-K957 HydrophobicContact CE-CG 4.23Å
948	G	70	Confident	83.7	Confident	33 Å²	33	54.8 Å²	54.8	34%	0.34	32%	0.315	S	S	.	.			trans	80.6	178.4	176	0	0	0	0	0	114.3	N942 G946 A950	N942-G948 PolarHBondContact ND2-O 3.19Å; G946-G948 PolarHBondContact O-N 3.36Å; G946-G948 VanDerWaalsContact O-N 3.09Å; G948-A950 PolarHBondContact O-N 3.36Å; G948-A950 VanDerWaalsContact O-N 3.15Å
949	T	66.8	Low	83.6	Confident	145 Å²	145	56.7 Å²	56.7	89%	0.89	33%	0.327	S	S	*	.	S	Bend	trans	-68.7	-11.6	-175.1	54.8	0	0	0	0	114.7	R951	T949-R951 PolarHBondContact O-N 3.38Å
950	A	67	Low	83.5	Confident	41 Å²	41	56.6 Å²	56.6	34%	0.339	32%	0.321	S	S	.	.	S	Bend	trans	-72.6	91.4	-177.9	0	0	0	0	0	112	G948 G952 R953	G948-A950 PolarHBondContact O-N 3.36Å; G948-A950 VanDerWaalsContact O-N 3.15Å; A950-G952 PolarHBondContact O-N 3.12Å; A950-R953 HydrophobicContact CB-CG 4.12Å; A950-R953 PolarHBondContact O-N 3.06Å
951	R	67.2	Low	83.5	Confident	128 Å²	128	55 Å²	55	48%	0.483	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	117.4	-178.2	-171	-177.6	-165.3	82.5	2.5	112.6	T949 K986	T949-R951 PolarHBondContact O-N 3.38Å; R951-K986 PolarHBondContact NH2-O 2.91Å
952	G	75.5	Confident	83.5	Confident	20 Å²	20	55 Å²	55	21%	0.206	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	103.3	1.8	171	0	0	0	0	0	115.5	N942 A950 I954 Y955 S956	N942-G952 PolarHBondContact OD1-N 3.05Å; A950-G952 PolarHBondContact O-N 3.12Å; G952-I954 PolarHBondContact O-N 2.96Å; G952-Y955 PolarHBondContact O-N 3.03Å; G952-S956 PolarHBondContact O-OG 2.98Å
953	R	84.1	Confident	83.6	Confident	143 Å²	143	58.7 Å²	58.7	54%	0.54	32%	0.324	S	S	.	.	S	Bend	trans	-57.3	-37.4	169.3	-77.5	179.4	168.3	177.1	-5.1	112	N942 M947 A950 Y955 S956 K957	N942-R953 PolarHBondContact OD1-N 3.2Å; M947-R953 HydrophobicContact CB-CB 4.42Å; M947-R953 HydrophobicContact CE-CB 3.97Å; M947-R953 WeakPolarHBondContact CE-O 3.36Å; M947-R953 WeakPolarHBondContact O-CD 3.47Å; M947-R953 PolarHBondContact O-NH1 3.06Å; A950-R953 HydrophobicContact CB-CG 4.12Å; A950-R953 PolarHBondContact O-N 3.06Å; R953-Y955 VanDerWaalsContact C-N 3.34Å; R953-Y955 PolarHBondContact O-N 3.5Å; R953-S956 WeakPolarHBondContact O-CA 3.44Å; R953-S956 WeakPolarHBondContact O-CB 3.5Å; R953-S956 PolarHBondContact O-N 2.9Å; R953-K957 PolarHBondContact O-N 3.36Å; R953-K957 VanDerWaalsContact O-N 3.09Å
954	I	90.3	Very high	83.9	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-50.3	-49.5	176.8	-168.8	173.9	0	0	0	112.5	A941 N942 L945 M947 G952 S956 K957 H958 L961	A941-I954 HydrophobicContact CB-CD1 3.72Å; N942-I954 HydrophobicContact CB-CB 4.11Å; N942-I954 HydrophobicContact CB-CG2 3.96Å; N942-I954 WeakPolarHBondContact OD1-CG2 3.47Å; N942-I954 PolarHBondContact OD1-N 2.83Å; L945-I954 HydrophobicContact CD1-CD1 3.73Å; L945-I954 HydrophobicContact CD1-CG1 4.1Å; M947-I954 VanDerWaalsContact SD-CA 3.56Å; M947-I954 HydrophobicContact SD-CB 3.84Å; M947-I954 HydrophobicContact SD-CG1 4.05Å; G952-I954 PolarHBondContact O-N 2.96Å; I954-S956 PolarHBondContact O-N 2.72Å; I954-S956 VanDerWaalsContact O-N 3.12Å; I954-K957 PolarHBondContact O-N 2.93Å; I954-H958 WeakPolarHBondContact O-CA 3.24Å; I954-H958 WeakPolarHBondContact O-CB 3.13Å; I954-H958 PolarHBondContact O-N 3.01Å; I954-L961 HydrophobicContact CD1-CD2 3.46Å; I954-L961 VanDerWaalsContact CD1-CD2 3.46Å; I954-L961 HydrophobicContact CG1-CD2 3.71Å
955	Y	91.1	Very high	84.1	Confident	43 Å²	43	56 Å²	56	17%	0.169	31%	0.31	C	S	.	.	H	α-helix	trans	-71.2	-8	179.7	-42.6	-58.9	0	0	0	114.7	G938 G952 R953 R963 Y988 V990	G938-Y955 WeakPolarHBondContact CA-OH 3.47Å; G952-Y955 PolarHBondContact O-N 3.03Å; R953-Y955 VanDerWaalsContact C-N 3.34Å; R953-Y955 PolarHBondContact O-N 3.5Å; Y955-R963 HydrophobicContact CD1-CB 4.33Å; Y955-R963 HydrophobicContact CE1-CB 4.09Å; Y955-Y988 HydrophobicContact CE2-CG 4.42Å; Y955-Y988 WeakPolarHBondContact OH-CB 3.4Å; Y955-V990 HydrophobicContact CE1-CG1 3.89Å
956	S	86.9	Confident	84.4	Confident	102 Å²	102	55.2 Å²	55.2	71%	0.713	31%	0.307	S	S	*	.	H	α-helix	trans	-98.6	-27.8	177.8	-52.8	0	0	0	0	112.4	G952 R953 I954	G952-S956 PolarHBondContact O-OG 2.98Å; R953-S956 WeakPolarHBondContact O-CA 3.44Å; R953-S956 WeakPolarHBondContact O-CB 3.5Å; R953-S956 PolarHBondContact O-N 2.9Å; I954-S956 PolarHBondContact O-N 2.72Å; I954-S956 VanDerWaalsContact O-N 3.12Å
957	K	88.5	Confident	84.8	Confident	114 Å²	114	55.4 Å²	55.4	50%	0.496	29%	0.292	S	S	.	.	H	α-helix	trans	-88.8	-28.5	171.4	-162.3	-176.1	-174.2	-164	0	111.7	M947 R953 I954 Q1002	M947-K957 HydrophobicContact CE-CB 3.55Å; M947-K957 HydrophobicContact CE-CD 3.65Å; M947-K957 HydrophobicContact CE-CG 4.23Å; R953-K957 PolarHBondContact O-N 3.36Å; R953-K957 VanDerWaalsContact O-N 3.09Å; I954-K957 PolarHBondContact O-N 2.93Å; K957-Q1002 VanDerWaalsContact NZ-CD 3.27Å
958	H	88.3	Confident	85.4	Confident	10 Å²	10	60 Å²	60	5%	0.046	32%	0.317	C	S	.	.			trans	-125.2	75.8	-177.5	-64.8	-72.8	0	0	0	111.9	I954 E960 L961 I998 Q1002	I954-H958 WeakPolarHBondContact O-CA 3.24Å; I954-H958 WeakPolarHBondContact O-CB 3.13Å; I954-H958 PolarHBondContact O-N 3.01Å; H958-E960 WeakPolarHBondContact CA-OE2 3.25Å; H958-E960 IonicContact CE1-OE1 2.63Å; H958-E960 IonicContact CG-OE1 3.85Å; H958-E960 IonicContact ND1-OE1 2.7Å; H958-E960 PolarHBondContact ND1-OE1 3.02Å; H958-E960 IonicContact ND1-OE2 3.38Å; H958-E960 PolarHBondContact O-N 2.9Å; H958-L961 HydrophobicContact CB-CB 4.01Å; H958-L961 PolarHBondContact O-N 3.01Å; H958-I998 HydrophobicContact CB-CD1 3.96Å; H958-I998 WeakPolarHBondContact CE1-CG2 3.47Å; H958-I998 WeakPolarHBondContact NE2-CG2 3.35Å; H958-Q1002 PolarHBondContact CE1-NE2 3.22Å; H958-Q1002 PolarHBondContact NE2-NE2 3.48Å; H958-Q1002 PolarHBondContact NE2-OE1 3.08Å
959	P	88.7	Confident	86.6	Confident	44 Å²	44	63.7 Å²	63.7	29%	0.286	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.6	173.4	28.8	-36.1	0	0	0	113.3	L961 I1042	P959-L961 VanDerWaalsContact C-N 3.35Å; P959-I1042 HydrophobicContact CG-CD1 3.81Å
960	E	87.4	Confident	87.9	Confident	44 Å²	44	56.8 Å²	56.8	21%	0.206	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-12.6	178.1	79.9	-70.2	176	0	0	114.4	H958 F962 Q994	H958-E960 WeakPolarHBondContact CA-OE2 3.25Å; H958-E960 IonicContact CE1-OE1 2.63Å; H958-E960 IonicContact CG-OE1 3.85Å; H958-E960 IonicContact ND1-OE1 2.7Å; H958-E960 PolarHBondContact ND1-OE1 3.02Å; H958-E960 IonicContact ND1-OE2 3.38Å; H958-E960 PolarHBondContact O-N 2.9Å; E960-F962 PolarHBondContact O-N 3.07Å; E960-Q994 PolarHBondContact O-NE2 2.7Å
961	L	90.3	Very high	89.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-72.4	122.7	177.9	179.7	60.1	0	0	0	110.8	I954 H958 P959 R963 V990 Q994 V995 I998	I954-L961 HydrophobicContact CD1-CD2 3.46Å; I954-L961 VanDerWaalsContact CD1-CD2 3.46Å; I954-L961 HydrophobicContact CG1-CD2 3.71Å; H958-L961 HydrophobicContact CB-CB 4.01Å; H958-L961 PolarHBondContact O-N 3.01Å; P959-L961 VanDerWaalsContact C-N 3.35Å; L961-R963 PolarHBondContact O-N 3.49Å; L961-V990 HydrophobicContact CD1-CB 4.24Å; L961-V990 HydrophobicContact CD2-CB 4.22Å; L961-V990 HydrophobicContact CD2-CG1 3.96Å; L961-V990 HydrophobicContact CG-CB 4.28Å; L961-V990 HydrophobicContact CG-CG1 4.2Å; L961-Q994 HydrophobicContact CD1-CB 3.65Å; L961-V995 HydrophobicContact CD1-CG2 3.91Å; L961-V995 HydrophobicContact CD2-CG2 4.26Å; L961-I998 HydrophobicContact CB-CD1 4.06Å; L961-I998 HydrophobicContact CD1-CD1 4.04Å; L961-I998 HydrophobicContact CD2-CD1 4.41Å; L961-I998 HydrophobicContact CG-CD1 4.4Å
962	F	92.3	Very high	90.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.267	C	S	.	.			trans	-57.6	129.1	173.3	176.9	-100.7	0	0	0	110.8	F927 F929 F935 E960 V990 H991 V1028 A1032 H1035	F927-F962 HydrophobicContact CD1-CB 4.42Å; F927-F962 AromaticContact CD2-CD2 3.99Å; F927-F962 HydrophobicContact CD2-CD2 3.99Å; F927-F962 HydrophobicContact CE1-CB 3.94Å; F927-F962 HydrophobicContact CE2-CB 4.07Å; F927-F962 HydrophobicContact CE2-CD2 4.09Å; F927-F962 HydrophobicContact CE2-CG 4.49Å; F927-F962 HydrophobicContact CG-CD2 4.41Å; F927-F962 HydrophobicContact CZ-CB 3.76Å; F929-F962 HydrophobicContact CE2-CD1 4.09Å; F929-F962 AromaticContact CE2-CE1 3.69Å; F929-F962 HydrophobicContact CE2-CE1 3.69Å; F929-F962 HydrophobicContact CE2-CE2 4.29Å; F929-F962 AromaticContact CE2-CZ 3.8Å; F929-F962 HydrophobicContact CE2-CZ 3.8Å; F929-F962 AromaticContact CZ-CD1 3.72Å; F929-F962 HydrophobicContact CZ-CD1 3.72Å; F929-F962 HydrophobicContact CZ-CD2 4.38Å; F929-F962 AromaticContact CZ-CE1 3.82Å; F929-F962 HydrophobicContact CZ-CE1 3.82Å; F929-F962 HydrophobicContact CZ-CE2 4.48Å; F929-F962 HydrophobicContact CZ-CG 4.01Å; F929-F962 HydrophobicContact CZ-CZ 4.21Å; F935-F962 HydrophobicContact CE1-CE1 4.37Å; E960-F962 PolarHBondContact O-N 3.07Å; F962-V990 WeakPolarHBondContact O-CA 3.49Å; F962-H991 HydrophobicContact CB-CB 4.38Å; F962-H991 HydrophobicContact CD1-CB 4.41Å; F962-V1028 HydrophobicContact CE1-CG1 3.86Å; F962-V1028 HydrophobicContact CZ-CG1 3.97Å; F962-A1032 HydrophobicContact CE2-CB 3.95Å; F962-A1032 HydrophobicContact CZ-CB 4.2Å; F962-H1035 HydrophobicContact CE2-CB 4.39Å
963	R	91.9	Very high	91.3	Very high	80 Å²	80	54.3 Å²	54.3	30%	0.302	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	121.9	178	61	-175.2	-178.1	-87.4	-3.8	110.7	Y955 L961 L989	Y955-R963 HydrophobicContact CD1-CB 4.33Å; Y955-R963 HydrophobicContact CE1-CB 4.09Å; L961-R963 PolarHBondContact O-N 3.49Å; R963-L989 WeakPolarHBondContact CA-O 3.2Å
964	Y	94.7	Very high	91.8	Very high	14 Å²	14	47.5 Å²	47.5	6%	0.055	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142.4	168.7	174.3	-86	0	0	0	109.5	D970 Y988 L989 F1024 K1027 V1028 V1031	Y964-D970 WeakPolarHBondContact CE1-OD2 3.39Å; Y964-D970 PolarHBondContact OH-OD2 2.83Å; Y964-Y988 CarbonylContact O-C 3.55Å; Y964-Y988 VanDerWaalsContact O-CA 3.24Å; Y964-Y988 WeakPolarHBondContact O-CA 3.42Å; Y964-L989 HydrophobicContact CD1-CB 4.42Å; Y964-L989 HydrophobicContact CD1-CD1 4.14Å; Y964-L989 HydrophobicContact CD1-CG 4.42Å; Y964-L989 PolarHBondContact N-O 3.34Å; Y964-L989 PolarHBondContact O-N 2.79Å; Y964-F1024 HydrophobicContact CD1-CE2 4.49Å; Y964-F1024 AromaticContact CE1-CE2 3.75Å; Y964-F1024 HydrophobicContact CE1-CE2 3.75Å; Y964-K1027 HydrophobicContact CE2-CB 4.31Å; Y964-V1028 HydrophobicContact CD1-CG2 4Å; Y964-V1028 HydrophobicContact CD2-CB 4.26Å; Y964-V1028 HydrophobicContact CD2-CG2 3.74Å; Y964-V1028 HydrophobicContact CE1-CG2 4.14Å; Y964-V1028 HydrophobicContact CE2-CB 4.49Å; Y964-V1028 HydrophobicContact CE2-CG2 3.86Å; Y964-V1028 HydrophobicContact CG-CG2 3.81Å; Y964-V1031 HydrophobicContact CD2-CB 3.87Å; Y964-V1031 HydrophobicContact CD2-CG1 4.1Å; Y964-V1031 HydrophobicContact CD2-CG2 3.8Å; Y964-V1031 HydrophobicContact CE2-CB 4.22Å; Y964-V1031 HydrophobicContact CE2-CG2 3.68Å
965	I	93.7	Very high	91.9	Very high	102 Å²	102	49.3 Å²	49.3	52%	0.523	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.8	-178.6	-47.8	-173.9	0	0	0	108.2	Y988	I965-Y988 HydrophobicContact CB-CE1 4.49Å; I965-Y988 HydrophobicContact CD1-CE1 4.04Å; I965-Y988 HydrophobicContact CG1-CD1 4Å; I965-Y988 HydrophobicContact CG1-CE1 3.73Å; I965-Y988 HydrophobicContact CG2-CE1 4.36Å
966	C	93.7	Very high	91.9	Very high	10 Å²	10	55.3 Å²	55.3	7%	0.068	28%	0.283	C	S	.	.			trans	-71.7	130.9	-176.2	-49.8	0	0	0	0	112	D970 K971 L974 A987	C966-D970 WeakPolarHBondContact CA-OD2 3.44Å; C966-D970 HydrophobicContact CB-CB 3.7Å; C966-K971 HydrophobicContact CB-CG 4.17Å; C966-L974 HydrophobicContact CB-CD1 4.35Å; C966-A987 HydrophobicContact CB-CB 3.88Å; C966-A987 PolarHBondContact N-O 2.93Å
967	D	93.5	Very high	92.1	Very high	68 Å²	68	53.3 Å²	53.3	36%	0.364	27%	0.267	S	S	.	.			trans	-75.8	-167	168.8	73.2	33.2	0	0	0	112.1	E969 D970 K971 K1027	D967-E969 WeakPolarHBondContact OD1-CA 3.4Å; D967-E969 WeakPolarHBondContact OD1-CB 3.28Å; D967-E969 PolarHBondContact OD1-N 2.99Å; D967-D970 VanDerWaalsContact CG-CG 3.48Å; D967-D970 PolarHBondContact N-OD2 2.76Å; D967-D970 PolarHBondContact OD1-N 3.01Å; D967-K971 WeakPolarHBondContact O-CB 3.46Å; D967-K971 VanDerWaalsContact O-CD 3.28Å; D967-K971 WeakPolarHBondContact O-CD 3.45Å; D967-K971 WeakPolarHBondContact O-CG 3.32Å; D967-K971 PolarHBondContact O-N 3.38Å; D967-K1027 IonicContact OD1-NZ 2.72Å; D967-K1027 PolarHBondContact OD1-NZ 2.82Å; D967-K1027 IonicContact OD2-NZ 2.75Å; D967-K1027 PolarHBondContact OD2-NZ 3.2Å
968	N	92.5	Very high	92.2	Very high	119 Å²	119	50.3 Å²	50.3	64%	0.636	27%	0.269	S	S	*	.	H	α-helix	trans	-75.9	-33.1	-177.3	-163.4	62.3	0	0	0	114.1	A972	N968-A972 PolarHBondContact O-N 3.15Å; N968-A972 VanDerWaalsContact O-N 3.07Å
969	E	93.5	Very high	92.3	Very high	111 Å²	111	51.2 Å²	51.2	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-74.6	-45.1	176.9	177.7	-175	-137.4	0	0	110.1	D967 K971 A972 W973 W1023 K1027	D967-E969 WeakPolarHBondContact OD1-CA 3.4Å; D967-E969 WeakPolarHBondContact OD1-CB 3.28Å; D967-E969 PolarHBondContact OD1-N 2.99Å; E969-K971 VanDerWaalsContact C-N 3.27Å; E969-K971 PolarHBondContact O-N 2.94Å; E969-A972 WeakPolarHBondContact O-CA 3.48Å; E969-A972 WeakPolarHBondContact O-CB 3.35Å; E969-A972 PolarHBondContact O-N 2.8Å; E969-W973 PolarHBondContact O-N 3.34Å; E969-W1023 HydrophobicContact CG-CH2 4.12Å; E969-W1023 HydrophobicContact CG-CZ3 4.09Å; E969-K1027 WeakPolarHBondContact OE2-CE 3.43Å; E969-K1027 IonicContact OE2-NZ 2.68Å; E969-K1027 PolarHBondContact OE2-NZ 3.05Å
970	D	95	Very high	92.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-53.3	-45.8	173.1	-64.2	-13	0	0	0	111.2	Y964 C966 D967 W973 L974 F1024 K1027	Y964-D970 WeakPolarHBondContact CE1-OD2 3.39Å; Y964-D970 PolarHBondContact OH-OD2 2.83Å; C966-D970 WeakPolarHBondContact CA-OD2 3.44Å; C966-D970 HydrophobicContact CB-CB 3.7Å; D967-D970 VanDerWaalsContact CG-CG 3.48Å; D967-D970 PolarHBondContact N-OD2 2.76Å; D967-D970 PolarHBondContact OD1-N 3.01Å; D970-W973 PolarHBondContact O-N 3.49Å; D970-L974 VanDerWaalsContact O-CG 3.23Å; D970-L974 WeakPolarHBondContact O-CG 3.27Å; D970-L974 PolarHBondContact O-N 2.9Å; D970-F1024 HydrophobicContact CB-CD2 4.46Å; D970-F1024 HydrophobicContact CB-CE1 4.33Å; D970-F1024 HydrophobicContact CB-CE2 3.63Å; D970-F1024 HydrophobicContact CB-CZ 3.55Å; D970-F1024 WeakPolarHBondContact OD1-CD2 3.13Å; D970-F1024 WeakPolarHBondContact OD1-CE2 3.44Å; D970-K1027 WeakPolarHBondContact OD1-CD 3.41Å; D970-K1027 IonicContact OD1-NZ 2.65Å; D970-K1027 PolarHBondContact OD1-NZ 2.84Å
971	K	93.9	Very high	92.3	Very high	35 Å²	35	57 Å²	57	15%	0.152	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-40.7	174.2	-77.7	167.7	172.9	-163.3	0	112.6	C966 D967 E969 W973 L974 V975 H983 V985 A987	C966-K971 HydrophobicContact CB-CG 4.17Å; D967-K971 WeakPolarHBondContact O-CB 3.46Å; D967-K971 VanDerWaalsContact O-CD 3.28Å; D967-K971 WeakPolarHBondContact O-CD 3.45Å; D967-K971 WeakPolarHBondContact O-CG 3.32Å; D967-K971 PolarHBondContact O-N 3.38Å; E969-K971 VanDerWaalsContact C-N 3.27Å; E969-K971 PolarHBondContact O-N 2.94Å; K971-W973 VanDerWaalsContact C-N 3.32Å; K971-W973 PolarHBondContact O-N 3.42Å; K971-L974 PolarHBondContact O-N 2.91Å; K971-V975 WeakPolarHBondContact O-CG2 3.49Å; K971-V975 PolarHBondContact O-N 2.96Å; K971-H983 WeakPolarHBondContact CD-O 3.22Å; K971-H983 WeakPolarHBondContact CE-O 3.48Å; K971-H983 PolarHBondContact NZ-O 3.11Å; K971-V985 VanDerWaalsContact CE-O 3.25Å; K971-V985 WeakPolarHBondContact CE-O 3.43Å; K971-V985 PolarHBondContact NZ-O 2.96Å; K971-A987 HydrophobicContact CG-CB 4.37Å
972	A	92.5	Very high	91.9	Very high	40 Å²	40	59.9 Å²	59.9	33%	0.331	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-43	179	0	0	0	0	0	110.8	N968 E969 V975 Q976	N968-A972 PolarHBondContact O-N 3.15Å; N968-A972 VanDerWaalsContact O-N 3.07Å; E969-A972 WeakPolarHBondContact O-CA 3.48Å; E969-A972 WeakPolarHBondContact O-CB 3.35Å; E969-A972 PolarHBondContact O-N 2.8Å; A972-V975 PolarHBondContact O-N 3.17Å; A972-Q976 VanDerWaalsContact O-CB 3.32Å; A972-Q976 WeakPolarHBondContact O-CB 3.23Å; A972-Q976 PolarHBondContact O-N 2.95Å
973	W	94.5	Very high	91.4	Very high	61 Å²	61	63.9 Å²	63.9	23%	0.231	34%	0.34	C	S	.	.	H	α-helix	trans	-63.5	-40.6	172.4	-174.3	84.2	0	0	0	112.9	E969 D970 K971 V975 Q976 T977 L979 F1018 L1020 P1021 W1023 F1024	E969-W973 PolarHBondContact O-N 3.34Å; D970-W973 PolarHBondContact O-N 3.49Å; K971-W973 VanDerWaalsContact C-N 3.32Å; K971-W973 PolarHBondContact O-N 3.42Å; W973-V975 VanDerWaalsContact C-N 3.29Å; W973-V975 PolarHBondContact O-N 2.86Å; W973-Q976 PolarHBondContact O-N 2.78Å; W973-T977 HydrophobicContact CD2-CG2 4.04Å; W973-T977 HydrophobicContact CE3-CG2 4.44Å; W973-T977 HydrophobicContact CH2-CG2 4.09Å; W973-T977 HydrophobicContact CZ2-CG2 3.63Å; W973-T977 HydrophobicContact CZ3-CG2 4.47Å; W973-T977 WeakPolarHBondContact O-CB 3.26Å; W973-T977 WeakPolarHBondContact O-CG2 3.39Å; W973-T977 PolarHBondContact O-N 3.22Å; W973-T977 PolarHBondContact O-OG1 3.48Å; W973-L979 HydrophobicContact CH2-CD1 4.37Å; W973-L979 HydrophobicContact CZ3-CD1 4.01Å; W973-F1018 HydrophobicContact CH2-CD2 4.38Å; W973-F1018 HydrophobicContact CZ3-CD2 4.24Å; W973-F1018 HydrophobicContact CZ3-CE2 4.28Å; W973-L1020 HydrophobicContact CZ3-CD2 4.33Å; W973-P1021 HydrophobicContact CD2-CG 4.11Å; W973-P1021 HydrophobicContact CH2-CG 4.23Å; W973-P1021 HydrophobicContact CZ2-CG 3.45Å; W973-P1021 VanDerWaalsContact CZ2-CG 3.45Å; W973-W1023 HydrophobicContact CB-CH2 3.99Å; W973-W1023 HydrophobicContact CB-CZ2 3.98Å; W973-W1023 AromaticContact CD1-CZ2 3.97Å; W973-W1023 HydrophobicContact CG-CH2 4.36Å; W973-W1023 AromaticContact CG-CZ2 3.94Å; W973-W1023 HydrophobicContact CG-CZ2 3.94Å; W973-F1024 HydrophobicContact CD2-CD1 4.26Å; W973-F1024 AromaticContact CE3-CD1 3.75Å; W973-F1024 HydrophobicContact CE3-CD1 3.75Å; W973-F1024 AromaticContact CE3-CE1 3.66Å; W973-F1024 HydrophobicContact CE3-CE1 3.66Å; W973-F1024 HydrophobicContact CZ3-CD1 4.17Å; W973-F1024 HydrophobicContact CZ3-CE1 4.09Å
974	L	93.9	Very high	90.5	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-66.7	-25.7	176	-70.8	167.5	0	0	0	113.7	L937 C966 D970 K971 T977 L979 I980 A987 L989 F1018 F1024	L937-L974 HydrophobicContact CD2-CD1 4.35Å; L937-L974 HydrophobicContact CD2-CD2 4.42Å; C966-L974 HydrophobicContact CB-CD1 4.35Å; D970-L974 VanDerWaalsContact O-CG 3.23Å; D970-L974 WeakPolarHBondContact O-CG 3.27Å; D970-L974 PolarHBondContact O-N 2.9Å; K971-L974 PolarHBondContact O-N 2.91Å; L974-T977 WeakPolarHBondContact CA-OG1 3.49Å; L974-T977 PolarHBondContact O-OG1 3.3Å; L974-L979 HydrophobicContact CD2-CB 4.05Å; L974-L979 HydrophobicContact CD2-CD1 3.71Å; L974-L979 CarbonylContact O-C 3.59Å; L974-L979 WeakPolarHBondContact O-CA 3.37Å; L974-L979 WeakPolarHBondContact O-CB 3.43Å; L974-L979 PolarHBondContact O-N 3.31Å; L974-I980 HydrophobicContact CB-CD1 3.92Å; L974-I980 HydrophobicContact CB-CG1 4.08Å; L974-I980 HydrophobicContact CD1-CD1 3.93Å; L974-I980 HydrophobicContact CG-CD1 4.47Å; L974-I980 PolarHBondContact O-N 3.24Å; L974-A987 HydrophobicContact CD1-CB 4.41Å; L974-L989 HydrophobicContact CD2-CD2 4.47Å; L974-F1018 HydrophobicContact CD2-CE2 3.83Å; L974-F1018 HydrophobicContact CD2-CZ 3.89Å; L974-F1024 HydrophobicContact CD1-CE1 4.49Å; L974-F1024 HydrophobicContact CD1-CZ 4.33Å; L974-F1024 HydrophobicContact CD2-CE1 4.49Å; L974-F1024 HydrophobicContact CG-CE1 4.26Å
975	V	92.9	Very high	89.6	Confident	38 Å²	38	66.3 Å²	66.3	23%	0.23	38%	0.379	C	S	.	.	H	α-helix	trans	-80.2	-46.6	171.5	173	0	0	0	0	110.6	K971 A972 W973 T977 G978 I980	K971-V975 WeakPolarHBondContact O-CG2 3.49Å; K971-V975 PolarHBondContact O-N 2.96Å; A972-V975 PolarHBondContact O-N 3.17Å; W973-V975 VanDerWaalsContact C-N 3.29Å; W973-V975 PolarHBondContact O-N 2.86Å; V975-T977 PolarHBondContact O-N 3.41Å; V975-T977 VanDerWaalsContact O-N 3.13Å; V975-G978 PolarHBondContact O-N 3.42Å; V975-I980 WeakPolarHBondContact CA-O 3.45Å; V975-I980 HydrophobicContact CG2-CB 4.43Å
976	Q	91.8	Very high	89.3	Confident	170 Å²	170	68.4 Å²	68.4	79%	0.794	39%	0.385	S	S	*	.	H	α-helix	trans	-55.1	-31	176.7	-169.6	68.7	31.8	0	0	113	A972 W973	A972-Q976 VanDerWaalsContact O-CB 3.32Å; A972-Q976 WeakPolarHBondContact O-CB 3.23Å; A972-Q976 PolarHBondContact O-N 2.95Å; W973-Q976 PolarHBondContact O-N 2.78Å
977	T	91.3	Very high	89.2	Confident	59 Å²	59	68 Å²	68	36%	0.362	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	4.4	179.7	49.5	0	0	0	0	114.7	W973 L974 V975 L979	W973-T977 HydrophobicContact CD2-CG2 4.04Å; W973-T977 HydrophobicContact CE3-CG2 4.44Å; W973-T977 HydrophobicContact CH2-CG2 4.09Å; W973-T977 HydrophobicContact CZ2-CG2 3.63Å; W973-T977 HydrophobicContact CZ3-CG2 4.47Å; W973-T977 WeakPolarHBondContact O-CB 3.26Å; W973-T977 WeakPolarHBondContact O-CG2 3.39Å; W973-T977 PolarHBondContact O-N 3.22Å; W973-T977 PolarHBondContact O-OG1 3.48Å; L974-T977 WeakPolarHBondContact CA-OG1 3.49Å; L974-T977 PolarHBondContact O-OG1 3.3Å; V975-T977 PolarHBondContact O-N 3.41Å; V975-T977 VanDerWaalsContact O-N 3.13Å; T977-L979 PolarHBondContact O-N 3.04Å; T977-L979 WeakPolarHBondContact OG1-CD1 3.46Å
978	G	90.5	Very high	89.2	Confident	52 Å²	52	67.4 Å²	67.4	54%	0.536	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	23.8	-178.6	0	0	0	0	0	113.9	V975 K1016	V975-G978 PolarHBondContact O-N 3.42Å; G978-K1016 PolarHBondContact O-NZ 3.02Å
979	L	89.8	Confident	89.3	Confident	29 Å²	29	61.7 Å²	61.7	15%	0.152	35%	0.345	C	S	.	.	S	Bend	trans	-86.9	-30.3	175	-64	175.1	0	0	0	111.2	L937 W973 L974 T977 F1018	L937-L979 HydrophobicContact CD1-CB 4.21Å; L937-L979 WeakPolarHBondContact CD1-O 3.48Å; W973-L979 HydrophobicContact CH2-CD1 4.37Å; W973-L979 HydrophobicContact CZ3-CD1 4.01Å; L974-L979 HydrophobicContact CD2-CB 4.05Å; L974-L979 HydrophobicContact CD2-CD1 3.71Å; L974-L979 CarbonylContact O-C 3.59Å; L974-L979 WeakPolarHBondContact O-CA 3.37Å; L974-L979 WeakPolarHBondContact O-CB 3.43Å; L974-L979 PolarHBondContact O-N 3.31Å; T977-L979 PolarHBondContact O-N 3.04Å; T977-L979 WeakPolarHBondContact OG1-CD1 3.46Å; L979-F1018 HydrophobicContact CD1-CB 4.3Å; L979-F1018 HydrophobicContact CD1-CD1 3.74Å; L979-F1018 HydrophobicContact CD1-CD2 3.58Å; L979-F1018 HydrophobicContact CD1-CE1 3.88Å; L979-F1018 HydrophobicContact CD1-CE2 3.71Å; L979-F1018 HydrophobicContact CD1-CG 3.6Å; L979-F1018 HydrophobicContact CD1-CZ 3.86Å; L979-F1018 HydrophobicContact CD2-CD1 3.85Å; L979-F1018 HydrophobicContact CD2-CE1 4.23Å; L979-F1018 HydrophobicContact CD2-CG 4.3Å; L979-F1018 HydrophobicContact CG-CD1 4.43Å
980	I	89.9	Confident	89.3	Confident	36 Å²	36	56.4 Å²	56.4	19%	0.185	32%	0.32	C	S	.	.			trans	-134.1	141	175	-55.9	-178.3	0	0	0	109.9	L937 L974 V975 S982 A987	L937-I980 HydrophobicContact CD1-CD1 4.36Å; L937-I980 HydrophobicContact CD1-CG1 3.72Å; L937-I980 HydrophobicContact CD2-CD1 3.79Å; L937-I980 HydrophobicContact CD2-CG1 4.06Å; L974-I980 HydrophobicContact CB-CD1 3.92Å; L974-I980 HydrophobicContact CB-CG1 4.08Å; L974-I980 HydrophobicContact CD1-CD1 3.93Å; L974-I980 HydrophobicContact CG-CD1 4.47Å; L974-I980 PolarHBondContact O-N 3.24Å; V975-I980 WeakPolarHBondContact CA-O 3.45Å; V975-I980 HydrophobicContact CG2-CB 4.43Å; I980-S982 WeakPolarHBondContact CG2-O 3.43Å; I980-A987 HydrophobicContact CD1-CB 3.44Å; I980-A987 VanDerWaalsContact CD1-CB 3.44Å
981	I	86.3	Confident	89.2	Confident	173 Å²	173	57.8 Å²	57.8	89%	0.887	33%	0.326	S	S	*	.	S	Bend	trans	-76.5	-27	-176.9	-57	172	0	0	0	112.8
982	S	82.8	Confident	89.2	Confident	61 Å²	61	56.2 Å²	56.2	43%	0.427	32%	0.32	S	S	.	.			trans	-155.3	152.1	-179.2	62.7	0	0	0	0	114.7	I980 G984	I980-S982 WeakPolarHBondContact CG2-O 3.43Å; S982-G984 VanDerWaalsContact C-N 3.27Å; S982-G984 PolarHBondContact O-N 3.35Å
983	H	80.1	Confident	89.1	Confident	84 Å²	84	59.1 Å²	59.1	39%	0.389	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.8	-178.6	-53.8	-109.7	0	0	0	114.2	K971 V985	K971-H983 WeakPolarHBondContact CD-O 3.22Å; K971-H983 WeakPolarHBondContact CE-O 3.48Å; K971-H983 PolarHBondContact NZ-O 3.11Å; H983-V985 PolarHBondContact O-N 2.63Å
984	G	73	Confident	89	Confident	72 Å²	72	56.7 Å²	56.7	74%	0.742	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-27.2	-168.3	0	0	0	0	0	115.1	S982	S982-G984 VanDerWaalsContact C-N 3.27Å; S982-G984 PolarHBondContact O-N 3.35Å
985	V	77.3	Confident	88.8	Confident	72 Å²	72	56.7 Å²	56.7	44%	0.436	32%	0.318	S	S	.	.	S	Bend	trans	-85.4	145.5	-175.6	-174	0	0	0	0	111.1	K971 H983 A987	K971-V985 VanDerWaalsContact CE-O 3.25Å; K971-V985 WeakPolarHBondContact CE-O 3.43Å; K971-V985 PolarHBondContact NZ-O 2.96Å; H983-V985 PolarHBondContact O-N 2.63Å; V985-A987 PolarHBondContact O-N 3.25Å
986	K	87.3	Confident	88.7	Confident	147 Å²	147	58.1 Å²	58.1	64%	0.639	32%	0.322	S	S	*	.			trans	-66	102.5	168.1	-71.6	-162.6	175.9	-163.5	0	110.2	R951 Y988	R951-K986 PolarHBondContact NH2-O 2.91Å; K986-Y988 HydrophobicContact CB-CE2 4.04Å; K986-Y988 WeakPolarHBondContact O-CD2 3.47Å
987	A	90.3	Very high	88.6	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.017	30%	0.3	C	S	.	.			trans	-79.1	149.8	172.7	0	0	0	0	0	110.9	C966 K971 L974 I980 V985	C966-A987 HydrophobicContact CB-CB 3.88Å; C966-A987 PolarHBondContact N-O 2.93Å; K971-A987 HydrophobicContact CG-CB 4.37Å; L974-A987 HydrophobicContact CD1-CB 4.41Å; I980-A987 HydrophobicContact CD1-CB 3.44Å; I980-A987 VanDerWaalsContact CD1-CB 3.44Å; V985-A987 PolarHBondContact O-N 3.25Å
988	Y	93.5	Very high	88.5	Confident	54 Å²	54	51 Å²	51	21%	0.212	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	135.4	177	-69.5	-94.5	0	0	0	108	G938 Y955 Y964 I965 K986	G938-Y988 PolarHBondContact N-O 3.25Å; Y955-Y988 HydrophobicContact CE2-CG 4.42Å; Y955-Y988 WeakPolarHBondContact OH-CB 3.4Å; Y964-Y988 CarbonylContact O-C 3.55Å; Y964-Y988 VanDerWaalsContact O-CA 3.24Å; Y964-Y988 WeakPolarHBondContact O-CA 3.42Å; I965-Y988 HydrophobicContact CB-CE1 4.49Å; I965-Y988 HydrophobicContact CD1-CE1 4.04Å; I965-Y988 HydrophobicContact CG1-CD1 4Å; I965-Y988 HydrophobicContact CG1-CE1 3.73Å; I965-Y988 HydrophobicContact CG2-CE1 4.36Å; K986-Y988 HydrophobicContact CB-CE2 4.04Å; K986-Y988 WeakPolarHBondContact O-CD2 3.47Å
989	L	94.5	Very high	88.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	142.6	168	-63.5	177.4	0	0	0	109.6	L937 R963 Y964 L974 F1018 L1020 F1024 V1028	L937-L989 HydrophobicContact CD2-CD2 4.12Å; R963-L989 WeakPolarHBondContact CA-O 3.2Å; Y964-L989 HydrophobicContact CD1-CB 4.42Å; Y964-L989 HydrophobicContact CD1-CD1 4.14Å; Y964-L989 HydrophobicContact CD1-CG 4.42Å; Y964-L989 PolarHBondContact N-O 3.34Å; Y964-L989 PolarHBondContact O-N 2.79Å; L974-L989 HydrophobicContact CD2-CD2 4.47Å; L989-F1018 HydrophobicContact CD2-CE2 3.8Å; L989-F1018 HydrophobicContact CD2-CZ 3.48Å; L989-F1018 VanDerWaalsContact CD2-CZ 3.48Å; L989-L1020 HydrophobicContact CD1-CD1 3.97Å; L989-L1020 HydrophobicContact CD1-CD2 3.89Å; L989-F1024 HydrophobicContact CD1-CE1 4.21Å; L989-F1024 HydrophobicContact CD1-CE2 3.84Å; L989-F1024 HydrophobicContact CD1-CZ 3.52Å; L989-V1028 HydrophobicContact CD1-CG2 4.33Å
990	V	94.2	Very high	88.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149.9	172.5	-61.5	0	0	0	0	109.8	F935 A936 A941 Y955 L961 F962 A992 V995	F935-V990 WeakPolarHBondContact CA-O 2.94Å; A936-V990 HydrophobicContact CB-CG2 4.14Å; A936-V990 PolarHBondContact N-O 3.19Å; A936-V990 WeakPolarHBondContact O-CG2 3.34Å; A936-V990 PolarHBondContact O-N 3.31Å; A941-V990 HydrophobicContact CB-CG2 3.79Å; Y955-V990 HydrophobicContact CE1-CG1 3.89Å; L961-V990 HydrophobicContact CD1-CB 4.24Å; L961-V990 HydrophobicContact CD2-CB 4.22Å; L961-V990 HydrophobicContact CD2-CG1 3.96Å; L961-V990 HydrophobicContact CG-CB 4.28Å; L961-V990 HydrophobicContact CG-CG1 4.2Å; F962-V990 WeakPolarHBondContact O-CA 3.49Å; V990-A992 PolarHBondContact O-N 3.31Å; V990-V995 HydrophobicContact CB-CG2 4.34Å; V990-V995 HydrophobicContact CG2-CG2 3.71Å
991	H	93.6	Very high	87.6	Confident	29 Å²	29	59.7 Å²	59.7	13%	0.134	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	118.8	178.3	-176.3	-141.4	0	0	0	109.6	F929 T933 F962 E993 Q994 V995	F929-H991 HydrophobicContact CE1-CB 4.18Å; F929-H991 AromaticContact CE1-CD2 3.65Å; F929-H991 AromaticContact CE1-CG 3.71Å; F929-H991 AromaticContact CE1-ND1 3.98Å; F929-H991 AromaticContact CE1-NE2 3.91Å; F929-H991 HydrophobicContact CZ-CB 4.37Å; T933-H991 VanDerWaalsContact CG2-CD2 3.42Å; T933-H991 WeakPolarHBondContact CG2-CD2 3.23Å; T933-H991 WeakPolarHBondContact CG2-NE2 3.11Å; F962-H991 HydrophobicContact CB-CB 4.38Å; F962-H991 HydrophobicContact CD1-CB 4.41Å; H991-E993 VanDerWaalsContact C-N 3.31Å; H991-E993 PolarHBondContact O-N 2.75Å; H991-Q994 HydrophobicContact CB-CB 4.42Å; H991-Q994 PolarHBondContact O-N 2.85Å; H991-V995 PolarHBondContact O-N 3.17Å
992	A	93.3	Very high	87	Confident	2 Å²	2	55.1 Å²	55.1	2%	0.017	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-37.2	-169.9	0	0	0	0	0	112.4	H934 A936 V990 Q994 V995 H996 T1017	H934-A992 HydrophobicContact CB-CB 4.03Å; H934-A992 VanDerWaalsContact O-CB 3.22Å; H934-A992 WeakPolarHBondContact O-CB 3.37Å; H934-A992 PolarHBondContact O-N 2.87Å; A936-A992 HydrophobicContact CB-CB 4.47Å; V990-A992 PolarHBondContact O-N 3.31Å; A992-Q994 PolarHBondContact O-N 3.38Å; A992-V995 WeakPolarHBondContact O-CB 3.48Å; A992-V995 PolarHBondContact O-N 3.07Å; A992-V995 VanDerWaalsContact O-N 3.08Å; A992-H996 PolarHBondContact O-N 3.18Å; A992-H996 VanDerWaalsContact O-N 3.08Å; A992-H996 PolarHBondContact O-ND1 3.07Å; A992-T1017 HydrophobicContact CB-CG2 3.54Å
993	E	90.6	Very high	86	Confident	100 Å²	100	55.8 Å²	55.8	47%	0.467	28%	0.284	S	S	.	.	H	α-helix	trans	-62	-41.3	178.3	178.1	52.5	-145.9	0	0	112.1	H991 V995 H996 Q997	H991-E993 VanDerWaalsContact C-N 3.31Å; H991-E993 PolarHBondContact O-N 2.75Å; E993-V995 VanDerWaalsContact C-N 3.28Å; E993-V995 PolarHBondContact O-N 2.98Å; E993-H996 PolarHBondContact O-N 3.09Å; E993-Q997 WeakPolarHBondContact O-CG 3.36Å; E993-Q997 PolarHBondContact O-N 3.28Å; E993-Q997 PolarHBondContact OE1-NE2 2.9Å
994	Q	91.4	Very high	84.5	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.047	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-35.1	172.4	-83.2	-166.6	-64.5	0	0	112.6	F927 E960 L961 H991 A992 Q997 I998	F927-Q994 HydrophobicContact CE1-CG 4.28Å; E960-Q994 PolarHBondContact O-NE2 2.7Å; L961-Q994 HydrophobicContact CD1-CB 3.65Å; H991-Q994 HydrophobicContact CB-CB 4.42Å; H991-Q994 PolarHBondContact O-N 2.85Å; A992-Q994 PolarHBondContact O-N 3.38Å; Q994-Q997 PolarHBondContact O-N 3.43Å; Q994-I998 WeakPolarHBondContact O-CB 3.41Å; Q994-I998 WeakPolarHBondContact O-CD1 3.37Å; Q994-I998 VanDerWaalsContact O-CG1 3.26Å; Q994-I998 WeakPolarHBondContact O-CG1 3.41Å; Q994-I998 PolarHBondContact O-N 3.12Å
995	V	91.5	Very high	83.4	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.6	-38.5	178.2	178.5	0	0	0	0	110.7	A941 W944 L945 L961 V990 H991 A992 E993 I998 A999 L1015	A941-V995 HydrophobicContact CB-CG1 3.86Å; A941-V995 HydrophobicContact CB-CG2 3.91Å; W944-V995 HydrophobicContact CE3-CG1 3.7Å; W944-V995 HydrophobicContact CZ3-CG1 3.83Å; L945-V995 HydrophobicContact CD1-CG1 4.17Å; L945-V995 HydrophobicContact CD2-CG1 4.27Å; L945-V995 HydrophobicContact CG-CG1 4.1Å; L961-V995 HydrophobicContact CD1-CG2 3.91Å; L961-V995 HydrophobicContact CD2-CG2 4.26Å; V990-V995 HydrophobicContact CB-CG2 4.34Å; V990-V995 HydrophobicContact CG2-CG2 3.71Å; H991-V995 PolarHBondContact O-N 3.17Å; A992-V995 WeakPolarHBondContact O-CB 3.48Å; A992-V995 PolarHBondContact O-N 3.07Å; A992-V995 VanDerWaalsContact O-N 3.08Å; E993-V995 VanDerWaalsContact C-N 3.28Å; E993-V995 PolarHBondContact O-N 2.98Å; V995-I998 PolarHBondContact O-N 3.08Å; V995-A999 PolarHBondContact O-N 2.99Å; V995-L1015 HydrophobicContact CB-CD2 4.24Å; V995-L1015 HydrophobicContact CG1-CD2 3.93Å
996	H	90.6	Very high	82	Confident	69 Å²	69	66 Å²	66	32%	0.319	32%	0.315	S	S	.	.	H	α-helix	trans	-65.4	-46.5	172.1	-66.5	87.8	0	0	0	111.4	W944 A992 E993 I998 A999 T1000	W944-H996 AromaticContact CH2-CD2 3.58Å; A992-H996 PolarHBondContact O-N 3.18Å; A992-H996 VanDerWaalsContact O-N 3.08Å; A992-H996 PolarHBondContact O-ND1 3.07Å; E993-H996 PolarHBondContact O-N 3.09Å; H996-I998 VanDerWaalsContact C-N 3.26Å; H996-I998 PolarHBondContact O-N 2.97Å; H996-A999 WeakPolarHBondContact O-CA 3.48Å; H996-A999 WeakPolarHBondContact O-CB 3.44Å; H996-A999 PolarHBondContact O-N 3.43Å; H996-T1000 PolarHBondContact O-N 3.33Å; H996-T1000 PolarHBondContact O-OG1 3.34Å; H996-T1000 VanDerWaalsContact O-OG1 3.09Å
997	Q	88.5	Confident	79.8	Confident	73 Å²	73	62.2 Å²	62.2	34%	0.341	31%	0.307	S	S	.	.	H	α-helix	trans	-60.7	-33.6	176.3	-68	174	15.5	0	0	113.1	E993 Q994 R1001	E993-Q997 WeakPolarHBondContact O-CG 3.36Å; E993-Q997 PolarHBondContact O-N 3.28Å; E993-Q997 PolarHBondContact OE1-NE2 2.9Å; Q994-Q997 PolarHBondContact O-N 3.43Å; Q997-R1001 WeakPolarHBondContact O-CD 3.32Å; Q997-R1001 VanDerWaalsContact O-CG 3.23Å; Q997-R1001 WeakPolarHBondContact O-CG 3.36Å; Q997-R1001 PolarHBondContact O-N 3.47Å
998	I	89	Confident	77.5	Confident	5 Å²	5	67.7 Å²	67.7	3%	0.026	35%	0.345	C	S	.	.	H	α-helix	trans	-66.8	-42.8	171.7	-77.3	163.3	0	0	0	111	L945 H958 L961 Q994 V995 H996 R1001 Q1002	L945-I998 HydrophobicContact CD1-CG2 3.62Å; L945-I998 HydrophobicContact CD2-CG2 4.05Å; H958-I998 HydrophobicContact CB-CD1 3.96Å; H958-I998 WeakPolarHBondContact CE1-CG2 3.47Å; H958-I998 WeakPolarHBondContact NE2-CG2 3.35Å; L961-I998 HydrophobicContact CB-CD1 4.06Å; L961-I998 HydrophobicContact CD1-CD1 4.04Å; L961-I998 HydrophobicContact CD2-CD1 4.41Å; L961-I998 HydrophobicContact CG-CD1 4.4Å; Q994-I998 WeakPolarHBondContact O-CB 3.41Å; Q994-I998 WeakPolarHBondContact O-CD1 3.37Å; Q994-I998 VanDerWaalsContact O-CG1 3.26Å; Q994-I998 WeakPolarHBondContact O-CG1 3.41Å; Q994-I998 PolarHBondContact O-N 3.12Å; V995-I998 PolarHBondContact O-N 3.08Å; H996-I998 VanDerWaalsContact C-N 3.26Å; H996-I998 PolarHBondContact O-N 2.97Å; I998-R1001 PolarHBondContact O-N 3.26Å; I998-Q1002 PolarHBondContact O-N 3.19Å
999	A	87.4	Confident	75.2	Confident	6 Å²	6	74.5 Å²	74.5	5%	0.05	38%	0.375	C	S	.	.	H	α-helix	trans	-60.5	-51.6	175	0	0	0	0	0	111	W944 L945 V995 H996 R1001 Q1002 I1003	W944-A999 HydrophobicContact CH2-CB 3.79Å; W944-A999 HydrophobicContact CZ3-CB 3.62Å; L945-A999 HydrophobicContact CD2-CB 3.73Å; V995-A999 PolarHBondContact O-N 2.99Å; H996-A999 WeakPolarHBondContact O-CA 3.48Å; H996-A999 WeakPolarHBondContact O-CB 3.44Å; H996-A999 PolarHBondContact O-N 3.43Å; A999-R1001 PolarHBondContact O-N 3.08Å; A999-R1001 VanDerWaalsContact O-N 3.1Å; A999-Q1002 PolarHBondContact O-N 3.11Å; A999-I1003 HydrophobicContact CB-CD1 3.89Å; A999-I1003 VanDerWaalsContact O-CB 3.31Å; A999-I1003 WeakPolarHBondContact O-CB 3.42Å; A999-I1003 VanDerWaalsContact O-CG1 3.29Å; A999-I1003 WeakPolarHBondContact O-CG1 3.49Å; A999-I1003 PolarHBondContact O-N 3.41Å
1000	T	84.8	Confident	73	Confident	118 Å²	118	77.4 Å²	77.4	72%	0.724	40%	0.4	S	S	*	.	H	α-helix	trans	-57.5	-26.9	177.6	-48.7	0	0	0	0	113.4	H996	H996-T1000 PolarHBondContact O-N 3.33Å; H996-T1000 PolarHBondContact O-OG1 3.34Å; H996-T1000 VanDerWaalsContact O-OG1 3.09Å
1001	R	80.7	Confident	70.6	Confident	176 Å²	176	84.4 Å²	84.4	66%	0.664	44%	0.437	S	S	*	.	H	α-helix	trans	-86.9	-15.2	176.5	-71.3	172.7	-170.6	177.5	5.9	114.9	Q997 I998 A999	Q997-R1001 WeakPolarHBondContact O-CD 3.32Å; Q997-R1001 VanDerWaalsContact O-CG 3.23Å; Q997-R1001 WeakPolarHBondContact O-CG 3.36Å; Q997-R1001 PolarHBondContact O-N 3.47Å; I998-R1001 PolarHBondContact O-N 3.26Å; A999-R1001 PolarHBondContact O-N 3.08Å; A999-R1001 VanDerWaalsContact O-N 3.1Å
1002	Q	72.6	Confident	68.6	Low	77 Å²	77	91.2 Å²	91.2	36%	0.36	47%	0.473	S	S	.	.	H	α-helix	trans	-115.1	-20.9	-177.9	-69.7	-166.1	-11.6	0	0	114	K957 H958 I998 A999 N1004	K957-Q1002 VanDerWaalsContact NZ-CD 3.27Å; H958-Q1002 PolarHBondContact CE1-NE2 3.22Å; H958-Q1002 PolarHBondContact NE2-NE2 3.48Å; H958-Q1002 PolarHBondContact NE2-OE1 3.08Å; I998-Q1002 PolarHBondContact O-N 3.19Å; A999-Q1002 PolarHBondContact O-N 3.11Å; Q1002-N1004 PolarHBondContact O-N 3.15Å
1003	I	62.3	Low	66.9	Low	76 Å²	76	98.5 Å²	98.5	39%	0.39	51%	0.506	S	S	.	.	S	Bend	trans	-86.9	100.3	175.5	-62.2	177.5	0	0	0	107.1	A999	A999-I1003 HydrophobicContact CB-CD1 3.89Å; A999-I1003 VanDerWaalsContact O-CB 3.31Å; A999-I1003 WeakPolarHBondContact O-CB 3.42Å; A999-I1003 VanDerWaalsContact O-CG1 3.29Å; A999-I1003 WeakPolarHBondContact O-CG1 3.49Å; A999-I1003 PolarHBondContact O-N 3.41Å
1004	N	48.4	Very low	66.2	Low	125 Å²	125	103 Å²	103	67%	0.668	52%	0.524	S	S	*	.			trans	-57	137.7	164.5	-142.1	18.4	0	0	0	107.7	Q1002 Y1006 S1007	Q1002-N1004 PolarHBondContact O-N 3.15Å; N1004-Y1006 PolarHBondContact O-N 2.83Å; N1004-S1007 PolarHBondContact O-N 3.34Å; N1004-S1007 VanDerWaalsContact O-N 3.14Å
1005	P	50.9	Low	65.9	Low	112 Å²	112	102.8 Å²	102.8	73%	0.727	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	1.4	-163.8	23.7	-33.9	0	0	0	116.1
1006	Y	46.2	Very low	65.7	Low	206 Å²	206	108.3 Å²	108.3	81%	0.808	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	4.5	178.3	-61.2	-79.4	0	0	0	114.3	N1004 S1008	N1004-Y1006 PolarHBondContact O-N 2.83Å; Y1006-S1008 VanDerWaalsContact C-N 3.34Å; Y1006-S1008 PolarHBondContact O-N 2.98Å
1007	S	42.7	Very low	65.8	Low	67 Å²	67	107.4 Å²	107.4	47%	0.469	55%	0.547	S	S	.	.			trans	-83.6	71	178.8	174.9	0	0	0	0	112.4	N1004 K1009	N1004-S1007 PolarHBondContact O-N 3.34Å; N1004-S1007 VanDerWaalsContact O-N 3.14Å; S1007-K1009 PolarHBondContact O-N 3.34Å
1008	S	41.3	Very low	66.1	Low	117 Å²	117	105 Å²	105	82%	0.818	54%	0.535	S	S	*	.			trans	-67.9	33	-178.7	53.8	0	0	0	0	116.2	Y1006	Y1006-S1008 VanDerWaalsContact C-N 3.34Å; Y1006-S1008 PolarHBondContact O-N 2.98Å
1009	K	45.8	Very low	66.3	Low	196 Å²	196	109 Å²	109	85%	0.852	55%	0.553	S	S	*	*			trans	-122.1	24	172.4	-65.7	-172.7	176.6	179.6	0	112.5	S1007	S1007-K1009 PolarHBondContact O-N 3.34Å
1010	A	47.4	Very low	66.7	Low	62 Å²	62	109.4 Å²	109.4	51%	0.512	55%	0.554	S	S	.	*			trans	-89.3	-17.7	179.9	0	0	0	0	0	113.7
1011	D	42.9	Very low	67.1	Low	147 Å²	147	105.3 Å²	105.3	79%	0.786	53%	0.529	S	S	*	.			trans	-81	130.3	170.7	-72	-55.7	0	0	0	111.3
1012	I	52.5	Low	67.7	Low	172 Å²	172	102.6 Å²	102.6	88%	0.882	52%	0.524	S	S	*	.	S	Bend	trans	161	-39.2	147.6	-86.3	158	0	0	0	110
1013	E	58.2	Low	68.7	Low	154 Å²	154	103.6 Å²	103.6	72%	0.72	52%	0.524	S	S	*	.			trans	-116.8	105.2	175	-74.7	-162.1	175.3	0	0	113.3	W944 L1015	W944-E1013 VanDerWaalsContact CD1-O 3.3Å; W944-E1013 PolarHBondContact NE1-O 2.96Å; E1013-L1015 PolarHBondContact O-N 2.9Å
1014	K	74.2	Confident	70.3	Confident	194 Å²	194	100 Å²	100	84%	0.843	51%	0.506	S	S	*	.			trans	-61.6	128.9	168.7	-177.2	173.2	-176.7	169.9	0	110.4	K1016	K1014-K1016 PolarHBondContact O-N 2.94Å
1015	L	86.1	Confident	72.5	Confident	6 Å²	6	94.2 Å²	94.2	3%	0.031	48%	0.475	C	S	.	.			trans	-48.9	126	178.7	179.7	65.2	0	0	0	111.1	A936 W944 V995 E1013 T1017	A936-L1015 HydrophobicContact CB-CD1 4.2Å; A936-L1015 HydrophobicContact CB-CD2 4.08Å; A936-L1015 HydrophobicContact CB-CG 4.18Å; W944-L1015 HydrophobicContact CB-CD1 3.77Å; W944-L1015 HydrophobicContact CD2-CB 3.92Å; W944-L1015 HydrophobicContact CD2-CD1 4.09Å; W944-L1015 HydrophobicContact CD2-CG 4.39Å; W944-L1015 HydrophobicContact CE3-CB 4.46Å; W944-L1015 HydrophobicContact CE3-CD1 4.33Å; W944-L1015 HydrophobicContact CE3-CD2 4.24Å; W944-L1015 HydrophobicContact CG-CB 4.08Å; W944-L1015 HydrophobicContact CG-CD1 3.85Å; W944-L1015 HydrophobicContact CZ2-CB 4.43Å; W944-L1015 HydrophobicContact CZ3-CD2 4.48Å; V995-L1015 HydrophobicContact CB-CD2 4.24Å; V995-L1015 HydrophobicContact CG1-CD2 3.93Å; E1013-L1015 PolarHBondContact O-N 2.9Å; L1015-T1017 VanDerWaalsContact C-N 3.31Å; L1015-T1017 HydrophobicContact CB-CG2 4.41Å; L1015-T1017 HydrophobicContact CD2-CG2 4.02Å; L1015-T1017 HydrophobicContact CG-CG2 4.01Å; L1015-T1017 PolarHBondContact O-N 3.04Å
1016	K	87.3	Confident	74.4	Confident	117 Å²	117	94.4 Å²	94.4	51%	0.509	47%	0.466	S	S	.	.			trans	-73.5	83.6	-177.8	-167.5	177.6	-177.4	-177.1	0	111.1	G978 K1014	G978-K1016 PolarHBondContact O-NZ 3.02Å; K1014-K1016 PolarHBondContact O-N 2.94Å
1017	T	92.5	Very high	76.7	Confident	49 Å²	49	86.9 Å²	86.9	30%	0.301	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	149.7	178.2	57.8	0	0	0	0	113	F935 A992 L1015	F935-T1017 CarbonylContact O-C 3.02Å; F935-T1017 VanDerWaalsContact O-CA 3.29Å; F935-T1017 WeakPolarHBondContact O-CA 3.42Å; A992-T1017 HydrophobicContact CB-CG2 3.54Å; L1015-T1017 VanDerWaalsContact C-N 3.31Å; L1015-T1017 HydrophobicContact CB-CG2 4.41Å; L1015-T1017 HydrophobicContact CD2-CG2 4.02Å; L1015-T1017 HydrophobicContact CG-CG2 4.01Å; L1015-T1017 PolarHBondContact O-N 3.04Å
1018	F	94.2	Very high	79.2	Confident	23 Å²	23	83.7 Å²	83.7	10%	0.101	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	158.9	175.8	49.7	-83.3	0	0	0	111.2	F935 L937 W973 L974 L979 L989 L1020	F935-F1018 PolarHBondContact N-O 2.83Å; F935-F1018 PolarHBondContact O-N 2.66Å; L937-F1018 HydrophobicContact CD2-CZ 4.36Å; L937-F1018 HydrophobicContact CG-CE1 4.01Å; L937-F1018 HydrophobicContact CG-CZ 4.07Å; W973-F1018 HydrophobicContact CH2-CD2 4.38Å; W973-F1018 HydrophobicContact CZ3-CD2 4.24Å; W973-F1018 HydrophobicContact CZ3-CE2 4.28Å; L974-F1018 HydrophobicContact CD2-CE2 3.83Å; L974-F1018 HydrophobicContact CD2-CZ 3.89Å; L979-F1018 HydrophobicContact CD1-CB 4.3Å; L979-F1018 HydrophobicContact CD1-CD1 3.74Å; L979-F1018 HydrophobicContact CD1-CD2 3.58Å; L979-F1018 HydrophobicContact CD1-CE1 3.88Å; L979-F1018 HydrophobicContact CD1-CE2 3.71Å; L979-F1018 HydrophobicContact CD1-CG 3.6Å; L979-F1018 HydrophobicContact CD1-CZ 3.86Å; L979-F1018 HydrophobicContact CD2-CD1 3.85Å; L979-F1018 HydrophobicContact CD2-CE1 4.23Å; L979-F1018 HydrophobicContact CD2-CG 4.3Å; L979-F1018 HydrophobicContact CG-CD1 4.43Å; L989-F1018 HydrophobicContact CD2-CE2 3.8Å; L989-F1018 HydrophobicContact CD2-CZ 3.48Å; L989-F1018 VanDerWaalsContact CD2-CZ 3.48Å; F1018-L1020 HydrophobicContact CD2-CD2 4Å; F1018-L1020 HydrophobicContact CE2-CD2 3.74Å
1019	K	94.4	Very high	81.6	Confident	90 Å²	90	81.9 Å²	81.9	39%	0.391	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-88.4	156.2	169.5	-65.7	179.1	178.4	-175	0	109.9	Q931 N932 H934	Q931-K1019 WeakPolarHBondContact O-CD 3.29Å; N932-K1019 PolarHBondContact OD1-NZ 3.46Å; H934-K1019 VanDerWaalsContact NE2-CE 3.33Å; H934-K1019 WeakPolarHBondContact NE2-CE 3.31Å
1020	L	94.3	Very high	83.7	Confident	14 Å²	14	75.4 Å²	75.4	7%	0.073	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-102	144.1	178.3	-59.5	178.9	0	0	0	111	F935 W973 L989 F1018 F1024 L1025 V1028	F935-L1020 HydrophobicContact CD1-CD1 4.41Å; F935-L1020 HydrophobicContact CD2-CD1 3.55Å; F935-L1020 HydrophobicContact CD2-CG 3.62Å; F935-L1020 HydrophobicContact CE2-CD1 3.66Å; F935-L1020 HydrophobicContact CE2-CG 4.08Å; F935-L1020 HydrophobicContact CG-CD1 3.94Å; F935-L1020 HydrophobicContact CG-CG 4.18Å; F935-L1020 HydrophobicContact CZ-CD1 4.15Å; W973-L1020 HydrophobicContact CZ3-CD2 4.33Å; L989-L1020 HydrophobicContact CD1-CD1 3.97Å; L989-L1020 HydrophobicContact CD1-CD2 3.89Å; F1018-L1020 HydrophobicContact CD2-CD2 4Å; F1018-L1020 HydrophobicContact CE2-CD2 3.74Å; L1020-F1024 HydrophobicContact CB-CB 4.4Å; L1020-F1024 HydrophobicContact CD2-CD1 3.84Å; L1020-F1024 HydrophobicContact CD2-CE1 3.89Å; L1020-F1024 HydrophobicContact CD2-CG 4.37Å; L1020-F1024 HydrophobicContact CD2-CZ 4.47Å; L1020-L1025 HydrophobicContact CB-CB 4.12Å; L1020-L1025 HydrophobicContact CD1-CD1 4.45Å; L1020-V1028 HydrophobicContact CD1-CB 4.34Å; L1020-V1028 HydrophobicContact CD1-CG2 3.77Å
1021	P	94	Very high	85.7	Confident	32 Å²	32	75 Å²	75	21%	0.208	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-56.9	154.4	167.3	-22.1	32.2	0	0	0	111.6	W973 W1023 F1024 L1025	W973-P1021 HydrophobicContact CD2-CG 4.11Å; W973-P1021 HydrophobicContact CH2-CG 4.23Å; W973-P1021 HydrophobicContact CZ2-CG 3.45Å; W973-P1021 VanDerWaalsContact CZ2-CG 3.45Å; P1021-W1023 VanDerWaalsContact C-N 3.33Å; P1021-W1023 HydrophobicContact CB-CG 4.48Å; P1021-W1023 HydrophobicContact CG-CZ2 4.46Å; P1021-W1023 PolarHBondContact O-N 3.35Å; P1021-F1024 HydrophobicContact CB-CB 4.5Å; P1021-F1024 PolarHBondContact O-N 3.33Å; P1021-L1025 WeakPolarHBondContact O-CB 3.37Å; P1021-L1025 PolarHBondContact O-N 3.27Å
1022	H	92.7	Very high	87.9	Confident	119 Å²	119	68.4 Å²	68.4	55%	0.551	33%	0.326	S	S	*	.	H	α-helix	trans	-54.2	-45	-175.3	-167.6	105.7	0	0	0	113.4	Q931 F1024 L1025 Q1026	Q931-H1022 PolarHBondContact NE2-ND1 3.24Å; H1022-F1024 PolarHBondContact O-N 2.86Å; H1022-L1025 PolarHBondContact O-N 3.21Å; H1022-Q1026 WeakPolarHBondContact O-CB 3.3Å; H1022-Q1026 PolarHBondContact O-N 3.02Å
1023	W	94.6	Very high	89.4	Confident	97 Å²	97	65.1 Å²	65.1	37%	0.367	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-41.4	178.1	63.7	-98.7	0	0	0	112.5	E969 W973 P1021 Q1026 K1027	E969-W1023 HydrophobicContact CG-CH2 4.12Å; E969-W1023 HydrophobicContact CG-CZ3 4.09Å; W973-W1023 HydrophobicContact CB-CH2 3.99Å; W973-W1023 HydrophobicContact CB-CZ2 3.98Å; W973-W1023 AromaticContact CD1-CZ2 3.97Å; W973-W1023 HydrophobicContact CG-CH2 4.36Å; W973-W1023 AromaticContact CG-CZ2 3.94Å; W973-W1023 HydrophobicContact CG-CZ2 3.94Å; P1021-W1023 VanDerWaalsContact C-N 3.33Å; P1021-W1023 HydrophobicContact CB-CG 4.48Å; P1021-W1023 HydrophobicContact CG-CZ2 4.46Å; P1021-W1023 PolarHBondContact O-N 3.35Å; W1023-Q1026 WeakPolarHBondContact O-CB 3.4Å; W1023-Q1026 PolarHBondContact O-N 3.5Å; W1023-K1027 PolarHBondContact O-N 3.49Å; W1023-K1027 VanDerWaalsContact O-N 3.17Å
1024	F	95.1	Very high	90.2	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-73.2	-42.9	-178.6	-165.9	179.9	0	0	0	110	Y964 D970 W973 L974 L989 L1020 P1021 H1022 Q1026 K1027 V1028	Y964-F1024 HydrophobicContact CD1-CE2 4.49Å; Y964-F1024 AromaticContact CE1-CE2 3.75Å; Y964-F1024 HydrophobicContact CE1-CE2 3.75Å; D970-F1024 HydrophobicContact CB-CD2 4.46Å; D970-F1024 HydrophobicContact CB-CE1 4.33Å; D970-F1024 HydrophobicContact CB-CE2 3.63Å; D970-F1024 HydrophobicContact CB-CZ 3.55Å; D970-F1024 WeakPolarHBondContact OD1-CD2 3.13Å; D970-F1024 WeakPolarHBondContact OD1-CE2 3.44Å; W973-F1024 HydrophobicContact CD2-CD1 4.26Å; W973-F1024 AromaticContact CE3-CD1 3.75Å; W973-F1024 HydrophobicContact CE3-CD1 3.75Å; W973-F1024 AromaticContact CE3-CE1 3.66Å; W973-F1024 HydrophobicContact CE3-CE1 3.66Å; W973-F1024 HydrophobicContact CZ3-CD1 4.17Å; W973-F1024 HydrophobicContact CZ3-CE1 4.09Å; L974-F1024 HydrophobicContact CD1-CE1 4.49Å; L974-F1024 HydrophobicContact CD1-CZ 4.33Å; L974-F1024 HydrophobicContact CD2-CE1 4.49Å; L974-F1024 HydrophobicContact CG-CE1 4.26Å; L989-F1024 HydrophobicContact CD1-CE1 4.21Å; L989-F1024 HydrophobicContact CD1-CE2 3.84Å; L989-F1024 HydrophobicContact CD1-CZ 3.52Å; L1020-F1024 HydrophobicContact CB-CB 4.4Å; L1020-F1024 HydrophobicContact CD2-CD1 3.84Å; L1020-F1024 HydrophobicContact CD2-CE1 3.89Å; L1020-F1024 HydrophobicContact CD2-CG 4.37Å; L1020-F1024 HydrophobicContact CD2-CZ 4.47Å; P1021-F1024 HydrophobicContact CB-CB 4.5Å; P1021-F1024 PolarHBondContact O-N 3.33Å; H1022-F1024 PolarHBondContact O-N 2.86Å; F1024-Q1026 VanDerWaalsContact C-N 3.25Å; F1024-Q1026 PolarHBondContact O-N 2.89Å; F1024-K1027 WeakPolarHBondContact O-CB 3.33Å; F1024-K1027 PolarHBondContact O-N 3.39Å; F1024-V1028 HydrophobicContact CD2-CG2 4.25Å; F1024-V1028 HydrophobicContact CE2-CG2 4.32Å; F1024-V1028 WeakPolarHBondContact O-CG2 3.22Å; F1024-V1028 PolarHBondContact O-N 3.46Å
1025	L	94.4	Very high	89.9	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-38.8	171.3	-175.6	66.5	0	0	0	111.3	F929 D930 Q931 F935 L1020 P1021 H1022 V1028 K1029	F929-L1025 HydrophobicContact CB-CD1 4.09Å; D930-L1025 WeakPolarHBondContact O-CD2 2.96Å; Q931-L1025 HydrophobicContact CG-CD2 4.2Å; F935-L1025 HydrophobicContact CE2-CD1 3.84Å; F935-L1025 HydrophobicContact CZ-CD1 4.19Å; L1020-L1025 HydrophobicContact CB-CB 4.12Å; L1020-L1025 HydrophobicContact CD1-CD1 4.45Å; P1021-L1025 WeakPolarHBondContact O-CB 3.37Å; P1021-L1025 PolarHBondContact O-N 3.27Å; H1022-L1025 PolarHBondContact O-N 3.21Å; L1025-V1028 PolarHBondContact O-N 3.23Å; L1025-K1029 HydrophobicContact CG-CG 4.4Å; L1025-K1029 WeakPolarHBondContact O-CG 3.37Å; L1025-K1029 PolarHBondContact O-N 2.65Å
1026	Q	92.5	Very high	88.2	Confident	116 Å²	116	64.1 Å²	64.1	54%	0.542	32%	0.319	S	S	.	.	H	α-helix	trans	-62.1	-47.6	176.7	-169.8	176.5	3.6	0	0	111.4	H1022 W1023 F1024 V1028 K1029 T1030	H1022-Q1026 WeakPolarHBondContact O-CB 3.3Å; H1022-Q1026 PolarHBondContact O-N 3.02Å; W1023-Q1026 WeakPolarHBondContact O-CB 3.4Å; W1023-Q1026 PolarHBondContact O-N 3.5Å; F1024-Q1026 VanDerWaalsContact C-N 3.25Å; F1024-Q1026 PolarHBondContact O-N 2.89Å; Q1026-V1028 VanDerWaalsContact C-N 3.3Å; Q1026-V1028 PolarHBondContact O-N 2.96Å; Q1026-K1029 PolarHBondContact O-N 2.72Å; Q1026-T1030 PolarHBondContact O-N 3.1Å; Q1026-T1030 PolarHBondContact O-OG1 3.3Å
1027	K	94.5	Very high	86.5	Confident	49 Å²	49	66.5 Å²	66.5	21%	0.213	33%	0.329	C	S	.	.	H	α-helix	trans	-53.3	-47.6	171.5	-63.9	-176.9	-176.4	-179.1	0	111.5	Y964 D967 E969 D970 W1023 F1024 T1030 V1031	Y964-K1027 HydrophobicContact CE2-CB 4.31Å; D967-K1027 IonicContact OD1-NZ 2.72Å; D967-K1027 PolarHBondContact OD1-NZ 2.82Å; D967-K1027 IonicContact OD2-NZ 2.75Å; D967-K1027 PolarHBondContact OD2-NZ 3.2Å; E969-K1027 WeakPolarHBondContact OE2-CE 3.43Å; E969-K1027 IonicContact OE2-NZ 2.68Å; E969-K1027 PolarHBondContact OE2-NZ 3.05Å; D970-K1027 WeakPolarHBondContact OD1-CD 3.41Å; D970-K1027 IonicContact OD1-NZ 2.65Å; D970-K1027 PolarHBondContact OD1-NZ 2.84Å; W1023-K1027 PolarHBondContact O-N 3.49Å; W1023-K1027 VanDerWaalsContact O-N 3.17Å; F1024-K1027 WeakPolarHBondContact O-CB 3.33Å; F1024-K1027 PolarHBondContact O-N 3.39Å; K1027-T1030 PolarHBondContact O-N 3.21Å; K1027-V1031 PolarHBondContact O-N 3.09Å
1028	V	94	Very high	84.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-43	-179.6	176.3	0	0	0	0	111.7	F929 F935 F962 Y964 L989 L1020 F1024 L1025 Q1026 T1030 V1031 A1032	F929-V1028 HydrophobicContact CD2-CG1 3.91Å; F929-V1028 HydrophobicContact CE2-CG1 3.8Å; F935-V1028 HydrophobicContact CE1-CG1 3.78Å; F935-V1028 HydrophobicContact CZ-CG1 3.86Å; F962-V1028 HydrophobicContact CE1-CG1 3.86Å; F962-V1028 HydrophobicContact CZ-CG1 3.97Å; Y964-V1028 HydrophobicContact CD1-CG2 4Å; Y964-V1028 HydrophobicContact CD2-CB 4.26Å; Y964-V1028 HydrophobicContact CD2-CG2 3.74Å; Y964-V1028 HydrophobicContact CE1-CG2 4.14Å; Y964-V1028 HydrophobicContact CE2-CB 4.49Å; Y964-V1028 HydrophobicContact CE2-CG2 3.86Å; Y964-V1028 HydrophobicContact CG-CG2 3.81Å; L989-V1028 HydrophobicContact CD1-CG2 4.33Å; L1020-V1028 HydrophobicContact CD1-CB 4.34Å; L1020-V1028 HydrophobicContact CD1-CG2 3.77Å; F1024-V1028 HydrophobicContact CD2-CG2 4.25Å; F1024-V1028 HydrophobicContact CE2-CG2 4.32Å; F1024-V1028 WeakPolarHBondContact O-CG2 3.22Å; F1024-V1028 PolarHBondContact O-N 3.46Å; L1025-V1028 PolarHBondContact O-N 3.23Å; Q1026-V1028 VanDerWaalsContact C-N 3.3Å; Q1026-V1028 PolarHBondContact O-N 2.96Å; V1028-T1030 PolarHBondContact O-N 2.87Å; V1028-V1031 PolarHBondContact O-N 2.99Å; V1028-A1032 WeakPolarHBondContact O-CB 3.29Å; V1028-A1032 PolarHBondContact O-N 2.88Å
1029	K	91.8	Very high	81.6	Confident	78 Å²	78	73.5 Å²	73.5	34%	0.339	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-43.5	172.8	-71.7	-170	-160.8	-142.2	0	111.2	F929 D930 L1025 Q1026 V1031 A1032 S1033	F929-K1029 HydrophobicContact CB-CG 4.31Å; F929-K1029 WeakPolarHBondContact O-CE 3.44Å; F929-K1029 PolarHBondContact O-NZ 3.13Å; D930-K1029 IonicContact OD1-NZ 3.6Å; L1025-K1029 HydrophobicContact CG-CG 4.4Å; L1025-K1029 WeakPolarHBondContact O-CG 3.37Å; L1025-K1029 PolarHBondContact O-N 2.65Å; Q1026-K1029 PolarHBondContact O-N 2.72Å; K1029-V1031 VanDerWaalsContact C-N 3.32Å; K1029-V1031 PolarHBondContact O-N 3.38Å; K1029-A1032 WeakPolarHBondContact O-CB 3.26Å; K1029-A1032 PolarHBondContact O-N 3Å; K1029-A1032 VanDerWaalsContact O-N 3.17Å; K1029-S1033 PolarHBondContact O-N 3.01Å; K1029-S1033 PolarHBondContact O-OG 2.82Å
1030	T	90.6	Very high	78.9	Confident	61 Å²	61	76.7 Å²	76.7	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-65	-34.7	179.1	-48.4	0	0	0	0	112.5	Q1026 K1027 V1028 R1034	Q1026-T1030 PolarHBondContact O-N 3.1Å; Q1026-T1030 PolarHBondContact O-OG1 3.3Å; K1027-T1030 PolarHBondContact O-N 3.21Å; V1028-T1030 PolarHBondContact O-N 2.87Å; T1030-R1034 WeakPolarHBondContact O-CG 3.47Å
1031	V	89.4	Confident	76.4	Confident	52 Å²	52	80.9 Å²	80.9	32%	0.315	40%	0.404	S	S	.	.	H	α-helix	trans	-71	-41	170.9	172.7	0	0	0	0	111.3	Y964 K1027 V1028 K1029 S1033 R1034 H1035	Y964-V1031 HydrophobicContact CD2-CB 3.87Å; Y964-V1031 HydrophobicContact CD2-CG1 4.1Å; Y964-V1031 HydrophobicContact CD2-CG2 3.8Å; Y964-V1031 HydrophobicContact CE2-CB 4.22Å; Y964-V1031 HydrophobicContact CE2-CG2 3.68Å; K1027-V1031 PolarHBondContact O-N 3.09Å; V1028-V1031 PolarHBondContact O-N 2.99Å; K1029-V1031 VanDerWaalsContact C-N 3.32Å; K1029-V1031 PolarHBondContact O-N 3.38Å; V1031-S1033 PolarHBondContact O-N 3.41Å; V1031-R1034 CarbonylContact O-C 3.57Å; V1031-R1034 WeakPolarHBondContact O-CA 3.46Å; V1031-R1034 PolarHBondContact O-N 2.95Å; V1031-H1035 PolarHBondContact O-N 2.87Å
1032	A	88.8	Confident	73.8	Confident	9 Å²	9	83.1 Å²	83.1	7%	0.074	41%	0.413	C	S	.	.	H	α-helix	trans	-61	-44.1	178.4	0	0	0	0	0	112.9	F927 F929 F962 V1028 K1029 R1034 H1035	F927-A1032 HydrophobicContact CB-CB 4.02Å; F929-A1032 HydrophobicContact CD2-CB 4.03Å; F929-A1032 HydrophobicContact CE2-CB 3.63Å; F929-A1032 HydrophobicContact CZ-CB 4.49Å; F962-A1032 HydrophobicContact CE2-CB 3.95Å; F962-A1032 HydrophobicContact CZ-CB 4.2Å; V1028-A1032 WeakPolarHBondContact O-CB 3.29Å; V1028-A1032 PolarHBondContact O-N 2.88Å; K1029-A1032 WeakPolarHBondContact O-CB 3.26Å; K1029-A1032 PolarHBondContact O-N 3Å; K1029-A1032 VanDerWaalsContact O-N 3.17Å; A1032-R1034 PolarHBondContact O-N 3.43Å; A1032-H1035 WeakPolarHBondContact O-CB 3.44Å; A1032-H1035 PolarHBondContact O-N 2.8Å
1033	S	84	Confident	71	Confident	104 Å²	104	78.5 Å²	78.5	73%	0.727	39%	0.394	S	S	*	.	H	α-helix	trans	-62.3	-22.1	173.7	-61.4	0	0	0	0	113.7	K1029 V1031	K1029-S1033 PolarHBondContact O-N 3.01Å; K1029-S1033 PolarHBondContact O-OG 2.82Å; V1031-S1033 PolarHBondContact O-N 3.41Å
1034	R	75.7	Confident	68.3	Low	195 Å²	195	78.8 Å²	78.8	74%	0.736	41%	0.407	S	S	*	.	H	α-helix	trans	-91.6	-11.8	173.2	-66.8	175.2	-178	141	1	112.9	T1030 V1031 A1032 S1036	T1030-R1034 WeakPolarHBondContact O-CG 3.47Å; V1031-R1034 CarbonylContact O-C 3.57Å; V1031-R1034 WeakPolarHBondContact O-CA 3.46Å; V1031-R1034 PolarHBondContact O-N 2.95Å; A1032-R1034 PolarHBondContact O-N 3.43Å; R1034-S1036 PolarHBondContact O-N 3.08Å
1035	H	67.8	Low	65.6	Low	50 Å²	50	85.9 Å²	85.9	23%	0.231	44%	0.44	C	S	.	.			trans	-81	42.8	-176.3	-160.9	-71.3	0	0	0	112.5	F962 V1031 A1032 F1037	F962-H1035 HydrophobicContact CE2-CB 4.39Å; V1031-H1035 PolarHBondContact O-N 2.87Å; A1032-H1035 WeakPolarHBondContact O-CB 3.44Å; A1032-H1035 PolarHBondContact O-N 2.8Å; H1035-F1037 VanDerWaalsContact C-N 3.31Å; H1035-F1037 PolarHBondContact O-N 3.24Å
1036	S	50.5	Low	63.1	Low	88 Å²	88	90.2 Å²	90.2	62%	0.615	46%	0.463	S	S	*	.			trans	-80.1	-6.6	-177.7	-170	0	0	0	0	114.1	R1034	R1034-S1036 PolarHBondContact O-N 3.08Å
1037	F	49.7	Very low	60.5	Low	167 Å²	167	88.4 Å²	88.4	73%	0.732	46%	0.455	S	S	*	.			trans	-140.7	98.9	-169.7	-97.8	-98.8	0	0	0	112.8	H1035	H1035-F1037 VanDerWaalsContact C-N 3.31Å; H1035-F1037 PolarHBondContact O-N 3.24Å
1038	F	42.7	Very low	57.7	Low	140 Å²	140	89.8 Å²	89.8	61%	0.614	47%	0.47	S	S	*	.	S	Bend	trans	-164.4	22.2	140.7	-127.6	-83.9	0	0	0	114.6
1039	V	43	Very low	55.1	Low	79 Å²	79	93.2 Å²	93.2	48%	0.479	49%	0.491	S	S	.	.			trans	-118.1	67	-177.1	-167.5	0	0	0	0	110.7	S1043	V1039-S1043 PolarHBondContact O-OG 3Å
1040	H	37.7	Very low	52.7	Low	157 Å²	157	92.6 Å²	92.6	73%	0.727	49%	0.489	S	S	*	.	S	Bend	trans	-139.6	18.9	172.4	-101.3	46.7	0	0	0	112
1041	V	40.1	Very low	50.2	Low	102 Å²	102	95.8 Å²	95.8	62%	0.618	50%	0.503	S	S	*	.	S	Bend	trans	-113.2	-19.7	179.9	-180	0	0	0	0	111.9	T1044	V1041-T1044 PolarHBondContact O-OG1 2.89Å
1042	I	39.6	Very low	47.9	Very low	78 Å²	78	99.5 Å²	99.5	40%	0.4	52%	0.517	S	S	.	.	S	Bend	trans	-93.3	-29.7	168.8	-63.4	175	0	0	0	110.3	P959 T1044 E1045 L1046	P959-I1042 HydrophobicContact CG-CD1 3.81Å; I1042-T1044 VanDerWaalsContact C-N 3.25Å; I1042-T1044 PolarHBondContact O-N 2.86Å; I1042-E1045 PolarHBondContact O-N 3.45Å; I1042-L1046 PolarHBondContact O-N 2.87Å
1043	S	34.2	Very low	45.8	Very low	22 Å²	22	104.7 Å²	104.7	15%	0.154	54%	0.543	C	S	.	.	G	3₁₀ helix	trans	-58.9	-36.6	179.9	-27	0	0	0	0	111.9	V1039 E1045 L1046 E1047	V1039-S1043 PolarHBondContact O-OG 3Å; S1043-E1045 PolarHBondContact O-N 3.31Å; S1043-E1045 VanDerWaalsContact O-N 3.12Å; S1043-L1046 CarbonylContact O-C 3.55Å; S1043-L1046 PolarHBondContact O-N 2.78Å; S1043-E1047 WeakPolarHBondContact CB-OE2 3.43Å; S1043-E1047 WeakPolarHBondContact O-CB 3.43Å; S1043-E1047 PolarHBondContact O-N 2.92Å
1044	T	37.5	Very low	43.7	Very low	104 Å²	104	108.8 Å²	108.8	64%	0.638	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-65.4	-11.8	173.8	45.5	0	0	0	0	115.5	V1041 I1042	V1041-T1044 PolarHBondContact O-OG1 2.89Å; I1042-T1044 VanDerWaalsContact C-N 3.25Å; I1042-T1044 PolarHBondContact O-N 2.86Å
1045	E	39.6	Very low	42.1	Very low	148 Å²	148	107 Å²	107	69%	0.692	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-107.2	2.8	173	-65.9	178.1	158.3	0	0	112.3	I1042 S1043 S1048	I1042-E1045 PolarHBondContact O-N 3.45Å; S1043-E1045 PolarHBondContact O-N 3.31Å; S1043-E1045 VanDerWaalsContact O-N 3.12Å; E1045-S1048 VanDerWaalsContact C-OG 3.23Å; E1045-S1048 PolarHBondContact O-OG 3.02Å; E1045-S1048 VanDerWaalsContact O-OG 3.12Å
1046	L	41.2	Very low	40.6	Very low	95 Å²	95	108.2 Å²	108.2	50%	0.497	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.5	-18.8	177.2	-136.1	83.7	0	0	0	114.1	I1042 S1043 T1049 K1050	I1042-L1046 PolarHBondContact O-N 2.87Å; S1043-L1046 CarbonylContact O-C 3.55Å; S1043-L1046 PolarHBondContact O-N 2.78Å; L1046-T1049 PolarHBondContact O-N 3.36Å; L1046-T1049 VanDerWaalsContact O-N 3.13Å; L1046-T1049 PolarHBondContact O-OG1 3Å; L1046-K1050 PolarHBondContact O-N 3.13Å
1047	E	37.2	Very low	40	Very low	79 Å²	79	111.3 Å²	111.3	37%	0.369	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-69.9	-23.8	167.4	-99	85.7	-111.6	0	0	111.2	S1043 T1049 K1050 N1051	S1043-E1047 WeakPolarHBondContact CB-OE2 3.43Å; S1043-E1047 WeakPolarHBondContact O-CB 3.43Å; S1043-E1047 PolarHBondContact O-N 2.92Å; E1047-T1049 PolarHBondContact O-N 3.12Å; E1047-K1050 PolarHBondContact O-N 2.93Å; E1047-K1050 VanDerWaalsContact O-N 3.13Å; E1047-N1051 PolarHBondContact O-N 3.25Å; E1047-N1051 PolarHBondContact O-ND2 2.7Å
1048	S	37.2	Very low	39.4	Very low	77 Å²	77	111.7 Å²	111.7	54%	0.538	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-53.9	-27.8	164.4	41.3	0	0	0	0	113.1	E1045	E1045-S1048 VanDerWaalsContact C-OG 3.23Å; E1045-S1048 PolarHBondContact O-OG 3.02Å; E1045-S1048 VanDerWaalsContact O-OG 3.12Å
1049	T	38.4	Very low	38.9	Very low	72 Å²	72	112.1 Å²	112.1	44%	0.442	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-110.6	7.7	176.8	54.5	0	0	0	0	113.9	L1046 E1047	L1046-T1049 PolarHBondContact O-N 3.36Å; L1046-T1049 VanDerWaalsContact O-N 3.13Å; L1046-T1049 PolarHBondContact O-OG1 3Å; E1047-T1049 PolarHBondContact O-N 3.12Å
1050	K	42.6	Very low	38.5	Very low	66 Å²	66	115.6 Å²	115.6	29%	0.287	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.6	-32.5	171.1	-75.7	-177.3	169.1	-177.4	0	113.6	N921 L1046 E1047 E1052 I1053	N921-K1050 PolarHBondContact O-NZ 3.44Å; N921-K1050 PolarHBondContact OD1-NZ 3.05Å; L1046-K1050 PolarHBondContact O-N 3.13Å; E1047-K1050 PolarHBondContact O-N 2.93Å; E1047-K1050 VanDerWaalsContact O-N 3.13Å; K1050-E1052 PolarHBondContact O-N 3.03Å; K1050-I1053 PolarHBondContact O-N 3.36Å
1051	N	38.2	Very low	38.2	Very low	127 Å²	127	113.4 Å²	113.4	68%	0.679	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-3.3	175	-66.3	-34.4	0	0	0	113.6	E1047	E1047-N1051 PolarHBondContact O-N 3.25Å; E1047-N1051 PolarHBondContact O-ND2 2.7Å
1052	E	40.3	Very low	37.8	Very low	130 Å²	130	114.2 Å²	114.2	61%	0.607	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-17.9	178.4	-166.2	167.3	-156	0	0	112.9	K1050 N1056	K1050-E1052 PolarHBondContact O-N 3.03Å; E1052-N1056 PolarHBondContact O-ND2 3.14Å
1053	I	43.7	Very low	37.4	Very low	119 Å²	119	115.9 Å²	115.9	61%	0.61	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-37	-169.8	-60.8	178.3	0	0	0	112.4	K1050 K1055	K1050-I1053 PolarHBondContact O-N 3.36Å; I1053-K1055 PolarHBondContact O-N 3.37Å
1054	E	40.6	Very low	37.6	Very low	189 Å²	189	121.9 Å²	121.9	88%	0.883	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	12.3	177.2	-67.2	-172.9	151	0	0	113.8
1055	K	41.4	Very low	37.4	Very low	157 Å²	157	123.9 Å²	123.9	68%	0.683	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	8.8	178.7	-131.5	-178.8	-176.9	-173.9	0	114.7	I1053	I1053-K1055 PolarHBondContact O-N 3.37Å
1056	N	37.1	Very low	37.3	Very low	77 Å²	77	128.4 Å²	128.4	41%	0.412	68%	0.677	S	S	.	*	S	Bend	trans	-118.8	16.3	-174.3	-83.7	-63.3	0	0	0	113.9	E1052	E1052-N1056 PolarHBondContact O-ND2 3.14Å
1057	I	38.7	Very low	37	Very low	152 Å²	152	128.9 Å²	128.9	78%	0.779	69%	0.685	S	S	*	*	S	Bend	trans	-131.2	46.3	-180	-39.4	-177.7	0	0	0	111.9
1058	Q	36.3	Very low	36.7	Very low	175 Å²	175	134.7 Å²	134.7	82%	0.818	71%	0.71	S	S	*	*	S	Bend	trans	-154.3	167	153.3	-112	161.7	-33.8	0	0	107.6
1059	D	32	Very low	36.5	Very low	150 Å²	150	135.5 Å²	135.5	80%	0.802	72%	0.721	S	S	*	*			trans	65.1	63.1	-175.9	-52.3	-21.5	0	0	0	115.5
1060	N	33.9	Very low	36.3	Very low	151 Å²	151	137.4 Å²	137.4	81%	0.807	74%	0.737	S	S	*	*			trans	-147.2	46	165.6	-129.4	-18	0	0	0	113.4
1061	S	33.2	Very low	36.1	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	76%	0.76	S	S	*	*			trans	-160	71.8	176.1	65	0	0	0	0	114.6
1062	S	31	Very low	35.7	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	76%	0.764	S	S	*	*			trans	-179.4	107.6	149.7	31.7	0	0	0	0	113.7
1063	S	32	Very low	35.5	Very low	113 Å²	113	142.4 Å²	142.4	79%	0.79	77%	0.768	S	S	*	*			trans	168.8	107.3	133	44.8	0	0	0	0	112
1064	V	36.8	Very low	35	Very low	148 Å²	148	143.7 Å²	143.7	90%	0.897	77%	0.772	S	S	*	*			trans	-147.1	116.3	144.8	-178.8	0	0	0	0	106.7
1065	D	34.7	Very low	34.8	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	76%	0.761	S	S	*	*			trans	-76.9	139.9	170.9	-67.4	-74.1	0	0	0	111.5
1066	R	36.2	Very low	34.5	Very low	243 Å²	243	136.4 Å²	136.4	92%	0.917	76%	0.762	S	S	*	*				-169.8	147.5	127.2	-103.7	161	-174	-139.5	-1.7	112
1067	P	35.5	Very low	34.2	Very low	104 Å²	104	137.8 Å²	137.8	68%	0.675	78%	0.777	S	S	*	*			trans	-88.7	162.1	179.6	36.7	-35.4	0	0	0	112.1
1068	F	30.7	Very low	33.9	Very low	202 Å²	202	135.3 Å²	135.3	89%	0.886	77%	0.774	S	S	*	*				179.2	155.6	117.8	-110.5	-80	0	0	0	113.4
1069	A	33.3	Very low	33.8	Very low	93 Å²	93	131.5 Å²	131.5	77%	0.769	77%	0.766	S	S	*	*			trans	55.3	115.1	152.2	0	0	0	0	0	121.3
1070	S	34.4	Very low	33.8	Very low	112 Å²	112	129.8 Å²	129.8	78%	0.783	77%	0.766	S	S	*	*			trans	-108.6	149.7	159.5	56.7	0	0	0	0	112
1071	P	38.2	Very low	33.8	Very low	118 Å²	118	127 Å²	127	77%	0.766	76%	0.758	S	S	*	*			trans	-104.2	136.1	141.9	-3.6	24.7	0	0	0	109
1072	F	30.2	Very low	33.7	Very low	176 Å²	176	126.8 Å²	126.8	77%	0.772	76%	0.756	S	S	*	*				58.9	114.1	57.1	-134	-110.6	0	0	0	111	Q1074	F1072-Q1074 HydrophobicContact CE1-CG 4.5Å
1073	I	34.9	Very low	33.6	Very low	134 Å²	134	125.7 Å²	125.7	69%	0.687	75%	0.749	S	S	*	*				-157.3	148.3	76.7	-88.5	167.3	0	0	0	112.3
1074	Q	34.4	Very low	33.6	Very low	146 Å²	146	127.9 Å²	127.9	68%	0.682	75%	0.749	S	S	*	*			trans	5.9	155.4	147.1	-40.2	164.7	-84.5	0	0	120	F1072	F1072-Q1074 HydrophobicContact CE1-CG 4.5Å
1075	S	35.2	Very low	33.3	Very low	95 Å²	95	124.6 Å²	124.6	66%	0.664	73%	0.732	S	S	*	*			cis	-159.1	143.4	28.3	-44.8	0	0	0	0	115.2
1076	S	35.3	Very low	33.1	Very low	99 Å²	99	128 Å²	128	69%	0.692	73%	0.734	S	S	*	*			trans	41.3	128.5	132.6	70.1	0	0	0	0	124.7
1077	S	31.4	Very low	32.8	Very low	106 Å²	106	120.1 Å²	120.1	74%	0.741	72%	0.716	S	S	*	*				64.6	146.3	126.6	64.6	0	0	0	0	122.1
1078	S	33	Very low	32.6	Very low	100 Å²	100	122.1 Å²	122.1	70%	0.699	72%	0.721	S	S	*	*			cis	-171.8	175.4	-10.7	50.9	0	0	0	0	111.9
1079	S	34.5	Very low	32.6	Very low	94 Å²	94	117.6 Å²	117.6	66%	0.657	71%	0.71	S	S	*	*			trans	64.5	118.9	141.6	56.9	0	0	0	0	121.2
1080	S	31.7	Very low	32.6	Very low	115 Å²	115	118.1 Å²	118.1	80%	0.804	71%	0.708	S	S	*	*			trans	72.4	150.6	134.2	-59.1	0	0	0	0	118.8
1081	S	32.4	Very low	32.4	Very low	92 Å²	92	119.5 Å²	119.5	64%	0.643	70%	0.702	S	S	*	*			cis	-172.3	163.1	-16.7	49.3	0	0	0	0	108
1082	S	31.5	Very low	32.2	Very low	107 Å²	107	122 Å²	122	75%	0.748	70%	0.701	S	S	*	*			trans	60.7	154.3	159.4	44.6	0	0	0	0	116.7
1083	S	29.8	Very low	32.1	Very low	95 Å²	95	121.8 Å²	121.8	66%	0.664	70%	0.7	S	S	*	*			cis	-170.4	170.5	-14.6	48.5	0	0	0	0	107.1
1084	M	30.6	Very low	31.9	Very low	159 Å²	159	120.7 Å²	120.7	78%	0.783	70%	0.695	S	S	*	*			trans	43.3	127.6	140	-72.7	-173.3	81.6	0	0	119.2
1085	S	31.7	Very low	31.6	Very low	79 Å²	79	119.6 Å²	119.6	55%	0.552	69%	0.694	S	S	*	*			cis	172.7	173.4	20.7	48.2	0	0	0	0	111.3
1086	R	29.8	Very low	31.3	Very low	219 Å²	219	121.9 Å²	121.9	83%	0.826	70%	0.698	S	S	*	*			trans	66.4	153.6	143.6	-80.3	165.8	175.9	-169.7	-1.4	117.4
1087	S	30.7	Very low	30.9	Very low	78 Å²	78	121 Å²	121	55%	0.545	69%	0.692	S	S	.	*			cis	-178.5	171.5	-23.2	51.1	0	0	0	0	109.2
1088	N	30.3	Very low	30.7	Very low	145 Å²	145	121.3 Å²	121.3	78%	0.775	69%	0.69	S	S	*	*			trans	73.1	160.5	147.2	-69.3	-5.5	0	0	0	117.9
1089	V	30.5	Very low	30.3	Very low	108 Å²	108	120.9 Å²	120.9	66%	0.655	69%	0.687	S	S	*	*			cis	179.3	130.6	-43.2	130.2	0	0	0	0	106.7
1090	S	34.3	Very low	29.9	Very low	104 Å²	104	124.2 Å²	124.2	73%	0.727	70%	0.696	S	S	*	*			trans	-175.3	130.5	149.9	37.3	0	0	0	0	106
1091	Q	30.9	Very low	29.8	Very low	141 Å²	141	123.5 Å²	123.5	66%	0.659	69%	0.691	S	S	*	*				61.3	132.5	55.8	-58	-179.8	-16.3	0	0	110.6
1092	F	32.6	Very low	29.8	Very low	171 Å²	171	126.1 Å²	126.1	75%	0.75	70%	0.698	S	S	*	*			cis	-119.7	163.3	20.8	-74.4	-103.7	0	0	0	110.8
1093	K	29.2	Very low	29.9	Very low	171 Å²	171	126.5 Å²	126.5	74%	0.743	70%	0.698	S	S	*	*				58.4	144.2	51.8	-84.3	-171.5	151.2	-151.5	0	111.7
1094	L	30.4	Very low	29.8	Very low	111 Å²	111	129.3 Å²	129.3	58%	0.581	70%	0.703	S	S	*	*			cis	-151.2	146.7	13.4	-164.6	71.8	0	0	0	111
1095	D	27.8	Very low	29.7	Very low	122 Å²	122	128.6 Å²	128.6	65%	0.652	70%	0.697	S	S	*	*			trans	19.2	172.6	147.7	-42.9	-17.4	0	0	0	123.8
1096	N	28.6	Very low	29.5	Very low	143 Å²	143	130.8 Å²	130.8	77%	0.765	70%	0.701	S	S	*	*			trans	80	143.7	155.4	-64.1	-28.8	0	0	0	119.5
1097	S	26.6	Very low	29.5	Very low	81 Å²	81	125.6 Å²	125.6	57%	0.566	69%	0.69	S	S	*	*			cis	-176.2	-169.6	-23.4	51.4	0	0	0	0	107.3
1098	T	27.3	Very low	29.2	Very low	113 Å²	113	129.9 Å²	129.9	69%	0.693	70%	0.701	S	S	*	*			trans	47.8	95.8	146.7	47.9	0	0	0	0	117.7
1099	S	25.1	Very low	29	Very low	90 Å²	90	132.1 Å²	132.1	63%	0.629	70%	0.7	S	S	*	*				81.1	148.5	71.9	70	0	0	0	0	114.3
1100	L	27	Very low	28.8	Very low	164 Å²	164	132 Å²	132	86%	0.859	70%	0.7	S	S	*	*			trans	70.7	147.3	173.3	-54	157.5	0	0	0	113
1101	S	28.7	Very low	28.5	Very low	100 Å²	100	131.7 Å²	131.7	70%	0.699	70%	0.698	S	S	*	*			cis	-163.9	158.3	-15.6	42.9	0	0	0	0	109.4
1102	N	32.4	Very low	28.5	Very low	148 Å²	148	131.9 Å²	131.9	79%	0.791	70%	0.699	S	S	*	*			trans	-59.2	148	161.6	-55.8	-24.3	0	0	0	109.2
1103	P	34	Very low	28.2	Very low	114 Å²	114	130.4 Å²	130.4	74%	0.74	70%	0.698	S	S	*	*				-104.8	158	78.2	-15.1	34.3	0	0	0	112.5
1104	M	27.4	Very low	28.3	Very low	154 Å²	154	129.4 Å²	129.4	76%	0.759	70%	0.7	S	S	*	*			cis	70.6	152.8	34.4	-158.7	-172.5	152.7	0	0	112.9
1105	E	28.4	Very low	28	Very low	145 Å²	145	130.9 Å²	130.9	68%	0.678	71%	0.706	S	S	*	*			trans	80.3	138.8	164.7	-58.7	-150.8	154.5	0	0	118.2
1106	I	28.2	Very low	28	Very low	124 Å²	124	130.7 Å²	130.7	64%	0.636	71%	0.71	S	S	*	*			cis	-162.6	166.8	-20.4	-132.3	168	0	0	0	110.9
1107	N	28.2	Very low	28.1	Very low	111 Å²	111	129.7 Å²	129.7	59%	0.594	71%	0.709	S	S	*	*			trans	66.3	139.6	172.5	-68.4	-23.4	0	0	0	117.7
1108	H	25.9	Very low	28.2	Very low	167 Å²	167	130.9 Å²	130.9	77%	0.773	71%	0.708	S	S	*	*			cis	78.6	159.2	36	-69.5	-73.9	0	0	0	115.2
1109	Y	26	Very low	28.4	Very low	192 Å²	192	131.5 Å²	131.5	75%	0.753	71%	0.714	S	S	*	*			trans	74.1	105.9	-165.8	-57.2	-80.7	0	0	0	111.6
1110	T	26.5	Very low	28.8	Very low	106 Å²	106	131.7 Å²	131.7	65%	0.65	72%	0.715	S	S	*	*				58.1	109.8	51.8	-42.6	0	0	0	0	108.9
1111	S	27.2	Very low	29.2	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	71%	0.71	S	S	*	*				-170.8	150.3	88.5	27.1	0	0	0	0	114.5
1112	H	30.4	Very low	29.3	Very low	145 Å²	145	135.6 Å²	135.6	67%	0.671	72%	0.72	S	S	*	*			trans	42.8	111.7	137.1	-51.1	-38.6	0	0	0	119.3
1113	N	26.6	Very low	29.4	Very low	140 Å²	140	134.8 Å²	134.8	75%	0.749	71%	0.709	S	S	*	*				81.6	175.5	79.2	-71.2	-19.2	0	0	0	113.3
1114	I	31.2	Very low	29.2	Very low	150 Å²	150	135.8 Å²	135.8	77%	0.769	71%	0.707	S	S	*	*			trans	79.9	91.5	-178.9	-52.2	164	0	0	0	110.9
1115	I	25.4	Very low	29.4	Very low	141 Å²	141	134.5 Å²	134.5	72%	0.723	70%	0.702	S	S	*	*				58.4	105.5	64.3	-48.1	165.7	0	0	0	109.7
1116	T	27.4	Very low	29.6	Very low	119 Å²	119	134.2 Å²	134.2	73%	0.73	71%	0.705	S	S	*	*				-177.7	169	87.4	-30.3	0	0	0	0	105.4
1117	T	29.7	Very low	29.8	Very low	122 Å²	122	133.3 Å²	133.3	75%	0.748	71%	0.71	S	S	*	*			cis	-154.4	-168.1	18.6	-39.2	0	0	0	0	110
1118	I	28.6	Very low	30.1	Very low	105 Å²	105	133.4 Å²	133.4	54%	0.538	72%	0.717	S	S	.	*			trans	-131.1	144	-176.4	-62.3	161.2	0	0	0	110.8	F1131	I1118-F1131 HydrophobicContact CD1-CE2 4.19Å
1119	P	32.9	Very low	30.5	Very low	126 Å²	126	131.1 Å²	131.1	82%	0.818	71%	0.714	S	S	*	*			trans	-112.4	118.1	141.8	33	-24.1	0	0	0	109.8
1120	S	33.1	Very low	30.7	Very low	94 Å²	94	129.1 Å²	129.1	66%	0.657	72%	0.715	S	S	*	*			cis	72.2	135.4	36	-60.7	0	0	0	0	114.8
1121	S	34.4	Very low	30.9	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	71%	0.714	S	S	*	*			cis	-172.7	151.4	-19	-112.9	0	0	0	0	111.9
1122	R	32.2	Very low	30.9	Very low	240 Å²	240	130.4 Å²	130.4	91%	0.906	71%	0.711	S	S	*	*			trans	149.5	129.4	161.7	-92.9	177.8	-90.5	-153.4	-2.7	107.3
1123	K	33.7	Very low	31	Very low	132 Å²	132	128.5 Å²	128.5	57%	0.574	71%	0.714	S	S	*	*	S	Bend	cis	-149.1	166	5.3	-107.1	-165.8	163.1	175.9	0	106.2	E293	E293-K1123 IonicContact OE1-NZ 3.63Å; E293-K1123 PolarHBondContact OE1-NZ 3.05Å; E293-K1123 IonicContact OE2-NZ 3.89Å; E293-K1123 PolarHBondContact OE2-NZ 2.79Å
1124	I	30.8	Very low	31.3	Very low	134 Å²	134	126.6 Å²	126.6	69%	0.687	71%	0.712	S	S	*	*			cis	-174.9	149.5	-25.5	-127.5	-177.2	0	0	0	104.8
1125	L	30.6	Very low	31.3	Very low	128 Å²	128	124.8 Å²	124.8	67%	0.67	71%	0.712	S	S	*	*			cis	-158.2	161.5	1.4	-170.5	81.2	0	0	0	107.8
1126	N	32.7	Very low	32	Very low	138 Å²	138	123.5 Å²	123.5	74%	0.738	71%	0.713	S	S	*	*			trans	65.8	133.5	166.5	-62.8	-17.8	0	0	0	119.2
1127	S	32.1	Very low	32	Very low	105 Å²	105	122.9 Å²	122.9	73%	0.734	71%	0.714	S	S	*	*			cis	-157.7	168.4	-9.1	-114.1	0	0	0	0	110.1
1128	P	35.9	Very low	32	Very low	114 Å²	114	121.3 Å²	121.3	74%	0.74	71%	0.713	S	S	*	*			trans	-105	179.4	-133.2	28.9	-10.9	0	0	0	114.3
1129	V	33.4	Very low	31.9	Very low	118 Å²	118	123.9 Å²	123.9	72%	0.715	73%	0.727	S	S	*	*				-167.9	126.6	62.6	163	0	0	0	0	112.5
1130	I	30.5	Very low	31.6	Very low	150 Å²	150	122.2 Å²	122.2	77%	0.769	72%	0.718	S	S	*	*			trans	41.5	132.3	136.8	-64.7	173.4	0	0	0	119.1
1131	F	30.3	Very low	31.3	Very low	141 Å²	141	125.8 Å²	125.8	62%	0.618	73%	0.729	S	S	*	*			cis	-150.2	-151.7	10	-146.5	-122.5	0	0	0	115.1	I1118	I1118-F1131 HydrophobicContact CD1-CE2 4.19Å
1132	S	28.2	Very low	30.9	Very low	90 Å²	90	125.2 Å²	125.2	63%	0.629	73%	0.731	S	S	*	*			trans	-149.7	172.7	-160.2	-55.9	0	0	0	0	115
1133	S	32	Very low	30.7	Very low	106 Å²	106	118.8 Å²	118.8	74%	0.741	72%	0.723	S	S	*	*			trans	69.5	157.9	150.2	46.3	0	0	0	0	119.7
1134	S	31.5	Very low	30.5	Very low	100 Å²	100	117.2 Å²	117.2	70%	0.699	73%	0.729	S	S	*	*			cis	-163	152.7	-4	33.1	0	0	0	0	108.2
1135	S	32.7	Very low	30.4	Very low	111 Å²	111	115.9 Å²	115.9	78%	0.776	73%	0.731	S	S	*	*				65.1	149.6	52.3	-58.2	0	0	0	0	115.1
1136	P	38.6	Very low	30.3	Very low	114 Å²	114	114.5 Å²	114.5	74%	0.74	73%	0.732	S	S	*	*			cis	-141.2	-148.4	-27.7	39.9	-18.4	0	0	0	112.7
1137	S	28.8	Very low	30.1	Very low	107 Å²	107	113.8 Å²	113.8	75%	0.748	73%	0.733	S	S	*	*			trans	79.5	123.5	164.3	-60.2	0	0	0	0	117
1138	A	28.1	Very low	29.9	Very low	88 Å²	88	115 Å²	115	73%	0.727	74%	0.736	S	S	*	*				67.5	130	77	0	0	0	0	0	112.3
1139	L	26.7	Very low	29.5	Very low	160 Å²	160	114 Å²	114	84%	0.838	73%	0.731	S	S	*	*				-153.5	135.3	54.9	-80.5	166	0	0	0	110.5
1140	S	26.5	Very low	29.2	Very low	91 Å²	91	115.8 Å²	115.8	64%	0.636	73%	0.729	S	S	*	*				86	128.6	88.3	90.3	0	0	0	0	116.9
1141	L	27.7	Very low	29.1	Very low	168 Å²	168	117.9 Å²	117.9	88%	0.88	73%	0.729	S	S	*	*			trans	21.2	107.9	148.5	-69.6	75.4	0	0	0	119.2
1142	A	26.6	Very low	28.9	Very low	95 Å²	95	115.1 Å²	115.1	79%	0.785	73%	0.727	S	S	*	*			trans	-165.8	145.2	141	0	0	0	0	0	108.9
1143	S	27.6	Very low	28.8	Very low	105 Å²	105	118.4 Å²	118.4	73%	0.734	74%	0.737	S	S	*	*			cis	-169.4	-171.7	-15.8	-109.6	0	0	0	0	108.8
1144	S	29.1	Very low	28.6	Very low	99 Å²	99	119.1 Å²	119.1	69%	0.692	74%	0.737	S	S	*	*			trans	57.9	102.7	154.3	43.8	0	0	0	0	117.5
1145	S	29.1	Very low	28.4	Very low	106 Å²	106	118.2 Å²	118.2	74%	0.741	74%	0.735	S	S	*	*				75.1	149.9	79.7	74.7	0	0	0	0	113.1
1146	S	28.7	Very low	28	Very low	99 Å²	99	118.1 Å²	118.1	69%	0.692	74%	0.735	S	S	*	*			cis	-139.7	142.2	21.3	-57.6	0	0	0	0	109.1
1147	V	27.6	Very low	27.4	Very low	123 Å²	123	117.9 Å²	117.9	75%	0.745	74%	0.736	S	S	*	*				58.3	138.9	77.3	-172.5	0	0	0	0	113.5
1148	T	28.7	Very low	27.2	Very low	130 Å²	130	117.7 Å²	117.7	80%	0.798	73%	0.734	S	S	*	*			trans	79.1	147.5	-175.1	77.2	0	0	0	0	115.5
1149	S	27.4	Very low	27.1	Very low	92 Å²	92	119.9 Å²	119.9	64%	0.643	74%	0.738	S	S	*	*			cis	-158.4	133.9	-23.1	-104.3	0	0	0	0	111.7
1150	K	26.4	Very low	27.1	Very low	157 Å²	157	118.5 Å²	118.5	68%	0.683	73%	0.728	S	S	*	*			trans	33.3	156.4	131.9	-57.7	-178.4	178.3	-179.9	0	122.1
1151	Y	28.4	Very low	27	Very low	193 Å²	193	120.6 Å²	120.6	76%	0.757	73%	0.727	S	S	*	*			trans	85.5	145.7	158.1	-49.3	-62.2	0	0	0	117.4
1152	S	26.1	Very low	26.9	Very low	83 Å²	83	117.4 Å²	117.4	58%	0.58	72%	0.718	S	S	*	*			cis	-178	141.3	-35.4	48.1	0	0	0	0	110.4
1153	L	26.3	Very low	27.1	Very low	160 Å²	160	119.7 Å²	119.7	84%	0.838	71%	0.712	S	S	*	*			trans	62.5	177.2	159.4	-55.4	156.9	0	0	0	113.4
1154	T	27.1	Very low	27.2	Very low	120 Å²	120	120.2 Å²	120.2	74%	0.736	71%	0.707	S	S	*	*			cis	-152.7	158.1	-0.7	-22.6	0	0	0	0	109.8
1155	A	28.1	Very low	27.5	Very low	81 Å²	81	122.1 Å²	122.1	67%	0.669	71%	0.707	S	S	*	*			trans	63.6	153.1	157.7	0	0	0	0	0	117.5
1156	S	24.6	Very low	27.6	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	70%	0.699	S	S	*	*			cis	80.5	147.3	20.6	-50.5	0	0	0	0	115.2
1157	S	26.3	Very low	27.9	Very low	109 Å²	109	124.6 Å²	124.6	76%	0.762	70%	0.703	S	S	*	*			trans	59	125.9	-162.4	57.3	0	0	0	0	114.2
1158	S	24.7	Very low	28	Very low	102 Å²	102	124.3 Å²	124.3	71%	0.713	70%	0.698	S	S	*	*			cis	75.5	151.9	44.3	81.2	0	0	0	0	113.4
1159	V	26	Very low	28.3	Very low	134 Å²	134	125.9 Å²	125.9	81%	0.812	70%	0.696	S	S	*	*			trans	76.1	141.3	-176.1	-178.8	0	0	0	0	113.3
1160	Q	25.3	Very low	28.4	Very low	132 Å²	132	127.9 Å²	127.9	62%	0.617	70%	0.7	S	S	*	*			cis	-172.7	163.1	-27.9	-169.1	69	7.6	0	0	107.2
1161	E	25.6	Very low	28.7	Very low	134 Å²	134	123.2 Å²	123.2	63%	0.626	69%	0.687	S	S	*	*			trans	51.2	123.8	158.9	-94.8	100.1	-113.9	0	0	119.3
1162	C	25.6	Very low	28.9	Very low	101 Å²	101	118.6 Å²	118.6	68%	0.682	68%	0.675	S	S	*	*				69.5	137.5	87.5	-57.9	0	0	0	0	113
1163	H	30.5	Very low	29.1	Very low	144 Å²	144	119.2 Å²	119.2	67%	0.667	67%	0.672	S	S	*	*				-155.4	142.7	51.4	-87.4	-88.1	0	0	0	113.7
1164	D	29.7	Very low	29.3	Very low	116 Å²	116	116.7 Å²	116.7	62%	0.62	66%	0.66	S	S	*	*				65.1	156.2	125.8	-48	-8.3	0	0	0	121.5
1165	M	35.6	Very low	29.6	Very low	139 Å²	139	118.9 Å²	118.9	69%	0.685	67%	0.667	S	S	*	*			cis	-128	137.4	3.4	-69.9	-98.5	67.5	0	0	113.3
1166	D	31.2	Very low	29.9	Very low	109 Å²	109	120 Å²	120	58%	0.583	67%	0.669	S	S	*	*			trans	30.8	122.9	131.2	-52.4	-15.2	0	0	0	123.2
1167	N	34.4	Very low	30.2	Very low	147 Å²	147	122.8 Å²	122.8	79%	0.786	68%	0.676	S	S	*	*				169.5	153.9	93.6	-89.6	-69.1	0	0	0	111.7
1168	N	30.4	Very low	30.4	Very low	118 Å²	118	123 Å²	123	63%	0.631	67%	0.672	S	S	*	*			cis	-161.3	163.7	-41.3	-147.3	-35.8	0	0	0	109.8
1169	Q	34.9	Very low	30.5	Very low	162 Å²	162	126.4 Å²	126.4	76%	0.757	68%	0.682	S	S	*	*			trans	65.5	119.5	165.4	-56.7	-175.8	14.5	0	0	117.3
1170	N	29.5	Very low	30.8	Very low	135 Å²	135	127.6 Å²	127.6	72%	0.722	68%	0.682	S	S	*	*				86.2	150.4	63.8	-87.2	-10.6	0	0	0	114.2
1171	S	32.5	Very low	30.8	Very low	59 Å²	59	126.1 Å²	126.1	41%	0.413	68%	0.679	S	S	.	*			cis	-150.4	145.1	4.2	-168.5	0	0	0	0	113.2	S900 R901	S900-S1171 WeakPolarHBondContact CB-O 3.13Å; S900-S1171 CarbonylContact O-C 3.54Å; S900-S1171 PolarHBondContact OG-O 3.47Å; R901-S1171 CarbonylContact O-C 3.5Å
1172	N	33.1	Very low	31	Very low	95 Å²	95	123 Å²	123	51%	0.508	66%	0.661	S	S	.	*			trans	9.4	164.5	155.8	-64	-35.1	0	0	0	122	S899 S900 R901	S899-N1172 CarbonylContact C-O 3.18Å; S899-N1172 CarbonylContact O-C 3.35Å; S900-N1172 VanDerWaalsContact C-C 3.4Å; S900-N1172 CarbonylContact C-O 3.58Å; S900-N1172 CarbonylContact O-C 3.52Å; S900-N1172 PolarHBondContact OG-O 3.45Å; R901-N1172 CarbonylContact O-C 3.4Å; R901-N1172 WeakPolarHBondContact O-CA 3.46Å; R901-N1172 PolarHBondContact O-N 2.81Å
1173	N	31	Very low	31.1	Very low	97 Å²	97	121.4 Å²	121.4	52%	0.519	65%	0.646	S	S	.	*				-154.9	136.5	-58.8	-146	-1.8	0	0	0	108.2	S899 R901 L902	S899-N1173 CarbonylContact O-C 3.55Å; S899-N1173 VanDerWaalsContact O-CA 3.25Å; S899-N1173 WeakPolarHBondContact O-CA 3.33Å; S899-N1173 PolarHBondContact O-N 3.47Å; S899-N1173 VanDerWaalsContact O-O 3.14Å; R901-N1173 VanDerWaalsContact C-OD1 3.23Å; R901-N1173 VanDerWaalsContact CA-OD1 3.26Å; R901-N1173 WeakPolarHBondContact CA-OD1 3.46Å; L902-N1173 PolarHBondContact N-OD1 3.24Å; L902-N1173 PolarHBondContact O-ND2 3.22Å; L902-N1173 VanDerWaalsContact O-ND2 3.14Å
1174	N	29.5	Very low	31	Very low	107 Å²	107	126 Å²	126	57%	0.572	66%	0.659	S	S	*	*			trans	-158.8	114.2	-178.4	-116.1	-31.7	0	0	0	114.6
1175	N	34	Very low	31.1	Very low	166 Å²	166	123 Å²	123	89%	0.888	65%	0.645	S	S	*	*			trans	-179.8	117.6	143.2	-104	-5	0	0	0	110
1176	S	33.9	Very low	30.7	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	66%	0.656	S	S	*	*			trans	-85.2	128.2	172.6	45.9	0	0	0	0	111	V1178	S1176-V1178 PolarHBondContact O-N 2.82Å
1177	N	29.9	Very low	30.7	Very low	170 Å²	170	125.8 Å²	125.8	91%	0.909	66%	0.661	S	S	*	*			trans	-75	94.9	170	-80.8	-35.1	0	0	0	109.6	L1179	N1177-L1179 PolarHBondContact O-N 2.76Å
1178	V	30.7	Very low	30.3	Very low	112 Å²	112	124.5 Å²	124.5	68%	0.679	66%	0.663	S	S	*	*			trans	-75.4	111.3	169.9	175.5	0	0	0	0	109.1	S1176 L1180	S1176-V1178 PolarHBondContact O-N 2.82Å; V1178-L1180 HydrophobicContact CG1-CD1 4.33Å; V1178-L1180 HydrophobicContact CG1-CG 4.06Å; V1178-L1180 PolarHBondContact O-N 3.43Å
1179	L	28.4	Very low	30.2	Very low	175 Å²	175	130.1 Å²	130.1	92%	0.916	68%	0.676	S	S	*	*			trans	-66.4	106.7	160.5	-77.3	166.1	0	0	0	108.6	N1177	N1177-L1179 PolarHBondContact O-N 2.76Å
1180	L	30.4	Very low	29.8	Very low	159 Å²	159	131.3 Å²	131.3	83%	0.832	68%	0.678	S	S	*	*			trans	-117.3	122	157	-90.6	173.1	0	0	0	109.9	V1178	V1178-L1180 HydrophobicContact CG1-CD1 4.33Å; V1178-L1180 HydrophobicContact CG1-CG 4.06Å; V1178-L1180 PolarHBondContact O-N 3.43Å
1181	N	26.9	Very low	29.9	Very low	100 Å²	100	130.1 Å²	130.1	54%	0.535	68%	0.68	S	S	.	*			trans	-77.4	177.2	178	-159.7	-23.9	0	0	0	109.9	S860	S860-N1181 PolarHBondContact OG-ND2 3.33Å
1182	R	28.7	Very low	29.6	Very low	69 Å²	69	132.9 Å²	132.9	26%	0.26	70%	0.695	S	S	.	*			trans	91.8	134.3	148	-80	177.3	-163.9	86	45.6	122.8	I856 N857 S860 D861	I856-R1182 PolarHBondContact O-NE 3.22Å; I856-R1182 PolarHBondContact O-NH2 3.36Å; N857-R1182 VanDerWaalsContact CA-CZ 3.41Å; N857-R1182 PolarHBondContact ND2-NE 3.45Å; N857-R1182 WeakPolarHBondContact OD1-CD 3.14Å; N857-R1182 PolarHBondContact OD1-NE 3.38Å; N857-R1182 PolarHBondContact OD1-NH1 3.22Å; S860-R1182 PolarHBondContact OG-NH2 2.83Å; D861-R1182 IonicContact OD1-NH1 3.91Å; D861-R1182 IonicContact OD2-NH1 3.58Å
1183	N	27.3	Very low	29.4	Very low	68 Å²	68	135.6 Å²	135.6	36%	0.364	71%	0.71	S	S	.	*			trans	72.3	73.9	132.9	-62.7	-12.4	0	0	0	119.5	R853 T1185	R853-N1183 PolarHBondContact NH1-OD1 2.88Å; N1183-T1185 PolarHBondContact O-N 2.98Å; N1183-T1185 VanDerWaalsContact O-N 3.09Å
1184	Y	30.2	Very low	29.4	Very low	239 Å²	239	135.5 Å²	135.5	94%	0.937	72%	0.716	S	S	*	*			trans	-76.1	81.2	138.7	-84.8	-75.8	0	0	0	111
1185	T	30.5	Very low	29.3	Very low	55 Å²	55	139.3 Å²	139.3	34%	0.337	72%	0.724	S	S	.	*			trans	-71.2	147	160.8	-45	0	0	0	0	109.2	R853 N1183 S1187	R853-T1185 PolarHBondContact NE-OG1 3.11Å; R853-T1185 PolarHBondContact NH1-OG1 3.02Å; N1183-T1185 PolarHBondContact O-N 2.98Å; N1183-T1185 VanDerWaalsContact O-N 3.09Å; T1185-S1187 PolarHBondContact O-N 3.16Å
1186	K	27	Very low	29.2	Very low	208 Å²	208	137.1 Å²	137.1	90%	0.904	72%	0.721	S	S	*	*			trans	-69.7	115.8	161.7	-85.2	-176.6	170.8	-176.9	0	109
1187	S	31.7	Very low	29	Very low	98 Å²	98	141.5 Å²	141.5	69%	0.685	73%	0.728	S	S	*	*			trans	-125.1	131.6	160	61.6	0	0	0	0	109.2	T1185	T1185-S1187 PolarHBondContact O-N 3.16Å
1188	S	26.1	Very low	29	Very low	119 Å²	119	139.7 Å²	139.7	83%	0.832	72%	0.723	S	S	*	*			trans	-104.4	111.8	-174	53.5	0	0	0	0	110.3
1189	W	29	Very low	28.9	Very low	237 Å²	237	142.8 Å²	142.8	90%	0.898	73%	0.732	S	S	*	*			trans	-122.7	122.8	172.1	-75.9	79.2	0	0	0	110.4
1190	K	25.3	Very low	28.8	Very low	186 Å²	186	139.3 Å²	139.3	81%	0.809	72%	0.722	S	S	*	*			trans	-97.8	127.6	169.1	-67.7	179.4	176.1	-177	0	108.5
1191	S	31.6	Very low	28.9	Very low	110 Å²	110	139.3 Å²	139.3	77%	0.769	72%	0.721	S	S	*	*			trans	-172.8	114.2	147	-76.9	0	0	0	0	106
1192	T	26.3	Very low	28.9	Very low	118 Å²	118	140.9 Å²	140.9	72%	0.724	73%	0.73	S	S	*	*				67.1	131.8	58.2	68.9	0	0	0	0	114.4
1193	N	28.8	Very low	29	Very low	152 Å²	152	148.4 Å²	148.4	81%	0.813	76%	0.76	S	S	*	*			trans	76.7	138.7	178.1	-56.4	-7.2	0	0	0	115.1
1194	S	31.3	Very low	29.1	Very low	94 Å²	94	150.6 Å²	150.6	66%	0.657	78%	0.776	S	S	*	*			cis	-159.4	168	-8.6	-111.5	0	0	0	0	113.7
1195	Y	28.1	Very low	29.2	Very low	188 Å²	188	145.8 Å²	145.8	74%	0.737	77%	0.766	S	S	*	*			trans	-18.4	147.7	151.6	-65.7	-104.5	0	0	0	115.4
1196	S	31.6	Very low	29.2	Very low	119 Å²	119	149.8 Å²	149.8	83%	0.832	78%	0.782	S	S	*	*				-156.1	162.7	51	-57.6	0	0	0	0	115.5
1197	K	29.6	Very low	29.4	Very low	196 Å²	196	145.7 Å²	145.7	85%	0.852	77%	0.769	S	S	*	*			trans	-111	134.2	176.3	160.9	-164.1	-178.5	-176.7	0	108.5
1198	T	28.8	Very low	29.4	Very low	131 Å²	131	146.7 Å²	146.7	80%	0.804	77%	0.767	S	S	*	*			trans	-176.9	151.8	146.8	24	0	0	0	0	114.9
1199	M	30.5	Very low	29.8	Very low	177 Å²	177	147 Å²	147	87%	0.872	76%	0.76	S	S	*	*			trans	66.8	120.5	157.2	-67.6	-54.7	-175.7	0	0	121.2
1200	S	25.7	Very low	30.2	Very low	102 Å²	102	142.4 Å²	142.4	71%	0.713	75%	0.753	S	S	*	*			trans	-73.2	167.7	155.5	-34.8	0	0	0	0	111.3
1201	I	32.6	Very low	30.6	Very low	159 Å²	159	139.9 Å²	139.9	82%	0.815	75%	0.748	S	S	*	*			trans	-155.2	146.5	131.2	-100.4	149.8	0	0	0	106.9
1202	D	26.3	Very low	30.7	Very low	134 Å²	134	142.7 Å²	142.7	72%	0.717	75%	0.753	S	S	*	*			trans	-72.2	167.1	-177.7	-52.2	-89	0	0	0	112.5
1203	Y	31.3	Very low	31	Very low	226 Å²	226	142.4 Å²	142.4	89%	0.886	75%	0.751	S	S	*	*				-169.2	133.7	111.1	-103.5	-70.9	0	0	0	110.6
1204	T	29.5	Very low	31.4	Very low	115 Å²	115	143 Å²	143	71%	0.706	75%	0.754	S	S	*	*			trans	-90.5	146.9	168.6	50.1	0	0	0	0	110.5
1205	D	32.3	Very low	31.4	Very low	137 Å²	137	146.5 Å²	146.5	73%	0.733	76%	0.758	S	S	*	*			trans	-177.1	161.8	136.4	-95	-21.8	0	0	0	108
1206	Q	30.3	Very low	31.8	Very low	140 Å²	140	146.1 Å²	146.1	65%	0.654	77%	0.766	S	S	*	*			cis	168.7	154.3	-32.6	-115.1	-162.1	71	0	0	104
1207	N	31.2	Very low	32	Very low	121 Å²	121	147.6 Å²	147.6	65%	0.647	76%	0.76	S	S	*	*			trans	65.9	154.4	160.2	-67.8	-45.5	0	0	0	119.2
1208	N	31	Very low	32	Very low	120 Å²	120	143 Å²	143	64%	0.642	75%	0.753	S	S	*	*			cis	-167	177.3	-40.4	-139.1	-39.8	0	0	0	109
1209	N	34.4	Very low	32.3	Very low	126 Å²	126	144.8 Å²	144.8	67%	0.674	76%	0.757	S	S	*	*			trans	67.7	136.4	160.4	-52.7	-28.6	0	0	0	115.8
1210	N	37.1	Very low	32.5	Very low	140 Å²	140	141.9 Å²	141.9	75%	0.749	75%	0.751	S	S	*	*			cis	-146.3	147.6	25.4	-98.8	-53	0	0	0	114.8
1211	N	33.5	Very low	32.8	Very low	132 Å²	132	142.4 Å²	142.4	71%	0.706	76%	0.755	S	S	*	*			trans	-27.9	141.9	162.5	-56.6	-63.9	0	0	0	118.6
1212	L	35.4	Very low	33.1	Very low	169 Å²	169	140.4 Å²	140.4	89%	0.885	75%	0.752	S	S	*	*				-151	109.3	124.1	-122.5	164.4	0	0	0	110.6
1213	V	32.1	Very low	33.6	Very low	112 Å²	112	141.6 Å²	141.6	68%	0.679	76%	0.758	S	S	*	*			trans	-94.5	135.9	179.1	172.7	0	0	0	0	109.5
1214	N	36.4	Very low	34.2	Very low	164 Å²	164	136 Å²	136	88%	0.877	75%	0.75	S	S	*	*			trans	-145.7	146.6	152.2	-114.2	-37.7	0	0	0	111.4
1215	K	32.7	Very low	34.6	Very low	169 Å²	169	136.3 Å²	136.3	74%	0.735	75%	0.753	S	S	*	*			trans	-135.1	104.9	-158.5	175.9	-169.2	174.7	-173.3	0	110.4
1216	I	36	Very low	34.6	Very low	179 Å²	179	136 Å²	136	92%	0.918	76%	0.757	S	S	*	*			trans	-128.7	152.3	169	-62.6	-176.4	0	0	0	108.5
1217	Q	34.6	Very low	34.8	Very low	151 Å²	151	136.9 Å²	136.9	71%	0.706	77%	0.765	S	S	*	*			trans	-128.8	145.8	-147.2	-173.1	170.5	-38.5	0	0	112.9
1218	S	31.4	Very low	35	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	77%	0.768	S	S	*	*			trans	53.8	116.4	159.1	58.2	0	0	0	0	120.2
1219	L	35.1	Very low	35	Very low	168 Å²	168	142.6 Å²	142.6	88%	0.88	78%	0.775	S	S	*	*			trans	-149.5	112.1	139.6	-112.5	157.8	0	0	0	108.5
1220	P	33.4	Very low	35	Very low	116 Å²	116	142.9 Å²	142.9	75%	0.753	77%	0.771	S	S	*	*			trans	-85.3	141.6	-179.1	33.3	-33.2	0	0	0	111.5
1221	S	33.2	Very low	34.8	Very low	113 Å²	113	141.7 Å²	141.7	79%	0.79	76%	0.764	S	S	*	*			trans	-155	155.1	172.5	-84.8	0	0	0	0	110.1
1222	P	37.2	Very low	34.8	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	77%	0.769	S	S	*	*	P	Polyproline II helix		-89.8	153	-119	29.6	-37	0	0	0	114.9
1223	N	36.9	Very low	34.6	Very low	158 Å²	158	141.3 Å²	141.3	85%	0.845	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-56.4	125.3	170.9	-69.2	-21.9	0	0	0	110.3
1224	P	44	Very low	34.6	Very low	110 Å²	110	142 Å²	142	71%	0.714	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-62.7	147.8	161.7	29.2	-33.5	0	0	0	108.8	T1226	P1224-T1226 PolarHBondContact O-N 3.32Å
1225	P	38.3	Very low	34.5	Very low	120 Å²	120	142 Å²	142	78%	0.779	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-61.7	130.6	-176.5	25.1	-33.9	0	0	0	110.5	L1227	P1225-L1227 VanDerWaalsContact C-N 3.34Å; P1225-L1227 PolarHBondContact O-N 3.34Å
1226	T	32.8	Very low	34.5	Very low	132 Å²	132	147.5 Å²	147.5	81%	0.81	77%	0.774	S	S	*	*			trans	-60.8	98.6	164.6	39.8	0	0	0	0	108.3	P1224 E1228	P1224-T1226 PolarHBondContact O-N 3.32Å; T1226-E1228 PolarHBondContact O-N 2.73Å
1227	L	34.7	Very low	34.4	Very low	158 Å²	158	146 Å²	146	83%	0.827	77%	0.766	S	S	*	*			trans	-63.6	105.5	171.9	-117.5	169.2	0	0	0	107.5	P1225	P1225-L1227 VanDerWaalsContact C-N 3.34Å; P1225-L1227 PolarHBondContact O-N 3.34Å
1228	E	35	Very low	34.4	Very low	150 Å²	150	145.7 Å²	145.7	70%	0.701	77%	0.77	S	S	*	*			trans	-57.5	146.1	-176.5	-71.7	-171.2	117.8	0	0	111	T1226 F1230	T1226-E1228 PolarHBondContact O-N 2.73Å; E1228-F1230 VanDerWaalsContact C-N 3.26Å; E1228-F1230 HydrophobicContact CB-CE2 4.49Å; E1228-F1230 WeakPolarHBondContact O-CD2 3.42Å; E1228-F1230 PolarHBondContact O-N 3.18Å
1229	R	30.6	Very low	34.6	Very low	211 Å²	211	148.2 Å²	148.2	80%	0.796	77%	0.773	S	S	*	*			trans	-68.1	87	173.1	-176.5	-170.9	-170.8	134.4	1	108.4	D1231	R1229-D1231 IonicContact NE-OD1 3.87Å; R1229-D1231 IonicContact NE-OD2 3.63Å; R1229-D1231 PolarHBondContact O-N 3.45Å
1230	F	34.8	Very low	34.5	Very low	131 Å²	131	147.1 Å²	147.1	58%	0.575	77%	0.767	S	S	*	*			trans	-67.3	81.3	177.5	-94	-84.1	0	0	0	111	E1228 Y1232	E1228-F1230 VanDerWaalsContact C-N 3.26Å; E1228-F1230 HydrophobicContact CB-CE2 4.49Å; E1228-F1230 WeakPolarHBondContact O-CD2 3.42Å; E1228-F1230 PolarHBondContact O-N 3.18Å; F1230-Y1232 HydrophobicContact CB-CD2 3.85Å; F1230-Y1232 HydrophobicContact CB-CE2 3.81Å; F1230-Y1232 HydrophobicContact CD1-CD2 4.16Å; F1230-Y1232 AromaticContact CD1-CE2 3.49Å; F1230-Y1232 HydrophobicContact CD1-CE2 3.49Å; F1230-Y1232 VanDerWaalsContact CD1-CE2 3.49Å; F1230-Y1232 AromaticContact CD1-CZ 3.81Å; F1230-Y1232 HydrophobicContact CE1-CE2 4.37Å; F1230-Y1232 HydrophobicContact CG-CD2 4.43Å; F1230-Y1232 AromaticContact CG-CE2 3.92Å; F1230-Y1232 HydrophobicContact CG-CE2 3.92Å; F1230-Y1232 PolarHBondContact O-N 3.4Å
1231	D	33.5	Very low	34.6	Very low	116 Å²	116	149 Å²	149	62%	0.62	77%	0.768	S	S	*	*			trans	-70.2	77.9	171.3	-73.3	-37.6	0	0	0	109.3	R1229 T1233	R1229-D1231 IonicContact NE-OD1 3.87Å; R1229-D1231 IonicContact NE-OD2 3.63Å; R1229-D1231 PolarHBondContact O-N 3.45Å; D1231-T1233 PolarHBondContact O-N 2.79Å
1232	Y	32.7	Very low	34.7	Very low	204 Å²	204	151.4 Å²	151.4	80%	0.8	77%	0.767	S	S	*	*			trans	-69.7	76.3	177.3	-89.4	-74.2	0	0	0	112.2	F1230	F1230-Y1232 HydrophobicContact CB-CD2 3.85Å; F1230-Y1232 HydrophobicContact CB-CE2 3.81Å; F1230-Y1232 HydrophobicContact CD1-CD2 4.16Å; F1230-Y1232 AromaticContact CD1-CE2 3.49Å; F1230-Y1232 HydrophobicContact CD1-CE2 3.49Å; F1230-Y1232 VanDerWaalsContact CD1-CE2 3.49Å; F1230-Y1232 AromaticContact CD1-CZ 3.81Å; F1230-Y1232 HydrophobicContact CE1-CE2 4.37Å; F1230-Y1232 HydrophobicContact CG-CD2 4.43Å; F1230-Y1232 AromaticContact CG-CE2 3.92Å; F1230-Y1232 HydrophobicContact CG-CE2 3.92Å; F1230-Y1232 PolarHBondContact O-N 3.4Å
1233	T	30.8	Very low	34.5	Very low	88 Å²	88	153.9 Å²	153.9	54%	0.54	77%	0.767	S	S	.	*			trans	-130	140.8	160.7	51.8	0	0	0	0	109.8	L96 D1231	L96-T1233 HydrophobicContact CD2-CG2 4.41Å; D1231-T1233 PolarHBondContact O-N 2.79Å
1234	T	32.4	Very low	34.3	Very low	127 Å²	127	153.5 Å²	153.5	78%	0.779	76%	0.761	S	S	*	*			trans	70.9	98.7	-176.6	71	0	0	0	0	116.6
1235	N	34.2	Very low	33.5	Very low	164 Å²	164	157.2 Å²	157.2	88%	0.877	77%	0.765	S	S	*	*				-161.8	119	113.4	-113.4	-53.6	0	0	0	112.4
1236	R	32.3	Very low	33.1	Very low	285 Å²	285	160.5 Å²	160.5	100%	1.075	76%	0.764	S	S	*	*			trans	70.9	0	179.4	-144.2	176.2	-150.1	174.8	8	117.4

Retrieved 1,236 of 1,236 residues in 756.2 ms (Link to these results)

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