A0A3Q0KKT6_SCHMA Loading...

Putative guanyl-nucleotide exchange factor

AlphaFold DB , UniProt , Accession A0A3Q0KKT6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,116 aa.

						>A0A3Q0KKT6_SCHMA|A0A3Q0KKT6
MNSTSHSVDSSVIQASLFGQYNRTGDPTSLWCDESLENPDSILDQCKCYTSTPSSFSTTSESTSYSRDLYVTSRLRSRSEEKNCKSEHSFHPSHSVINYLKLDKLSNKMCPGCVPCSSSDDKLRFSVYSEEKDDLKVTPKDFQHGNKLKRKENQSFKSSSSVCYSDDSDSVPPAMALINVNRLHTQALHPESLNKNRIIVTNKILHDFNNELDFSGSKLSKTFLNTSRKSLPAIHLDRDLEISGSSGTSSLSYTAVIVNETEYIPPDKRSVASPDESNEHYLTSLHFGQTGASARDSGLSSHSSNSVNYSPNSLVLPHKRLVPECKNSLSPTPPPVPRHAPQSQVMVALTQRNGNIPCETDLTKCTCSKGASSKMAVERIRGTTIRLHSHTGESKTLLKSYFPRENEQNKQNLNSSLSPIWKRKSNTLQSMIKDKIQLIEEQNYSKSIQITKSKEGGVNKREEKDDDEVERKGKHLINKVQYENTTTIKNDNNHDRIHNSCLLLNDSTKQQDICTACTLNWQFYLSQPCSYTFIDNMAKCYHDVNNAWYFVKHDCFLNSTIRLFKHDSCFNCRKHIYAVGVNLFNRNPLRGLKYLARHNFLNLSSSKEVSKFIQNNADLCRSKIGAFLGLPPTDEINPTEVTMILLKSLNISGLEVDEALRLVVHRYGMPVESQEIDRLLQCVTEYYHTVRWCSTSVNSSDIFSSTNDHQLKSLPAPPISPDQLSLIFYAILLLQTSLHNVNAAKSSLGKQNVSQFIKNVHDLLLNQPSSSPSPSFMAKSKSKIANHNDVVDESGNMLTINTESILDNENNINNNKSFDIKHVFSNRTLTEIFHRIKVRPLEPGSDQTTIVRHISKAIRNLQEVKILNIDDIDNESLFTNNPFELVEPHRRLVCYCTVVHINQNQPPHKETSILRHLFVFNDLIIIAKDTSSKRTSGRRLVFDKSRKNQLKINDKKLSPGQYDDFLRPPLDLLYTDCDKKFKIMNTGSNTLSCIQPTVGCVPHRVGGGRGRRSRSKNELYSRKAADSTSHSYTRLTALYVFSLYRCKIRPFKTDVYRYGIELWKFPKSRTSQTTLINQQPEQMIIIAALDKNDYENLLNDLYQALCETNLVAFELK
					

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	31	Very low	30.6	Very low	226 Å²	226	129.7 Å²	129.7	100%	1.113	76%	0.762	S	S	*	*				0	77.6	0	-60.4	-180	-175	0	0	106.4
2	N	32	Very low	30.1	Very low	153 Å²	153	130.1 Å²	130.1	82%	0.818	77%	0.766	S	S	*	*				74.7	127.1	67.8	-59	34.3	0	0	0	110.7
3	S	31.4	Very low	29.8	Very low	97 Å²	97	131 Å²	131	68%	0.678	76%	0.763	S	S	*	*			cis	-167	168.7	-11.7	43.9	0	0	0	0	109.9
4	T	33.1	Very low	29.5	Very low	119 Å²	119	134.6 Å²	134.6	73%	0.73	77%	0.769	S	S	*	*			trans	22.7	144	140.6	59.2	0	0	0	0	120.9
5	S	31.6	Very low	29.4	Very low	80 Å²	80	131.7 Å²	131.7	56%	0.559	77%	0.768	S	S	*	*			cis	166.9	162	-4.9	52.8	0	0	0	0	108.8
6	H	32.3	Very low	29.3	Very low	180 Å²	180	129.2 Å²	129.2	83%	0.833	76%	0.76	S	S	*	*			trans	62.4	168.9	153	-64.2	-45.6	0	0	0	116.1
7	S	31	Very low	29.3	Very low	90 Å²	90	130.2 Å²	130.2	63%	0.629	76%	0.761	S	S	*	*			cis	-163.2	132.7	-29.6	51.4	0	0	0	0	107.9
8	V	28.9	Very low	29.2	Very low	124 Å²	124	134 Å²	134	75%	0.752	77%	0.767	S	S	*	*				79.9	137.2	108.9	176.4	0	0	0	0	116.1
9	D	29.4	Very low	29.2	Very low	144 Å²	144	130.7 Å²	130.7	77%	0.77	77%	0.765	S	S	*	*			trans	67	108.2	160.4	-67.2	-14.3	0	0	0	124.7
10	S	25.7	Very low	29.3	Very low	109 Å²	109	133.1 Å²	133.1	76%	0.762	77%	0.769	S	S	*	*				74.9	161.9	103.7	-149.1	0	0	0	0	122.4
11	S	30.1	Very low	29.2	Very low	105 Å²	105	136.4 Å²	136.4	73%	0.734	77%	0.77	S	S	*	*			trans	60.5	123.5	-171.6	60.5	0	0	0	0	114.7
12	V	24.8	Very low	29.1	Very low	134 Å²	134	132.9 Å²	132.9	81%	0.812	76%	0.756	S	S	*	*			cis	74.5	129.1	33.4	-165.9	0	0	0	0	113.8
13	I	26.9	Very low	28.8	Very low	142 Å²	142	136.2 Å²	136.2	73%	0.728	76%	0.757	S	S	*	*			trans	124.6	100.4	162.5	-65.8	-175.7	0	0	0	115.5
14	Q	25.5	Very low	28.7	Very low	181 Å²	181	138.2 Å²	138.2	85%	0.846	77%	0.765	S	S	*	*			trans	66.3	153	139.3	-67.2	177.6	-18.4	0	0	124.1
15	A	28.2	Very low	28.3	Very low	92 Å²	92	136 Å²	136	76%	0.76	77%	0.766	S	S	*	*			trans	74.7	142.7	152.9	0	0	0	0	0	118.8
16	S	26.3	Very low	28	Very low	91 Å²	91	139.9 Å²	139.9	64%	0.636	78%	0.78	S	S	*	*			cis	-175.5	162.3	-18.9	45.5	0	0	0	0	110
17	L	29.3	Very low	27.9	Very low	147 Å²	147	136.6 Å²	136.6	77%	0.77	78%	0.775	S	S	*	*			trans	68.9	150	168.7	-60.5	127.1	0	0	0	116.3
18	F	28.5	Very low	27.6	Very low	198 Å²	198	139.3 Å²	139.3	87%	0.868	79%	0.788	S	S	*	*			cis	-157.9	142.1	-31.7	-139.5	-108.4	0	0	0	106.2
19	G	29.3	Very low	27.6	Very low	72 Å²	72	137.4 Å²	137.4	74%	0.742	78%	0.781	S	S	*	*			trans	-167.5	126.5	-177.7	0	0	0	0	0	112.9
20	Q	30.3	Very low	27.6	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	78%	0.779	S	S	*	*			trans	-65.2	136.7	-167.8	-72.7	145.6	-28.2	0	0	113.3
21	Y	26.8	Very low	27.8	Very low	202 Å²	202	143.1 Å²	143.1	79%	0.792	78%	0.784	S	S	*	*				45.3	131.2	101.3	-66.3	-83.4	0	0	0	114.5
22	N	29.4	Very low	27.6	Very low	153 Å²	153	142.1 Å²	142.1	82%	0.818	78%	0.776	S	S	*	*			cis	-143.7	178	30.8	-104.8	-47.8	0	0	0	114.5
23	R	26.6	Very low	27.8	Very low	223 Å²	223	142.1 Å²	142.1	84%	0.842	77%	0.772	S	S	*	*			trans	-98	143.5	-177.9	-57.3	174.3	177	-179.9	-1.9	112.9
24	T	28	Very low	28	Very low	139 Å²	139	143.9 Å²	143.9	85%	0.853	78%	0.777	S	S	*	*				143.7	126.5	114.7	56.1	0	0	0	0	114.2
25	G	26	Very low	28.2	Very low	73 Å²	73	141.1 Å²	141.1	75%	0.753	78%	0.778	S	S	*	*			trans	91	128	153.2	0	0	0	0	0	116.9
26	D	24.1	Very low	28.2	Very low	160 Å²	160	144.4 Å²	144.4	86%	0.856	78%	0.781	S	S	*	*			trans	54.8	143	169.7	-58.7	-19.5	0	0	0	118.7
27	P	30.5	Very low	28.4	Very low	112 Å²	112	147.9 Å²	147.9	73%	0.727	79%	0.788	S	S	*	*				-143.4	126.7	117	33.7	-18.6	0	0	0	114.4
28	T	25.8	Very low	28.5	Very low	146 Å²	146	147.9 Å²	147.9	90%	0.896	79%	0.788	S	S	*	*			trans	-100.7	95	154.6	48.6	0	0	0	0	109.2
29	S	27.8	Very low	28.7	Very low	85 Å²	85	143.3 Å²	143.3	59%	0.594	78%	0.779	S	S	*	*			trans	-172.9	139.8	-177.6	57.9	0	0	0	0	109
30	L	29.3	Very low	28.6	Very low	139 Å²	139	147.5 Å²	147.5	73%	0.728	78%	0.784	S	S	*	*			cis	-127.6	-175.2	-9.1	-75.5	109.8	0	0	0	106.4
31	W	29.9	Very low	28.7	Very low	233 Å²	233	143.8 Å²	143.8	88%	0.883	78%	0.778	S	S	*	*			cis	-139	128.4	29.5	-78.2	55.4	0	0	0	107
32	C	27.3	Very low	28.8	Very low	84 Å²	84	141.8 Å²	141.8	57%	0.568	78%	0.779	S	S	*	*				70.6	126.8	90.4	-70	0	0	0	0	112.4
33	D	28.9	Very low	28.7	Very low	135 Å²	135	141.8 Å²	141.8	72%	0.722	78%	0.779	S	S	*	*			cis	-139.6	165.9	18.2	-78.6	-52.8	0	0	0	115.9
34	E	29.1	Very low	28.8	Very low	179 Å²	179	138 Å²	138	84%	0.836	78%	0.775	S	S	*	*			trans	11	142	145.6	-52.5	-173.1	146.3	0	0	119.5
35	S	29.9	Very low	28.7	Very low	122 Å²	122	140 Å²	140	85%	0.853	78%	0.775	S	S	*	*			cis	-158	172	26.7	38.5	0	0	0	0	112.3
36	L	28.3	Very low	28.6	Very low	161 Å²	161	141.9 Å²	141.9	84%	0.843	78%	0.775	S	S	*	*			trans	-103.8	136.5	-178.1	-166.4	86.9	0	0	0	110.7
37	E	32.3	Very low	28.7	Very low	164 Å²	164	143.4 Å²	143.4	77%	0.766	77%	0.774	S	S	*	*				175.4	126.1	129.6	-98.4	177.8	-155.5	0	0	115.3
38	N	30	Very low	28.5	Very low	147 Å²	147	144 Å²	144	79%	0.786	78%	0.779	S	S	*	*			trans	63.9	156	152.1	-69.3	-47.6	0	0	0	122.9
39	P	32.5	Very low	28.5	Very low	102 Å²	102	148.3 Å²	148.3	66%	0.662	78%	0.781	S	S	*	*			trans	-113.3	-175.3	-167.3	43.3	-32.9	0	0	0	115
40	D	28.3	Very low	28.4	Very low	160 Å²	160	150 Å²	150	86%	0.856	79%	0.787	S	S	*	*			trans	59.2	63.3	162.5	-64.3	-13.2	0	0	0	117.2
41	S	32.1	Very low	28.4	Very low	100 Å²	100	149.1 Å²	149.1	70%	0.699	79%	0.793	S	S	*	*			trans	-142.7	118.8	162.5	-170.6	0	0	0	0	113.6
42	I	29.3	Very low	28.2	Very low	160 Å²	160	143.6 Å²	143.6	82%	0.821	79%	0.785	S	S	*	*			trans	68.1	134.1	151.8	-65.9	171.5	0	0	0	118.7
43	L	27.2	Very low	28.3	Very low	154 Å²	154	145.5 Å²	145.5	81%	0.806	80%	0.797	S	S	*	*			trans	-81.6	156.9	173.9	-176.2	67.1	0	0	0	110.7
44	D	27.4	Very low	28.4	Very low	142 Å²	142	144.9 Å²	144.9	76%	0.759	80%	0.803	S	S	*	*	S	Bend	trans	80.1	140.2	-180	-79.6	-29.5	0	0	0	118.5
45	Q	26.1	Very low	28.3	Very low	183 Å²	183	140.7 Å²	140.7	86%	0.855	79%	0.793	S	S	*	*			trans	66.2	82.4	167.6	-59.4	-177.6	46.9	0	0	119.8
46	C	25.3	Very low	28.3	Very low	111 Å²	111	144.6 Å²	144.6	75%	0.75	80%	0.795	S	S	*	*				-157.6	110.6	129.2	-106.7	0	0	0	0	116.3
47	K	26.4	Very low	28.2	Very low	192 Å²	192	142.5 Å²	142.5	84%	0.835	79%	0.794	S	S	*	*				39.8	87.9	126.5	-58.4	173.2	-175.8	171.3	0	118.9
48	C	26.3	Very low	27.9	Very low	124 Å²	124	140.9 Å²	140.9	84%	0.838	80%	0.795	S	S	*	*			trans	-77.9	140.1	148.6	-68.3	0	0	0	0	110	T50	C48-T50 PolarHBondContact O-N 2.97Å; C48-T50 VanDerWaalsContact O-N 3.13Å
49	Y	24.5	Very low	27.8	Very low	238 Å²	238	140.4 Å²	140.4	93%	0.933	80%	0.798	S	S	*	*			trans	-66.2	108.4	-179	-86.6	-108.3	0	0	0	112.4	S51	Y49-S51 PolarHBondContact O-N 2.86Å
50	T	26.6	Very low	27.7	Very low	119 Å²	119	140.6 Å²	140.6	73%	0.73	80%	0.802	S	S	*	*			trans	-76.4	115	159.2	51.6	0	0	0	0	109.3	C48 T52	C48-T50 PolarHBondContact O-N 2.97Å; C48-T50 VanDerWaalsContact O-N 3.13Å; T50-T52 PolarHBondContact O-N 3.28Å
51	S	28.2	Very low	27.5	Very low	121 Å²	121	142.5 Å²	142.5	85%	0.846	81%	0.806	S	S	*	*			trans	-65	99.9	171.8	54.7	0	0	0	0	110.2	Y49	Y49-S51 PolarHBondContact O-N 2.86Å
52	T	27.1	Very low	27.3	Very low	117 Å²	117	143.4 Å²	143.4	72%	0.718	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.8	130.9	179.2	46.1	0	0	0	0	111.2	T50 S54	T50-T52 PolarHBondContact O-N 3.28Å; T52-S54 PolarHBondContact O-N 3.36Å
53	P	28.1	Very low	27.3	Very low	125 Å²	125	142.7 Å²	142.7	81%	0.812	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-68.3	124.3	163.6	29.3	-31.8	0	0	0	109
54	S	31.2	Very low	27.2	Very low	122 Å²	122	139.9 Å²	139.9	85%	0.853	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-65.3	139.7	175.2	49.5	0	0	0	0	111.3	T52	T52-S54 PolarHBondContact O-N 3.36Å
55	S	27.8	Very low	27.1	Very low	91 Å²	91	141 Å²	141	64%	0.636	80%	0.803	S	S	*	*			trans	-92.8	174.6	-169.9	52.9	0	0	0	0	114.6
56	F	28.4	Very low	27.2	Very low	204 Å²	204	138 Å²	138	90%	0.895	80%	0.802	S	S	*	*			trans	77.7	142.8	178.4	-52.6	-79.5	0	0	0	115.3
57	S	28.1	Very low	27.4	Very low	116 Å²	116	144.3 Å²	144.3	81%	0.811	81%	0.81	S	S	*	*			cis	-133	158.7	2.3	54	0	0	0	0	113
58	T	25.5	Very low	27.3	Very low	130 Å²	130	141 Å²	141	80%	0.798	80%	0.802	S	S	*	*			trans	-88.5	138.5	-175.6	49.8	0	0	0	0	114.4
59	T	26.6	Very low	27.4	Very low	137 Å²	137	138.6 Å²	138.6	84%	0.84	78%	0.78	S	S	*	*			trans	-171.8	167.6	134.1	22	0	0	0	0	112.2
60	S	30.6	Very low	27.5	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	77%	0.771	S	S	*	*			trans	53.5	82.9	166.6	59.5	0	0	0	0	118.9
61	E	24.5	Very low	27.5	Very low	200 Å²	200	136.6 Å²	136.6	94%	0.935	77%	0.773	S	S	*	*				13.7	112.9	128.4	-58.5	177.5	155.1	0	0	119.1
62	S	28.9	Very low	27.4	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	77%	0.769	S	S	*	*			trans	-146.2	147.3	147.5	68.6	0	0	0	0	109.8
63	T	28	Very low	27.3	Very low	144 Å²	144	133.5 Å²	133.5	88%	0.883	75%	0.751	S	S	*	*			trans	-76.3	149.8	-164.1	40.9	0	0	0	0	115.6
64	S	24.7	Very low	27.2	Very low	95 Å²	95	134.8 Å²	134.8	66%	0.664	74%	0.739	S	S	*	*			trans	-64.8	143.5	178.6	54.7	0	0	0	0	114.1
65	Y	26.1	Very low	27	Very low	165 Å²	165	135.6 Å²	135.6	65%	0.647	73%	0.733	S	S	*	*				-175.5	102.1	117.5	-107.7	-73.1	0	0	0	111.8
66	S	29.1	Very low	26.9	Very low	120 Å²	120	140.5 Å²	140.5	84%	0.839	74%	0.738	S	S	*	*			trans	-155.1	11.5	174.2	-41.1	0	0	0	0	114.8
67	R	28.1	Very low	26.8	Very low	244 Å²	244	136.5 Å²	136.5	92%	0.921	74%	0.735	S	S	*	*			trans	-114.2	-0.3	-165.8	-135.4	174.7	-168.6	127.3	6.2	115.9
68	D	25.8	Very low	26.9	Very low	123 Å²	123	138.3 Å²	138.3	66%	0.658	72%	0.724	S	S	*	*	S	Bend	trans	-94.4	152.2	168.9	-71	-52.9	0	0	0	110.7
69	L	28.1	Very low	26.8	Very low	74 Å²	74	138 Å²	138	39%	0.387	73%	0.727	S	S	.	*	S	Bend	trans	92.8	23.7	175.5	-52.1	168.9	0	0	0	119.3	T736 N742 A743	L69-T736 HydrophobicContact CD1-CG2 4.03Å; L69-N742 HydrophobicContact CD2-CB 3.59Å; L69-A743 HydrophobicContact CD1-CB 3.79Å
70	Y	26.8	Very low	27	Very low	188 Å²	188	137.8 Å²	137.8	74%	0.737	72%	0.717	S	S	*	*	S	Bend	trans	-139.3	36.4	163.1	-124.8	-80.9	0	0	0	117.2	V671	Y70-V671 HydrophobicContact CD1-CG1 4.31Å; Y70-V671 HydrophobicContact CD2-CG1 3.79Å; Y70-V671 HydrophobicContact CE1-CG1 4.09Å; Y70-V671 HydrophobicContact CE2-CG1 3.54Å; Y70-V671 HydrophobicContact CE2-CG2 4.44Å; Y70-V671 HydrophobicContact CG-CG1 4.18Å
71	V	26	Very low	26.8	Very low	126 Å²	126	141.6 Å²	141.6	76%	0.764	72%	0.723	S	S	*	*			trans	-137.1	102.1	170	-173.8	0	0	0	0	111.8
72	T	25.1	Very low	27.2	Very low	126 Å²	126	142.1 Å²	142.1	77%	0.773	72%	0.722	S	S	*	*			trans	-140.6	46.2	166.4	56.7	0	0	0	0	112.9
73	S	25.8	Very low	27	Very low	47 Å²	47	143.6 Å²	143.6	33%	0.329	72%	0.721	S	S	.	*	S	Bend	trans	-158.5	42.6	178.6	45.1	0	0	0	0	115.2	N881	S73-N881 PolarHBondContact O-ND2 3.05Å; S73-N881 PolarHBondContact O-OD1 2.88Å; S73-N881 VanDerWaalsContact O-OD1 3.07Å; S73-N881 PolarHBondContact OG-ND2 3.13Å
74	R	26.8	Very low	27.1	Very low	153 Å²	153	142.7 Å²	142.7	58%	0.577	72%	0.719	S	S	*	*	S	Bend	trans	-154.6	125.6	159.8	-110.1	163.4	-152.3	-162.8	0.7	113.4	T879 N880 N881	R74-T879 PolarHBondContact NH2-O 3.32Å; R74-N880 HydrophobicContact CG-CB 4.06Å; R74-N880 VanDerWaalsContact CG-O 3.24Å; R74-N880 WeakPolarHBondContact CG-O 3.31Å; R74-N881 PolarHBondContact NE-OD1 3.09Å; R74-N881 PolarHBondContact NH2-OD1 3.16Å
75	L	25.5	Very low	27	Very low	138 Å²	138	147.4 Å²	147.4	72%	0.723	73%	0.727	S	S	*	*			trans	27.7	107.1	151.8	-57.5	171.2	0	0	0	119.9	N880	L75-N880 HydrophobicContact CD1-CB 4.45Å
76	R	27.5	Very low	27.1	Very low	194 Å²	194	144.5 Å²	144.5	73%	0.732	73%	0.731	S	S	*	*			trans	-155	104.2	132.7	-154	161	-173.7	144.9	0.4	113.1
77	S	26.2	Very low	27	Very low	120 Å²	120	146.8 Å²	146.8	84%	0.839	73%	0.729	S	S	*	*			trans	-66.2	134.4	155.7	34.3	0	0	0	0	108.9
78	R	28.8	Very low	27	Very low	154 Å²	154	143 Å²	143	58%	0.581	72%	0.721	S	S	*	*			trans	-150.2	83.7	178.1	-135.3	172.9	-174.9	-163	-15.2	113.3	E80	R78-E80 HydrophobicContact CG-CG 4.14Å; R78-E80 IonicContact CZ-OE1 2.61Å; R78-E80 IonicContact CZ-OE2 3.03Å; R78-E80 IonicContact NE-OE1 3.22Å; R78-E80 PolarHBondContact NE-OE1 3.15Å; R78-E80 IonicContact NE-OE2 2.76Å; R78-E80 PolarHBondContact NE-OE2 3.3Å; R78-E80 IonicContact NH2-OE1 2.68Å; R78-E80 PolarHBondContact NH2-OE1 3.34Å; R78-E80 IonicContact NH2-OE2 3.11Å; R78-E80 PolarHBondContact NH2-OE2 3.29Å
79	S	24.7	Very low	27	Very low	123 Å²	123	142.1 Å²	142.1	86%	0.86	72%	0.724	S	S	*	*			trans	-81.9	101.4	153.7	50.8	0	0	0	0	108.2
80	E	30.7	Very low	26.9	Very low	133 Å²	133	146.7 Å²	146.7	62%	0.621	74%	0.741	S	S	*	*			trans	-131	101.1	171.4	-82.9	177	-152.9	0	0	109.3	R78	R78-E80 HydrophobicContact CG-CG 4.14Å; R78-E80 IonicContact CZ-OE1 2.61Å; R78-E80 IonicContact CZ-OE2 3.03Å; R78-E80 IonicContact NE-OE1 3.22Å; R78-E80 PolarHBondContact NE-OE1 3.15Å; R78-E80 IonicContact NE-OE2 2.76Å; R78-E80 PolarHBondContact NE-OE2 3.3Å; R78-E80 IonicContact NH2-OE1 2.68Å; R78-E80 PolarHBondContact NH2-OE1 3.34Å; R78-E80 IonicContact NH2-OE2 3.11Å; R78-E80 PolarHBondContact NH2-OE2 3.29Å
81	E	26.2	Very low	27	Very low	188 Å²	188	146.8 Å²	146.8	88%	0.879	75%	0.748	S	S	*	*			trans	-70.8	145.6	163.9	-56.3	170	117.7	0	0	109.6
82	K	31.5	Very low	27.2	Very low	210 Å²	210	145.7 Å²	145.7	91%	0.913	74%	0.744	S	S	*	*			trans	-163.8	140.7	137.9	-109.6	151.5	-170.3	176.3	0	113.6
83	N	25.8	Very low	27.4	Very low	151 Å²	151	145 Å²	145	81%	0.807	74%	0.744	S	S	*	*			trans	-75.6	145.8	-173.1	-57.9	-63.6	0	0	0	113.6
84	C	29.2	Very low	27.3	Very low	124 Å²	124	151.4 Å²	151.4	84%	0.838	77%	0.768	S	S	*	*				-163.3	111.5	127.6	-102.2	0	0	0	0	107.3
85	K	24	Very low	27.3	Very low	195 Å²	195	149.2 Å²	149.2	85%	0.848	78%	0.776	S	S	*	*				71.1	85.5	71.2	-77.5	-159.8	173.8	-170	0	115
86	S	28.2	Very low	27.3	Very low	104 Å²	104	148.4 Å²	148.4	73%	0.727	78%	0.777	S	S	*	*			trans	168.5	104.5	136.9	55.3	0	0	0	0	106.8
87	E	27	Very low	27.2	Very low	168 Å²	168	145.2 Å²	145.2	79%	0.785	77%	0.773	S	S	*	*				118	119.8	68.6	-98.5	176.7	-163.7	0	0	107.7
88	H	27	Very low	27	Very low	165 Å²	165	145.6 Å²	145.6	76%	0.764	77%	0.766	S	S	*	*			trans	41	148.4	152.7	-55	-67.4	0	0	0	122.1
89	S	27	Very low	27	Very low	103 Å²	103	148 Å²	148	72%	0.72	78%	0.776	S	S	*	*			cis	-147.5	151.3	23	50.2	0	0	0	0	115.1
90	F	24.5	Very low	27	Very low	170 Å²	170	148.2 Å²	148.2	75%	0.746	77%	0.767	S	S	*	*			trans	20.6	119.6	149.5	-69.3	-97.4	0	0	0	121.6
91	H	30.5	Very low	26.8	Very low	191 Å²	191	151.9 Å²	151.9	88%	0.884	78%	0.781	S	S	*	*				-163.8	117.9	108.1	-115.7	-74.6	0	0	0	113
92	P	28.5	Very low	26.8	Very low	103 Å²	103	148.1 Å²	148.1	67%	0.669	77%	0.766	S	S	*	*			trans	-119.7	135.8	172	36.7	-25.4	0	0	0	114.1
93	S	29.4	Very low	26.7	Very low	111 Å²	111	145.3 Å²	145.3	78%	0.776	76%	0.761	S	S	*	*			trans	-154.7	125.4	157	46.7	0	0	0	0	109
94	H	25.3	Very low	26.7	Very low	181 Å²	181	145.4 Å²	145.4	84%	0.838	75%	0.754	S	S	*	*				75.3	141.9	56.6	-100.9	-103.4	0	0	0	115.9
95	S	26.6	Very low	26.6	Very low	108 Å²	108	147.3 Å²	147.3	76%	0.755	76%	0.755	S	S	*	*			trans	85.1	147	155.8	97.4	0	0	0	0	117.2
96	V	24.8	Very low	26.7	Very low	120 Å²	120	142 Å²	142	73%	0.727	74%	0.743	S	S	*	*			cis	-171	150.4	-19.9	105.8	0	0	0	0	112.3
97	I	24.5	Very low	26.6	Very low	127 Å²	127	143.3 Å²	143.3	65%	0.651	74%	0.742	S	S	*	*			trans	58.7	133.5	148.5	-72.2	175.9	0	0	0	122.3
98	N	24	Very low	26.4	Very low	129 Å²	129	144 Å²	144	69%	0.69	74%	0.742	S	S	*	*			trans	34	142.7	142	-51.6	-10.9	0	0	0	120.3
99	Y	27.1	Very low	26.3	Very low	203 Å²	203	144.6 Å²	144.6	80%	0.796	75%	0.747	S	S	*	*				-156.4	145.8	69.6	-108.9	-94.2	0	0	0	116.6
100	L	24.3	Very low	26.2	Very low	128 Å²	128	144.8 Å²	144.8	67%	0.67	75%	0.748	S	S	*	*			trans	-25.7	138.2	162.8	-65.4	151.2	0	0	0	116.9	L102	L100-L102 HydrophobicContact CD2-CD1 4.02Å
101	K	28.5	Very low	26.4	Very low	211 Å²	211	142.7 Å²	142.7	92%	0.917	75%	0.751	S	S	*	*				-146.1	125.4	106.9	-121.6	177	-176.2	-177.8	0	113.2
102	L	24.5	Very low	26.1	Very low	109 Å²	109	137 Å²	137	57%	0.571	74%	0.744	S	S	*	*			trans	-80.7	143.3	162.9	-70.7	140.7	0	0	0	108.4	L100 K104	L100-L102 HydrophobicContact CD2-CD1 4.02Å; L102-K104 HydrophobicContact CB-CG 4.34Å; L102-K104 HydrophobicContact CD2-CG 4.4Å
103	D	31.1	Very low	26	Very low	150 Å²	150	138 Å²	138	80%	0.802	75%	0.752	S	S	*	*				-151.6	122.1	111.2	-85.4	-41.5	0	0	0	106.7
104	K	25.5	Very low	25.9	Very low	153 Å²	153	139.1 Å²	139.1	67%	0.665	75%	0.754	S	S	*	*				82.1	141.9	52.4	-77.9	-175	172	-179	0	113.4	L102	L102-K104 HydrophobicContact CB-CG 4.34Å; L102-K104 HydrophobicContact CD2-CG 4.4Å
105	L	27.4	Very low	26.3	Very low	164 Å²	164	135.6 Å²	135.6	86%	0.859	75%	0.747	S	S	*	*			trans	71.6	137.3	176.1	-54.1	174.6	0	0	0	116.4
106	S	25	Very low	26.2	Very low	83 Å²	83	136 Å²	136	58%	0.58	75%	0.748	S	S	*	*			cis	-175.1	153.5	-29.8	42.2	0	0	0	0	109.7
107	N	25.7	Very low	26.3	Very low	133 Å²	133	134.8 Å²	134.8	71%	0.711	75%	0.745	S	S	*	*			trans	58.1	115.7	148.4	-64.5	-22.1	0	0	0	118.5
108	K	24.2	Very low	26.5	Very low	183 Å²	183	133.6 Å²	133.6	80%	0.796	75%	0.748	S	S	*	*				71.2	138	79.8	-75.8	-178.3	172.1	-178.1	0	114
109	M	24.3	Very low	27	Very low	177 Å²	177	131.9 Å²	131.9	87%	0.872	75%	0.746	S	S	*	*			trans	70.7	149.5	172.1	-61.4	162.8	79.2	0	0	113.8
110	C	25.1	Very low	27.2	Very low	107 Å²	107	128.8 Å²	128.8	72%	0.723	74%	0.744	S	S	*	*			cis	-150	173.9	-6.8	-117.6	0	0	0	0	109.9
111	P	28.9	Very low	27.6	Very low	126 Å²	126	128.1 Å²	128.1	82%	0.818	74%	0.741	S	S	*	*			trans	-90.2	152.8	177.1	35.8	-33.3	0	0	0	113.6
112	G	24.5	Very low	27.9	Very low	71 Å²	71	124.8 Å²	124.8	73%	0.732	73%	0.726	S	S	*	*			trans	123.2	155.7	161.6	0	0	0	0	0	116.8
113	C	25.9	Very low	28.1	Very low	125 Å²	125	125.7 Å²	125.7	85%	0.845	73%	0.731	S	S	*	*			trans	63.5	126.5	171	-55	0	0	0	0	117.6
114	V	26.4	Very low	28	Very low	133 Å²	133	129.2 Å²	129.2	81%	0.806	73%	0.733	S	S	*	*			cis	81.8	127.2	26.5	-176.4	0	0	0	0	113.3
115	P	34.3	Very low	28	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	74%	0.742	S	S	*	*			cis	-136.7	-140.9	-30.1	38.3	-16.1	0	0	0	111.3
116	C	24.3	Very low	27.9	Very low	117 Å²	117	128.5 Å²	128.5	79%	0.791	74%	0.737	S	S	*	*			trans	71.9	156	161.3	-71.9	0	0	0	0	119.2
117	S	26.8	Very low	27.9	Very low	94 Å²	94	129.7 Å²	129.7	66%	0.657	74%	0.74	S	S	*	*			cis	-170.7	167.8	-24.1	54.4	0	0	0	0	110.9
118	S	29.2	Very low	27.8	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	75%	0.747	S	S	*	*			trans	62.6	157.3	158.3	50.9	0	0	0	0	117.4
119	S	33.5	Very low	27.9	Very low	92 Å²	92	129.9 Å²	129.9	64%	0.643	74%	0.743	S	S	*	*			cis	-137.8	136.3	4.6	-27	0	0	0	0	108.2
120	D	31	Very low	27.9	Very low	139 Å²	139	129.9 Å²	129.9	74%	0.743	74%	0.741	S	S	*	*				71.1	143.1	94.7	-59.6	-34.3	0	0	0	113.3
121	D	34.7	Very low	28.1	Very low	113 Å²	113	133.5 Å²	133.5	60%	0.604	75%	0.747	S	S	*	*			cis	-166.1	169.5	30.2	-126.7	3.3	0	0	0	110
122	K	33.5	Very low	27.9	Very low	142 Å²	142	135.8 Å²	135.8	62%	0.617	74%	0.744	S	S	*	*			cis	-169.5	162.2	-11.5	-146.1	177	-147.7	76.7	0	110.4
123	L	29.8	Very low	28.2	Very low	128 Å²	128	139.1 Å²	139.1	67%	0.67	75%	0.746	S	S	*	*			trans	69.1	149.7	157.9	-51	179.1	0	0	0	119.1
124	R	28.1	Very low	28.2	Very low	223 Å²	223	139.6 Å²	139.6	84%	0.842	74%	0.74	S	S	*	*			cis	-150.6	-177.4	-9.2	-129	170.3	-174.7	167.5	3.4	114.3
125	F	24.6	Very low	28.3	Very low	195 Å²	195	139 Å²	139	86%	0.855	73%	0.731	S	S	*	*			trans	-101.3	-169.4	-163.6	-100	-107.6	0	0	0	115.3
126	S	26.6	Very low	27.9	Very low	107 Å²	107	141.7 Å²	141.7	75%	0.748	73%	0.732	S	S	*	*			trans	81	126.9	174.6	62.6	0	0	0	0	116.2
127	V	23.8	Very low	28	Very low	109 Å²	109	141.9 Å²	141.9	66%	0.661	73%	0.729	S	S	*	*			cis	84.9	133	18.1	-167.5	0	0	0	0	114.7
128	Y	25.4	Very low	28	Very low	219 Å²	219	143 Å²	143	86%	0.859	73%	0.732	S	S	*	*			trans	70.5	150.4	-170.7	-56.4	-73.5	0	0	0	114.2
129	S	24.4	Very low	28.4	Very low	101 Å²	101	143.6 Å²	143.6	71%	0.706	73%	0.734	S	S	*	*			cis	-156.7	-174.7	-18.6	-121	0	0	0	0	110.9
130	E	24.9	Very low	28.1	Very low	176 Å²	176	148 Å²	148	82%	0.822	74%	0.742	S	S	*	*			trans	-64.6	138.3	172.5	-57.8	159.3	118.3	0	0	113.5
131	E	29	Very low	27.9	Very low	184 Å²	184	146.6 Å²	146.6	86%	0.86	73%	0.734	S	S	*	*			trans	175.1	122.2	136	-95.1	165.7	-176.8	0	0	106.2
132	K	25.6	Very low	27.4	Very low	173 Å²	173	149 Å²	149	75%	0.752	74%	0.739	S	S	*	*				72	145.7	68.5	-98.9	-168	178.1	-176.4	0	115
133	D	29.7	Very low	27.1	Very low	142 Å²	142	148.5 Å²	148.5	76%	0.759	74%	0.739	S	S	*	*			trans	64.6	150.8	166.1	-55.7	-0.8	0	0	0	117.6
134	D	26.7	Very low	27	Very low	135 Å²	135	150 Å²	150	72%	0.722	74%	0.742	S	S	*	*			cis	-161.5	168.9	-40.9	-155.6	-7.4	0	0	0	108.4
135	L	27.6	Very low	26.9	Very low	121 Å²	121	142.3 Å²	142.3	63%	0.634	73%	0.732	S	S	*	*			trans	62.9	161.7	164.1	-88.4	69.5	0	0	0	117.6
136	K	26.6	Very low	27.1	Very low	162 Å²	162	138.8 Å²	138.8	70%	0.704	72%	0.722	S	S	*	*			cis	-170.9	158.5	-34.4	-118.7	-177.7	-152.4	157.1	0	108.8
137	V	26.4	Very low	27.2	Very low	121 Å²	121	141.8 Å²	141.8	73%	0.733	72%	0.722	S	S	*	*			trans	64.4	138	141.3	167.4	0	0	0	0	118.7
138	T	26.3	Very low	27.4	Very low	117 Å²	117	142.3 Å²	142.3	72%	0.718	72%	0.72	S	S	*	*			cis	-159.5	161.3	-17.2	27.3	0	0	0	0	108.6
139	P	38.8	Very low	27.7	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	72%	0.717	S	S	*	*			trans	-77.5	169.8	172.2	35.4	-38	0	0	0	113.2
140	K	26.7	Very low	27.8	Very low	186 Å²	186	145.6 Å²	145.6	81%	0.809	72%	0.72	S	S	*	*			trans	145.8	156.9	166.2	-87.8	-177.2	169.6	-168.4	0	108.5
141	D	26	Very low	28.1	Very low	109 Å²	109	145.9 Å²	145.9	58%	0.583	72%	0.719	S	S	*	*			cis	-160.3	157	-12.5	-114.5	-27.6	0	0	0	108.4
142	F	25.1	Very low	28	Very low	164 Å²	164	143.9 Å²	143.9	72%	0.719	71%	0.71	S	S	*	*			trans	64	174.2	151.6	-80.1	-132.1	0	0	0	117.9
143	Q	26.3	Very low	28.2	Very low	130 Å²	130	141.3 Å²	141.3	61%	0.607	70%	0.704	S	S	*	*			cis	-169.2	166.2	-42.2	-168.7	179.7	62.4	0	0	107.9
144	H	28.2	Very low	28.1	Very low	161 Å²	161	142.5 Å²	142.5	75%	0.745	71%	0.705	S	S	*	*			trans	68.6	149.5	177.3	-59.7	82.8	0	0	0	116.3
145	G	26.8	Very low	28.2	Very low	60 Å²	60	140.7 Å²	140.7	62%	0.619	70%	0.703	S	S	*	*			cis	145.9	156	-11.4	0	0	0	0	0	113.6
146	N	27.8	Very low	28.1	Very low	122 Å²	122	144.6 Å²	144.6	65%	0.652	72%	0.715	S	S	*	*			trans	70.7	154.7	173.7	-58.1	-68.9	0	0	0	114.9
147	K	28.3	Very low	28.3	Very low	169 Å²	169	146.1 Å²	146.1	74%	0.735	72%	0.722	S	S	*	*			cis	-170.1	-172.8	-5.4	-113.6	169.9	-174.4	126.8	0	107.5
148	L	29.1	Very low	28.3	Very low	121 Å²	121	144.9 Å²	144.9	63%	0.634	72%	0.719	S	S	*	*			cis	-159.4	142.7	4.9	-104.6	137.2	0	0	0	109.1
149	K	32	Very low	28.4	Very low	182 Å²	182	144.2 Å²	144.2	79%	0.791	72%	0.719	S	S	*	*			trans	68.7	160.8	146.2	-68.3	168.4	176	167.7	0	122.8
150	R	26.4	Very low	27.7	Very low	206 Å²	206	143.7 Å²	143.7	78%	0.777	72%	0.718	S	S	*	*			cis	-177.2	167.9	-37.6	-149.4	170.4	177.1	152.7	3.5	111.7
151	K	31.4	Very low	27.6	Very low	183 Å²	183	140.3 Å²	140.3	80%	0.796	72%	0.718	S	S	*	*			trans	86.6	130.9	171	-56.8	-174	176.1	-173.7	0	114.7
152	E	26.7	Very low	27.6	Very low	141 Å²	141	141.3 Å²	141.3	66%	0.659	73%	0.728	S	S	*	*			cis	78.4	135.3	27.6	-52.8	162.4	143.5	0	0	112.4
153	N	28.8	Very low	27.4	Very low	119 Å²	119	138.4 Å²	138.4	64%	0.636	73%	0.727	S	S	*	*			cis	-161.6	154.9	25.4	-118.6	-27	0	0	0	113.1
154	Q	27.9	Very low	27.4	Very low	168 Å²	168	142.2 Å²	142.2	79%	0.785	74%	0.737	S	S	*	*			trans	60.7	158.3	141.5	-69.3	168.6	23.5	0	0	120.7
155	S	29.3	Very low	27.2	Very low	97 Å²	97	139 Å²	139	68%	0.678	73%	0.732	S	S	*	*			cis	-164.7	143.3	-6.7	44.2	0	0	0	0	114.5
156	F	25.8	Very low	27.1	Very low	203 Å²	203	142.8 Å²	142.8	89%	0.89	74%	0.739	S	S	*	*			trans	44.5	153.4	141.2	-90.2	-84.9	0	0	0	126.6
157	K	30.6	Very low	27	Very low	193 Å²	193	144.3 Å²	144.3	84%	0.839	75%	0.746	S	S	*	*			trans	78.6	151.7	166.8	-66.7	-176.9	-178.7	-178.5	0	117.9
158	S	26.8	Very low	27	Very low	96 Å²	96	142.2 Å²	142.2	67%	0.671	75%	0.753	S	S	*	*			cis	-179.4	161.1	-43.8	47.2	0	0	0	0	110.3
159	S	28.1	Very low	26.8	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	76%	0.764	S	S	*	*			trans	89.4	100.4	156.3	-48.3	0	0	0	0	121.3
160	S	23.5	Very low	26.7	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	76%	0.763	S	S	*	*				56	147.6	124.3	62.7	0	0	0	0	125.2
161	S	25.8	Very low	26.7	Very low	114 Å²	114	137 Å²	137	80%	0.797	76%	0.763	S	S	*	*			trans	81.4	150.8	152.8	79	0	0	0	0	118.8
162	V	24.6	Very low	26.9	Very low	131 Å²	131	134 Å²	134	79%	0.794	76%	0.762	S	S	*	*			cis	-168.1	168.7	-38.1	113.2	0	0	0	0	109.8
163	C	22.3	Very low	27.1	Very low	103 Å²	103	133.3 Å²	133.3	70%	0.696	77%	0.77	S	S	*	*			trans	82.2	135.9	168.2	-77	0	0	0	0	121.6
164	Y	24.4	Very low	26.9	Very low	210 Å²	210	132.1 Å²	132.1	82%	0.824	78%	0.776	S	S	*	*			trans	6.5	156.3	142.9	-57.9	-88.8	0	0	0	121.6
165	S	24.7	Very low	26.8	Very low	93 Å²	93	132.3 Å²	132.3	65%	0.65	78%	0.78	S	S	*	*			cis	-149.3	169.2	18.2	-31.8	0	0	0	0	114.9
166	D	24.4	Very low	26.6	Very low	140 Å²	140	132.8 Å²	132.8	75%	0.749	79%	0.789	S	S	*	*			trans	60.8	133.8	142.3	-49.2	-25.1	0	0	0	124.7
167	D	26	Very low	26.4	Very low	153 Å²	153	130.4 Å²	130.4	82%	0.818	79%	0.785	S	S	*	*			trans	40.3	106.6	146.5	-65.3	-9.8	0	0	0	122.6
168	S	27.9	Very low	26.2	Very low	125 Å²	125	128.3 Å²	128.3	87%	0.874	78%	0.781	S	S	*	*				-177.1	159.5	117.8	37.1	0	0	0	0	113.5
169	D	25.8	Very low	26	Very low	163 Å²	163	130.9 Å²	130.9	87%	0.872	79%	0.787	S	S	*	*			trans	-66	133.8	176.3	-76.9	-75.7	0	0	0	113.4
170	S	28.6	Very low	25.9	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	79%	0.787	S	S	*	*				168	143.1	112.8	51.5	0	0	0	0	116.8
171	V	28.4	Very low	26	Very low	128 Å²	128	134.5 Å²	134.5	78%	0.776	80%	0.795	S	S	*	*			trans	38.8	119.2	147.4	-174.3	0	0	0	0	120.4
172	P	35.3	Very low	25.9	Very low	120 Å²	120	139.5 Å²	139.5	78%	0.779	80%	0.796	S	S	*	*			trans	-86.3	143.5	177.3	34.7	-35	0	0	0	114.6
173	P	30.5	Very low	25.9	Very low	126 Å²	126	139.5 Å²	139.5	82%	0.818	79%	0.791	S	S	*	*			trans	-96	160.4	160	2.4	18.2	0	0	0	112.6
174	A	25.1	Very low	26.2	Very low	93 Å²	93	141.9 Å²	141.9	77%	0.769	79%	0.792	S	S	*	*			trans	-95.9	-179.5	166.8	0	0	0	0	0	111.2
175	M	24.1	Very low	26.2	Very low	173 Å²	173	137.8 Å²	137.8	85%	0.852	79%	0.788	S	S	*	*			trans	90.4	92.1	175.3	-59.8	-69.7	-73	0	0	117.1
176	A	25.1	Very low	26.4	Very low	106 Å²	106	141.8 Å²	141.8	88%	0.876	80%	0.797	S	S	*	*			trans	-147.6	73.3	149.9	0	0	0	0	0	110.1
177	L	23.4	Very low	26.4	Very low	153 Å²	153	139.3 Å²	139.3	80%	0.801	80%	0.796	S	S	*	*			trans	-82	122.4	157.7	-85.3	169.1	0	0	0	107.7
178	I	24.6	Very low	26.6	Very low	149 Å²	149	140 Å²	140	76%	0.764	80%	0.799	S	S	*	*			trans	179.6	121.2	151.2	-98.7	151	0	0	0	108.9
179	N	23.6	Very low	26.5	Very low	150 Å²	150	139.9 Å²	139.9	80%	0.802	78%	0.784	S	S	*	*			trans	52.3	157.5	154.2	-55.6	-17.8	0	0	0	118.8
180	V	25	Very low	26.5	Very low	119 Å²	119	137.9 Å²	137.9	72%	0.721	78%	0.78	S	S	*	*			cis	-137.8	138	22.7	170.8	0	0	0	0	110.6	R182	V180-R182 HydrophobicContact CG1-CB 4.43Å; V180-R182 PolarHBondContact O-N 3.41Å
181	N	25.9	Very low	26.4	Very low	166 Å²	166	139.5 Å²	139.5	89%	0.888	78%	0.775	S	S	*	*			trans	-68.3	109.5	160.8	-83.1	-34.7	0	0	0	110.1
182	R	24.1	Very low	26.4	Very low	218 Å²	218	138.3 Å²	138.3	82%	0.823	77%	0.772	S	S	*	*			trans	-162.9	129	156.6	-112.5	163.6	-173.7	-171.3	-0.2	112.3	V180	V180-R182 HydrophobicContact CG1-CB 4.43Å; V180-R182 PolarHBondContact O-N 3.41Å
183	L	24.2	Very low	26.1	Very low	132 Å²	132	138.8 Å²	138.8	69%	0.691	77%	0.768	S	S	*	*			trans	26	130.7	136.8	-48.3	172.9	0	0	0	117.5
184	H	28.5	Very low	26	Very low	153 Å²	153	138.5 Å²	138.5	71%	0.708	76%	0.76	S	S	*	*			cis	-137.4	140.5	37	-104.5	-89.4	0	0	0	115.5
185	T	25.1	Very low	26.2	Very low	123 Å²	123	143.1 Å²	143.1	76%	0.755	76%	0.762	S	S	*	*			trans	-85.5	126.7	150.4	46.3	0	0	0	0	109.9
186	Q	28.2	Very low	26.4	Very low	178 Å²	178	142.5 Å²	142.5	83%	0.832	76%	0.762	S	S	*	*			trans	-138.3	100.2	154.9	-75.5	-178.9	-31.7	0	0	105.2
187	A	25.2	Very low	26.6	Very low	88 Å²	88	146.7 Å²	146.7	73%	0.727	76%	0.755	S	S	*	*			cis	86.5	68.1	48.9	0	0	0	0	0	113.6
188	L	29	Very low	26.8	Very low	167 Å²	167	145.3 Å²	145.3	87%	0.874	75%	0.748	S	S	*	*			trans	-145.3	131.9	164.6	-68	173.9	0	0	0	108
189	H	27	Very low	27	Very low	123 Å²	123	145.4 Å²	145.4	57%	0.569	75%	0.748	S	S	*	*			cis	-147.4	122.2	-24.9	-160.7	-86.9	0	0	0	106.8	E191	H189-E191 VanDerWaalsContact C-N 3.28Å; H189-E191 IonicContact CE1-OE2 2.89Å; H189-E191 PolarHBondContact CE1-OE2 3.16Å; H189-E191 VanDerWaalsContact CE1-OE2 3.22Å; H189-E191 IonicContact ND1-OE2 3.83Å; H189-E191 PolarHBondContact O-N 3.41Å
190	P	24.9	Very low	27.2	Very low	120 Å²	120	143.6 Å²	143.6	78%	0.779	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	37.4	-160.4	34.4	-37.9	0	0	0	115.7
191	E	26.6	Very low	27.3	Very low	145 Å²	145	143.5 Å²	143.5	68%	0.678	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	-15.5	-171.2	-69.1	-167.6	117.1	0	0	116.6	H189	H189-E191 VanDerWaalsContact C-N 3.28Å; H189-E191 IonicContact CE1-OE2 2.89Å; H189-E191 PolarHBondContact CE1-OE2 3.16Å; H189-E191 VanDerWaalsContact CE1-OE2 3.22Å; H189-E191 IonicContact ND1-OE2 3.83Å; H189-E191 PolarHBondContact O-N 3.41Å
192	S	28.7	Very low	27.4	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	73%	0.732	S	S	*	*	S	Bend	trans	-82	-15.4	172.7	56.5	0	0	0	0	113.6
193	L	29	Very low	27.7	Very low	130 Å²	130	137.8 Å²	137.8	68%	0.681	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-0.4	-168.4	-98.5	162.7	0	0	0	115.8
194	N	28.9	Very low	28	Very low	121 Å²	121	138.9 Å²	138.9	65%	0.647	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.3	16.9	-176.1	-151	20.4	0	0	0	115.2
195	K	29.1	Very low	27.9	Very low	189 Å²	189	138.5 Å²	138.5	82%	0.822	73%	0.729	S	S	*	*	S	Bend	trans	-108.4	-17.3	174.7	-89.3	-179.1	173.4	175	0	115.9
196	N	29.2	Very low	28	Very low	160 Å²	160	140.4 Å²	140.4	86%	0.856	73%	0.729	S	S	*	*	S	Bend	trans	-112.2	28.1	179.8	-75.4	-18	0	0	0	113.9
197	R	28.5	Very low	28.1	Very low	194 Å²	194	136.2 Å²	136.2	73%	0.732	71%	0.712	S	S	*	*	S	Bend	trans	-126.9	12.5	-176.8	-136.4	171.3	-173.2	151.8	2.2	115.6
198	I	27.5	Very low	28.3	Very low	124 Å²	124	141.6 Å²	141.6	64%	0.636	72%	0.719	S	S	*	*	S	Bend	trans	-113.9	-8.2	179.5	-69.2	175.5	0	0	0	112.3
199	I	28	Very low	28.1	Very low	152 Å²	152	140.2 Å²	140.2	78%	0.779	71%	0.713	S	S	*	*	S	Bend	trans	-120	97.5	176.3	-54.6	178	0	0	0	110
200	V	28	Very low	28.1	Very low	111 Å²	111	141.7 Å²	141.7	67%	0.673	73%	0.725	S	S	*	*	S	Bend	trans	174.7	-30.2	150.3	144.5	0	0	0	0	109	N202 K203	V200-N202 PolarHBondContact O-N 2.89Å; V200-K203 PolarHBondContact O-N 3.49Å
201	T	27.2	Very low	28.5	Very low	117 Å²	117	144.6 Å²	144.6	72%	0.718	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	0.2	169.7	22.8	0	0	0	0	115.1
202	N	28.9	Very low	28.5	Very low	127 Å²	127	144.7 Å²	144.7	68%	0.679	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	5.1	171.9	-91.2	-19.7	0	0	0	114.5	V200 I204	V200-N202 PolarHBondContact O-N 2.89Å; N202-I204 VanDerWaalsContact C-N 3.27Å; N202-I204 PolarHBondContact O-N 3.22Å
203	K	29.6	Very low	28.3	Very low	137 Å²	137	145.6 Å²	145.6	60%	0.596	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	27.1	173.8	-111.1	-175.4	-173.6	-80.2	0	113.9	V200 D207	V200-K203 PolarHBondContact O-N 3.49Å; K203-D207 WeakPolarHBondContact CG-OD2 3.48Å; K203-D207 IonicContact NZ-OD1 3.93Å; K203-D207 PolarHBondContact NZ-OD1 3.49Å; K203-D207 IonicContact NZ-OD2 2.72Å; K203-D207 PolarHBondContact NZ-OD2 2.9Å
204	I	30.7	Very low	28.2	Very low	155 Å²	155	147.4 Å²	147.4	80%	0.795	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-1.5	173	-71.7	174.6	0	0	0	111.2	N202	N202-I204 VanDerWaalsContact C-N 3.27Å; N202-I204 PolarHBondContact O-N 3.22Å
205	L	27.1	Very low	28.2	Very low	145 Å²	145	147.1 Å²	147.1	76%	0.759	74%	0.739	S	S	*	*	S	Bend	trans	-140.2	7.2	-165.8	-100.9	166.9	0	0	0	117.5
206	H	27.6	Very low	28.1	Very low	164 Å²	164	141.1 Å²	141.1	76%	0.759	73%	0.732	S	S	*	*	S	Bend	trans	-152.4	13.3	-178.7	-143.2	-71.7	0	0	0	118.3
207	D	28.9	Very low	28.1	Very low	90 Å²	90	138.9 Å²	138.9	48%	0.481	73%	0.728	S	S	.	*	S	Bend	trans	-102.7	134.7	166.5	-62.9	-50.4	0	0	0	109.3	K203	K203-D207 WeakPolarHBondContact CG-OD2 3.48Å; K203-D207 IonicContact NZ-OD1 3.93Å; K203-D207 PolarHBondContact NZ-OD1 3.49Å; K203-D207 IonicContact NZ-OD2 2.72Å; K203-D207 PolarHBondContact NZ-OD2 2.9Å
208	F	29.9	Very low	28.3	Very low	200 Å²	200	138.3 Å²	138.3	88%	0.877	73%	0.731	S	S	*	*			trans	65.1	43	177.1	-55.8	-75.2	0	0	0	117.6
209	N	25.8	Very low	28.2	Very low	139 Å²	139	140 Å²	140	74%	0.743	74%	0.74	S	S	*	*				-80.2	141.4	123.9	-82.4	-41.1	0	0	0	107.4
210	N	27	Very low	28	Very low	154 Å²	154	136.5 Å²	136.5	82%	0.824	73%	0.73	S	S	*	*			trans	104.3	62.7	178.5	-56.4	-11.2	0	0	0	117.5
211	E	31.7	Very low	27.9	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	74%	0.737	S	S	*	*			trans	-153.3	112.8	134.3	-104.5	169.3	-163.7	0	0	104.5
212	L	27.3	Very low	27.8	Very low	147 Å²	147	140.6 Å²	140.6	77%	0.77	74%	0.739	S	S	*	*				64.1	121	75.2	-62.8	168.3	0	0	0	111.5
213	D	24.9	Very low	27.5	Very low	121 Å²	121	143.9 Å²	143.9	65%	0.647	75%	0.748	S	S	*	*			cis	-162.8	176	2	-146.6	-13.9	0	0	0	114.3
214	F	27.1	Very low	27.2	Very low	167 Å²	167	144.1 Å²	144.1	73%	0.732	76%	0.755	S	S	*	*			trans	56.5	98.3	160.9	-82.9	-83.6	0	0	0	122.5
215	S	28	Very low	26.8	Very low	115 Å²	115	143.5 Å²	143.5	80%	0.804	75%	0.753	S	S	*	*				70	144.7	122.9	76.3	0	0	0	0	122.2
216	G	27.2	Very low	26.7	Very low	64 Å²	64	143 Å²	143	66%	0.66	76%	0.757	S	S	*	*			cis	168.8	171.5	-11.4	0	0	0	0	0	117.2
217	S	29.3	Very low	26.7	Very low	112 Å²	112	140.6 Å²	140.6	78%	0.783	76%	0.758	S	S	*	*			trans	84.4	136.9	163.7	87.1	0	0	0	0	120.2
218	K	32.1	Very low	26.4	Very low	182 Å²	182	147.8 Å²	147.8	79%	0.791	78%	0.779	S	S	*	*			trans	71.3	97.7	163.4	-54.9	-171.3	-178.8	177.9	0	116.3
219	L	26.6	Very low	26.2	Very low	159 Å²	159	148.3 Å²	148.3	83%	0.832	78%	0.78	S	S	*	*				73.7	140.7	65.6	-65.8	168.5	0	0	0	113.2
220	S	24.2	Very low	26.3	Very low	80 Å²	80	147.4 Å²	147.4	56%	0.559	79%	0.785	S	S	*	*			cis	-177.6	147	-18.2	54	0	0	0	0	112.3
221	K	23.9	Very low	26.1	Very low	187 Å²	187	148 Å²	148	81%	0.813	79%	0.788	S	S	*	*			trans	63.9	165.6	151.7	-67.3	168.5	177.6	178.9	0	117.9
222	T	26	Very low	25.9	Very low	126 Å²	126	144.9 Å²	144.9	77%	0.773	78%	0.783	S	S	*	*			trans	74.9	138.5	165	78.9	0	0	0	0	116.4
223	F	23.2	Very low	25.8	Very low	196 Å²	196	142 Å²	142	86%	0.86	78%	0.78	S	S	*	*			cis	-150.9	172.2	-19.3	-138.9	-97.8	0	0	0	110.2
224	L	23	Very low	25.8	Very low	143 Å²	143	144 Å²	144	75%	0.749	79%	0.789	S	S	*	*			trans	-76.2	157.2	169.8	-82.1	159.7	0	0	0	112.3
225	N	23.1	Very low	25.7	Very low	141 Å²	141	143.3 Å²	143.3	75%	0.754	79%	0.788	S	S	*	*			trans	74.4	155.3	164	-66.4	-33.4	0	0	0	119.5
226	T	23.9	Very low	25.5	Very low	136 Å²	136	143.4 Å²	143.4	83%	0.834	78%	0.779	S	S	*	*			trans	71.2	144.7	-178.8	80.3	0	0	0	0	114.2
227	S	27.7	Very low	25.5	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	78%	0.777	S	S	*	*			cis	-129.9	147.9	7.3	-73.8	0	0	0	0	113.6
228	R	23.4	Very low	25.3	Very low	241 Å²	241	149.2 Å²	149.2	91%	0.909	77%	0.772	S	S	*	*			trans	-76.9	164.4	155.3	-70.4	178.7	173.5	176.5	-2.3	109.4
229	K	24.4	Very low	25.3	Very low	210 Å²	210	147.3 Å²	147.3	91%	0.913	77%	0.771	S	S	*	*			trans	87.4	102.9	168.3	-52.8	174.2	177.4	-180	0	117
230	S	27.4	Very low	25.2	Very low	121 Å²	121	145.4 Å²	145.4	85%	0.846	76%	0.761	S	S	*	*			trans	-156	67.1	143.5	51.5	0	0	0	0	110.6	P232	S230-P232 WeakPolarHBondContact O-CD 3.38Å
231	L	23.1	Very low	25.4	Very low	167 Å²	167	150.7 Å²	150.7	87%	0.874	78%	0.777	S	S	*	*			trans	-81.8	126.6	166.2	-98.1	165.4	0	0	0	109.5
232	P	27.9	Very low	25.4	Very low	114 Å²	114	148.5 Å²	148.5	74%	0.74	77%	0.772	S	S	*	*			trans	-95.9	106.1	154.1	32.3	-23.9	0	0	0	108.9	S230	S230-P232 WeakPolarHBondContact O-CD 3.38Å
233	A	24.9	Very low	25.6	Very low	87 Å²	87	148.2 Å²	148.2	72%	0.719	78%	0.776	S	S	*	*			trans	-102.6	105.8	172.6	0	0	0	0	0	109.5
234	I	26.3	Very low	25.8	Very low	162 Å²	162	142.5 Å²	142.5	83%	0.831	77%	0.772	S	S	*	*			trans	-146.5	140.7	173.8	-52.2	178.3	0	0	0	107.3
235	H	24.2	Very low	26.1	Very low	153 Å²	153	141.1 Å²	141.1	71%	0.708	77%	0.774	S	S	*	*			cis	174.1	121.7	-30.1	-153	-113.2	0	0	0	103.9
236	L	23.8	Very low	26.4	Very low	117 Å²	117	139.4 Å²	139.4	61%	0.613	77%	0.773	S	S	*	*			trans	62.6	160.8	164.5	-63	177.3	0	0	0	118.4
237	D	27.1	Very low	26.6	Very low	117 Å²	117	135.7 Å²	135.7	63%	0.626	76%	0.762	S	S	*	*			cis	-120.3	144.3	0.7	-91.1	-54.6	0	0	0	110.7
238	R	25.5	Very low	26.7	Very low	181 Å²	181	136.9 Å²	136.9	68%	0.683	77%	0.765	S	S	*	*				56.3	141.6	100	-50.6	178.8	-161.8	-145.9	-4.4	115.3
239	D	30.7	Very low	27	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	76%	0.76	S	S	*	*			cis	-112	152.3	14.8	-57.4	-58.5	0	0	0	111.7
240	L	24.9	Very low	27.1	Very low	120 Å²	120	125.2 Å²	125.2	63%	0.628	75%	0.747	S	S	*	*				62.1	128.7	55	-64	162.9	0	0	0	111.9	I242	L240-I242 HydrophobicContact CD2-CD1 3.46Å; L240-I242 VanDerWaalsContact CD2-CD1 3.46Å; L240-I242 HydrophobicContact CD2-CG1 4.03Å
241	E	28.6	Very low	27.1	Very low	190 Å²	190	127.3 Å²	127.3	89%	0.888	75%	0.748	S	S	*	*			cis	-122.5	148.5	21.6	-57.6	165.5	148.1	0	0	110.8
242	I	25.1	Very low	27.2	Very low	141 Å²	141	123.9 Å²	123.9	72%	0.723	74%	0.738	S	S	*	*			cis	84.3	86.2	48.4	-58.3	-178.3	0	0	0	115.9	L240	L240-I242 HydrophobicContact CD2-CD1 3.46Å; L240-I242 VanDerWaalsContact CD2-CD1 3.46Å; L240-I242 HydrophobicContact CD2-CG1 4.03Å
243	S	29.5	Very low	27	Very low	121 Å²	121	129.5 Å²	129.5	85%	0.846	75%	0.746	S	S	*	*			trans	171.3	137.3	142.3	33.5	0	0	0	0	106.8
244	G	26.8	Very low	27.1	Very low	76 Å²	76	131.4 Å²	131.4	78%	0.784	75%	0.749	S	S	*	*			cis	103.2	117	37	0	0	0	0	0	107.1
245	S	29.8	Very low	26.9	Very low	113 Å²	113	128.2 Å²	128.2	79%	0.79	75%	0.746	S	S	*	*			cis	-153.3	-178.4	21.8	57.7	0	0	0	0	114.7
246	S	28.7	Very low	27	Very low	105 Å²	105	126.5 Å²	126.5	73%	0.734	75%	0.746	S	S	*	*			trans	-16.6	155.1	169.4	52.4	0	0	0	0	121.4
247	G	29.3	Very low	27	Very low	58 Å²	58	128 Å²	128	60%	0.598	75%	0.753	S	S	*	*			cis	-169.4	159	8.7	0	0	0	0	0	113.5
248	T	29.6	Very low	27	Very low	139 Å²	139	128.3 Å²	128.3	85%	0.853	76%	0.759	S	S	*	*				54.2	119.4	99.2	63.6	0	0	0	0	113.4
249	S	29.8	Very low	27	Very low	114 Å²	114	126 Å²	126	80%	0.797	76%	0.76	S	S	*	*				-168.1	176.8	50.3	55.4	0	0	0	0	111.3
250	S	26.8	Very low	26.7	Very low	91 Å²	91	128 Å²	128	64%	0.636	77%	0.765	S	S	*	*			cis	-168.5	148.8	-37	58.8	0	0	0	0	109.8
251	L	25.7	Very low	26.9	Very low	166 Å²	166	129.1 Å²	129.1	87%	0.869	78%	0.777	S	S	*	*			trans	63.2	160.8	150.9	-67.4	167.1	0	0	0	118.2
252	S	25.9	Very low	26.7	Very low	95 Å²	95	128.3 Å²	128.3	66%	0.664	77%	0.773	S	S	*	*			cis	-149.7	158.2	-9.3	34	0	0	0	0	111.9
253	Y	24.6	Very low	26.8	Very low	232 Å²	232	131.7 Å²	131.7	91%	0.91	78%	0.778	S	S	*	*			trans	-52.7	137.9	153.8	-100	-121.9	0	0	0	111.5
254	T	26.6	Very low	26.7	Very low	127 Å²	127	131.6 Å²	131.6	78%	0.779	77%	0.767	S	S	*	*			trans	-138.8	125.8	142.2	37	0	0	0	0	109.3
255	A	22.8	Very low	27.1	Very low	94 Å²	94	133.2 Å²	133.2	78%	0.777	76%	0.764	S	S	*	*			trans	-81.4	137	165.3	0	0	0	0	0	108.5
256	V	25.6	Very low	27.5	Very low	118 Å²	118	134.1 Å²	134.1	72%	0.715	77%	0.767	S	S	*	*			trans	-114	91.8	174.9	-178.5	0	0	0	0	108.2	V258	V256-V258 HydrophobicContact CG1-CB 4.28Å; V256-V258 HydrophobicContact CG1-CG2 3.53Å
257	I	23.3	Very low	27.6	Very low	148 Å²	148	135.1 Å²	135.1	76%	0.759	76%	0.764	S	S	*	*			trans	-79.7	115.1	154.9	-58.6	173.4	0	0	0	105.1
258	V	27.1	Very low	27.5	Very low	124 Å²	124	140.3 Å²	140.3	75%	0.752	77%	0.77	S	S	*	*			trans	-123.7	132	166.7	161.8	0	0	0	0	107.1	V256	V256-V258 HydrophobicContact CG1-CB 4.28Å; V256-V258 HydrophobicContact CG1-CG2 3.53Å
259	N	25.6	Very low	27.5	Very low	131 Å²	131	145 Å²	145	70%	0.701	77%	0.772	S	S	*	*			trans	-83.3	170.2	-167.7	-60.1	-23.2	0	0	0	112.3
260	E	24.1	Very low	27.4	Very low	185 Å²	185	144 Å²	144	86%	0.864	77%	0.766	S	S	*	*			trans	-55.9	140.8	159	-56.7	163.9	141.6	0	0	110.7
261	T	29.1	Very low	27.3	Very low	143 Å²	143	146.5 Å²	146.5	88%	0.877	78%	0.777	S	S	*	*			trans	-169	156.2	148.6	4.4	0	0	0	0	110.9
262	E	24	Very low	27.5	Very low	173 Å²	173	143.5 Å²	143.5	81%	0.808	78%	0.776	S	S	*	*			trans	-99.2	155.3	-170.1	-55.5	158	108.6	0	0	112.6
263	Y	28.7	Very low	27.4	Very low	212 Å²	212	144.1 Å²	144.1	83%	0.831	78%	0.78	S	S	*	*			trans	-167.7	104.4	144.9	-129.3	-102.2	0	0	0	108.6
264	I	27.9	Very low	27.9	Very low	119 Å²	119	137.9 Å²	137.9	61%	0.61	77%	0.768	S	S	*	*				71.2	118.6	79.2	-63.7	169.1	0	0	0	113.2
265	P	33.2	Very low	28.1	Very low	111 Å²	111	138 Å²	138	72%	0.721	76%	0.764	S	S	*	*			trans	-92.4	165	-178.8	38	-36.4	0	0	0	113.9
266	P	39.5	Very low	28.3	Very low	131 Å²	131	142.2 Å²	142.2	85%	0.851	77%	0.767	S	S	*	*			trans	-77.3	155	169.1	33.2	-34.8	0	0	0	112.4
267	D	30.6	Very low	28.5	Very low	127 Å²	127	141.5 Å²	141.5	68%	0.679	77%	0.768	S	S	*	*			trans	-108.9	172.3	-155.1	-148.4	-0.2	0	0	0	116.5
268	K	27.4	Very low	28.7	Very low	166 Å²	166	140.8 Å²	140.8	72%	0.722	77%	0.766	S	S	*	*			trans	-42.5	158.1	-179.9	-52.2	145.1	-162.4	85.9	0	116.2
269	R	29.3	Very low	28.7	Very low	237 Å²	237	141.8 Å²	141.8	89%	0.894	76%	0.762	S	S	*	*				-155.6	132.3	128.8	-113.1	167.1	-161.9	-161.3	2.2	114.7
270	S	27.7	Very low	28.9	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	76%	0.758	S	S	*	*			trans	25.7	114.4	150.1	52.8	0	0	0	0	119.1
271	V	25.2	Very low	29	Very low	144 Å²	144	141.2 Å²	141.2	87%	0.873	75%	0.749	S	S	*	*				67.7	105.1	60	-178.5	0	0	0	0	113.6
272	A	28.6	Very low	28.8	Very low	103 Å²	103	140.9 Å²	140.9	85%	0.851	74%	0.741	S	S	*	*			trans	-163	130.8	146.7	0	0	0	0	0	109.9
273	S	25.5	Very low	28.8	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	74%	0.738	S	S	*	*			trans	-133.6	-173.9	168.8	62.2	0	0	0	0	106.2
274	P	35	Very low	28.6	Very low	100 Å²	100	132.8 Å²	132.8	65%	0.649	73%	0.729	S	S	*	*			cis	-136.4	-128.3	7.6	31.4	-4.1	0	0	0	112.6
275	D	29.1	Very low	28.5	Very low	129 Å²	129	134.7 Å²	134.7	69%	0.69	74%	0.74	S	S	*	*			trans	74.1	107.1	169.3	-47.3	-21.6	0	0	0	116.2
276	E	27.6	Very low	28.1	Very low	183 Å²	183	136 Å²	136	86%	0.855	74%	0.736	S	S	*	*				78.1	111.9	54.5	-68.5	-163.1	172.2	0	0	114.6
277	S	29.7	Very low	27.4	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	73%	0.733	S	S	*	*				174.2	137.5	122.9	59	0	0	0	0	112
278	N	28.4	Very low	27.4	Very low	134 Å²	134	135.7 Å²	135.7	72%	0.717	74%	0.736	S	S	*	*			trans	63.3	120.2	140.4	-60.5	13.2	0	0	0	118.6
279	E	27.1	Very low	27.5	Very low	145 Å²	145	136 Å²	136	68%	0.678	74%	0.74	S	S	*	*				69.8	146.9	80.4	-69.5	-175.1	140.7	0	0	113.1
280	H	28.6	Very low	27.6	Very low	131 Å²	131	131.9 Å²	131.9	61%	0.606	74%	0.741	S	S	*	*			cis	-166.4	-179.1	25.7	-130.9	4.3	0	0	0	111.4
281	Y	27.6	Very low	27.6	Very low	173 Å²	173	130.9 Å²	130.9	68%	0.678	75%	0.745	S	S	*	*			trans	29	121.9	164.1	-67.1	-87.7	0	0	0	121.3
282	L	24.1	Very low	28	Very low	135 Å²	135	129.2 Å²	129.2	71%	0.707	75%	0.747	S	S	*	*				72.8	134.9	66.3	-81.7	170.1	0	0	0	117.2
283	T	24.8	Very low	27.9	Very low	124 Å²	124	130 Å²	130	76%	0.761	75%	0.746	S	S	*	*			trans	64	157.9	156.7	53.6	0	0	0	0	118.1
284	S	24.2	Very low	28.4	Very low	92 Å²	92	128.8 Å²	128.8	64%	0.643	74%	0.742	S	S	*	*			cis	-172	175.6	-18.3	-94	0	0	0	0	109.6
285	L	24.6	Very low	28.2	Very low	158 Å²	158	135 Å²	135	83%	0.827	75%	0.753	S	S	*	*			trans	69	165.3	158.1	-65.1	143	0	0	0	117.5
286	H	26.1	Very low	28.5	Very low	140 Å²	140	135.8 Å²	135.8	65%	0.648	76%	0.757	S	S	*	*			cis	-168.3	166.9	-46.2	-136.6	-105.7	0	0	0	111
287	F	24.6	Very low	28.6	Very low	180 Å²	180	132.1 Å²	132.1	79%	0.789	75%	0.752	S	S	*	*			trans	68.6	160.5	156.3	-79.1	-57.9	0	0	0	123.7
288	G	29.9	Very low	28.8	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	75%	0.75	S	S	*	*			trans	101.1	95.2	177.3	0	0	0	0	0	113.7
289	Q	29.7	Very low	28.9	Very low	173 Å²	173	132.4 Å²	132.4	81%	0.808	76%	0.76	S	S	*	*			cis	81.9	148.6	31	-99.6	-166.8	11.5	0	0	117.1
290	T	30.9	Very low	29	Very low	150 Å²	150	130.9 Å²	130.9	92%	0.92	77%	0.765	S	S	*	*			trans	77.3	141.7	-169.5	74.4	0	0	0	0	115.7
291	G	27.7	Very low	29.1	Very low	72 Å²	72	129.2 Å²	129.2	74%	0.742	77%	0.768	S	S	*	*			cis	170.3	152.2	-12.8	0	0	0	0	0	115
292	A	33.5	Very low	29.4	Very low	110 Å²	110	129.3 Å²	129.3	91%	0.909	78%	0.775	S	S	*	*			trans	66.8	162.5	167.7	0	0	0	0	0	119.3
293	S	28	Very low	29.8	Very low	119 Å²	119	127.9 Å²	127.9	83%	0.832	78%	0.776	S	S	*	*			cis	-172.9	176.3	-33.7	-168.1	0	0	0	0	110.6
294	A	36.1	Very low	30.1	Very low	82 Å²	82	126.7 Å²	126.7	68%	0.678	77%	0.772	S	S	*	*			trans	80.3	122.8	-179.1	0	0	0	0	0	115.9
295	R	29.9	Very low	30.5	Very low	231 Å²	231	129.7 Å²	129.7	87%	0.872	78%	0.781	S	S	*	*				71.1	125.7	58.7	-67.7	-179.3	176.3	172.7	-2.6	111.2
296	D	34.8	Very low	30.6	Very low	146 Å²	146	127.2 Å²	127.2	78%	0.781	78%	0.778	S	S	*	*			cis	-155.2	-168.7	40.3	-90.8	-52.8	0	0	0	111.1
297	S	30.4	Very low	30.9	Very low	105 Å²	105	126.9 Å²	126.9	73%	0.734	79%	0.785	S	S	*	*			cis	179.4	140.8	-46.2	-80.4	0	0	0	0	108.5
298	G	33.9	Very low	31	Very low	66 Å²	66	125.5 Å²	125.5	68%	0.68	79%	0.786	S	S	*	*			trans	122	124.2	178.7	0	0	0	0	0	113.1
299	L	30	Very low	31.1	Very low	177 Å²	177	133 Å²	133	93%	0.927	79%	0.793	S	S	*	*			cis	69.1	126.3	43.1	-51.7	173.5	0	0	0	112.1
300	S	28.8	Very low	31	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	79%	0.791	S	S	*	*			cis	-162.3	-167.2	4.3	56.5	0	0	0	0	109.3
301	S	32.7	Very low	31.2	Very low	97 Å²	97	128.4 Å²	128.4	68%	0.678	78%	0.784	S	S	*	*			cis	-153.1	-103.4	13	59.1	0	0	0	0	115
302	H	32.1	Very low	31.3	Very low	175 Å²	175	132.8 Å²	132.8	81%	0.81	79%	0.791	S	S	*	*			trans	-126.5	173.8	-172.1	-56.1	-81.6	0	0	0	110
303	S	33.5	Very low	31	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	78%	0.78	S	S	*	*			cis	-156.9	144.4	28.3	56	0	0	0	0	110.2
304	S	30.1	Very low	31.1	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	78%	0.781	S	S	*	*				89.7	143.4	76.2	-51.4	0	0	0	0	115.8
305	N	32.7	Very low	30.7	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	79%	0.785	S	S	*	*			trans	80.6	108.8	178.9	-51	-8.7	0	0	0	115.1
306	S	27.8	Very low	30.7	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	77%	0.774	S	S	*	*			cis	86.5	103.4	29.3	89	0	0	0	0	116.4
307	V	32.8	Very low	30.6	Very low	133 Å²	133	130.2 Å²	130.2	81%	0.806	78%	0.775	S	S	*	*			trans	-143.1	125.6	142.1	177.6	0	0	0	0	107.5	Y309	V307-Y309 HydrophobicContact CG1-CD2 4.32Å
308	N	26.7	Very low	30.5	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	77%	0.774	S	S	*	*			trans	-90.9	148.4	169.2	-67.9	-36.5	0	0	0	109.7
309	Y	31.6	Very low	30.4	Very low	228 Å²	228	139.3 Å²	139.3	89%	0.894	79%	0.785	S	S	*	*			trans	-141.4	133.8	143.8	-98.1	-74.5	0	0	0	110.4	V307	V307-Y309 HydrophobicContact CG1-CD2 4.32Å
310	S	27.6	Very low	30.2	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	78%	0.782	S	S	*	*			trans	-105	161.3	179.4	-90.2	0	0	0	0	111
311	P	34.6	Very low	30.2	Very low	118 Å²	118	144.7 Å²	144.7	77%	0.766	79%	0.787	S	S	*	*			trans	-73.9	154.8	-176.3	31.8	-37	0	0	0	112.4
312	N	30.5	Very low	29.9	Very low	165 Å²	165	146.1 Å²	146.1	88%	0.882	79%	0.792	S	S	*	*			trans	-157.5	166	155.4	-117.8	-34.3	0	0	0	113
313	S	26.2	Very low	30.1	Very low	99 Å²	99	143 Å²	143	69%	0.692	79%	0.787	S	S	*	*			trans	-83.8	162.7	-172.5	56.1	0	0	0	0	114.5
314	L	29.5	Very low	29.9	Very low	161 Å²	161	145.3 Å²	145.3	84%	0.843	79%	0.787	S	S	*	*			trans	176	99.9	146.9	-94.6	162.8	0	0	0	107.2
315	V	28.3	Very low	29.5	Very low	125 Å²	125	146.2 Å²	146.2	76%	0.758	79%	0.791	S	S	*	*				72.4	119.3	89.1	175.9	0	0	0	0	114.8
316	L	30.5	Very low	29.5	Very low	124 Å²	124	147.4 Å²	147.4	65%	0.649	79%	0.789	S	S	*	*			trans	-31.7	155.6	167.5	-82.9	146.9	0	0	0	117.3
317	P	32.7	Very low	29.5	Very low	125 Å²	125	149.6 Å²	149.6	81%	0.812	79%	0.792	S	S	*	*				-129.8	147.9	96.5	37	-31.5	0	0	0	115.3
318	H	27.9	Very low	29.2	Very low	150 Å²	150	148.3 Å²	148.3	69%	0.694	79%	0.79	S	S	*	*			trans	-69.4	155.7	167.4	-63.5	-81.8	0	0	0	112.3
319	K	31.8	Very low	29.4	Very low	212 Å²	212	149.5 Å²	149.5	92%	0.922	80%	0.795	S	S	*	*				-151.3	119.4	126	-114.6	164.4	-173.5	175.6	0	112.1
320	R	25.1	Very low	29.2	Very low	231 Å²	231	143.9 Å²	143.9	87%	0.872	79%	0.789	S	S	*	*			trans	-71.6	146.7	162.3	-64.2	174.2	175.8	168.5	-2.6	108.5
321	L	29.8	Very low	29.4	Very low	171 Å²	171	144 Å²	144	90%	0.895	79%	0.787	S	S	*	*			trans	-153.8	134.8	141	-105.1	175	0	0	0	110
322	V	27	Very low	29.1	Very low	127 Å²	127	144.3 Å²	144.3	77%	0.77	79%	0.787	S	S	*	*			trans	-159	149.2	-174	173.4	0	0	0	0	105.2
323	P	35.4	Very low	29.2	Very low	111 Å²	111	142.4 Å²	142.4	72%	0.721	78%	0.784	S	S	*	*			cis	-115.9	-169	-15.6	39.3	-24.9	0	0	0	111.3
324	E	29	Very low	29.7	Very low	152 Å²	152	143.4 Å²	143.4	71%	0.71	79%	0.788	S	S	*	*				-175.6	158.9	114.2	-109.9	-163.3	-151.8	0	0	112.7	K326	E324-K326 IonicContact OE2-NZ 2.67Å; E324-K326 PolarHBondContact OE2-NZ 3.3Å
325	C	23	Very low	29.7	Very low	117 Å²	117	141.7 Å²	141.7	79%	0.791	79%	0.786	S	S	*	*			trans	-103.3	135.9	174.3	-57.4	0	0	0	0	111
326	K	32.1	Very low	29.7	Very low	181 Å²	181	142 Å²	142	79%	0.787	79%	0.788	S	S	*	*			trans	-151.5	160	151.7	-97.3	118	-161.7	170.7	0	111	E324	E324-K326 IonicContact OE2-NZ 2.67Å; E324-K326 PolarHBondContact OE2-NZ 3.3Å
327	N	27.4	Very low	29.9	Very low	152 Å²	152	141.9 Å²	141.9	81%	0.813	80%	0.795	S	S	*	*			trans	-87.6	165.2	-161	-67.2	-30.5	0	0	0	114.5
328	S	25.9	Very low	29.6	Very low	107 Å²	107	146.6 Å²	146.6	75%	0.748	80%	0.796	S	S	*	*			trans	52.2	108.7	143.3	60.4	0	0	0	0	119
329	L	30.8	Very low	30	Very low	175 Å²	175	148.7 Å²	148.7	92%	0.916	81%	0.806	S	S	*	*			trans	-161.8	133.6	132.4	-106.3	156.9	0	0	0	110.2
330	S	27.8	Very low	29.9	Very low	109 Å²	109	142.7 Å²	142.7	76%	0.762	80%	0.796	S	S	*	*			trans	-86.4	144.9	178.5	55.6	0	0	0	0	112.2
331	P	32.7	Very low	30.5	Very low	111 Å²	111	138 Å²	138	72%	0.721	80%	0.795	S	S	*	*			trans	-138.3	124.1	142.7	31	-14.1	0	0	0	115
332	T	27.2	Very low	30.7	Very low	126 Å²	126	138 Å²	138	77%	0.773	79%	0.79	S	S	*	*			trans	34.4	128.4	139.7	58.2	0	0	0	0	121.7
333	P	33.7	Very low	31	Very low	124 Å²	124	137.4 Å²	137.4	81%	0.805	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.4	165.8	33.2	-34.6	0	0	0	112.9
334	P	35.3	Very low	30.9	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.9	164.1	176.7	31.4	-35.2	0	0	0	113.7
335	P	29.9	Very low	31.1	Very low	125 Å²	125	139.5 Å²	139.5	81%	0.812	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-86.8	162.3	-159.1	33.7	-37.8	0	0	0	116.5
336	V	28.9	Very low	31.4	Very low	132 Å²	132	141 Å²	141	80%	0.8	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-82.5	126.9	178.1	178.8	0	0	0	0	111.9	R338	V336-R338 PolarHBondContact O-N 3.27Å
337	P	34.1	Very low	31.3	Very low	120 Å²	120	138 Å²	138	78%	0.779	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.8	122	167.2	-16.7	31.3	0	0	0	111.3
338	R	27.5	Very low	31.5	Very low	224 Å²	224	134.4 Å²	134.4	85%	0.845	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-79.6	141.3	162.3	-63.8	177.9	178	-178.8	-0.8	108.6	V336	V336-R338 PolarHBondContact O-N 3.27Å
339	H	34.6	Very low	31.6	Very low	195 Å²	195	136.9 Å²	136.9	90%	0.903	79%	0.791	S	S	*	*				177.4	137.5	124.2	-94.9	-67	0	0	0	111.1
340	A	31.7	Very low	31.5	Very low	85 Å²	85	134.7 Å²	134.7	70%	0.702	79%	0.785	S	S	*	*			trans	-145	154.2	168.6	0	0	0	0	0	108.4
341	P	36.7	Very low	31.6	Very low	132 Å²	132	138 Å²	138	86%	0.857	79%	0.788	S	S	*	*			trans	-84.5	139.5	168.8	32.7	-31.2	0	0	0	111.4
342	Q	33	Very low	31.5	Very low	171 Å²	171	144.5 Å²	144.5	80%	0.799	80%	0.798	S	S	*	*			trans	-129.9	145.6	170.7	-73.9	-173.5	-13.6	0	0	110.7
343	S	35.4	Very low	31.5	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	80%	0.803	S	S	*	*			trans	-161.2	125.5	154.2	42.7	0	0	0	0	107.4
344	Q	32.7	Very low	31.4	Very low	170 Å²	170	144 Å²	144	79%	0.794	80%	0.802	S	S	*	*			cis	95.1	153.1	36.7	-72.7	-169	-0	0	0	115.1
345	V	32.3	Very low	30.9	Very low	138 Å²	138	145.6 Å²	145.6	84%	0.836	80%	0.804	S	S	*	*			trans	80.4	134.5	-177.4	176.1	0	0	0	0	114.7
346	M	30	Very low	30.9	Very low	148 Å²	148	147.7 Å²	147.7	73%	0.729	81%	0.807	S	S	*	*			cis	-153.9	154.5	-20.1	-93.1	-68.3	-94.2	0	0	106.2
347	V	30.2	Very low	30.8	Very low	119 Å²	119	146.5 Å²	146.5	72%	0.721	80%	0.802	S	S	*	*				52.7	128.1	72.1	-167.3	0	0	0	0	112.4
348	A	31.8	Very low	30.4	Very low	75 Å²	75	146.4 Å²	146.4	62%	0.62	80%	0.803	S	S	*	*			cis	-152.2	169	30.1	0	0	0	0	0	115.4
349	L	26.5	Very low	30.3	Very low	160 Å²	160	144.4 Å²	144.4	84%	0.838	80%	0.803	S	S	*	*			trans	32.3	150.2	135	-55.1	171.2	0	0	0	121.2
350	T	30	Very low	29.9	Very low	129 Å²	129	140.5 Å²	140.5	79%	0.791	79%	0.793	S	S	*	*			cis	-157.4	175.3	20.9	-20.1	0	0	0	0	112.2
351	Q	29.5	Very low	29.6	Very low	178 Å²	178	143.5 Å²	143.5	83%	0.832	80%	0.797	S	S	*	*			trans	-76.3	153.5	178.4	-55.9	156.3	-25	0	0	114.4
352	R	30.3	Very low	29.2	Very low	247 Å²	247	145.2 Å²	145.2	93%	0.932	80%	0.798	S	S	*	*				-162.8	152.4	127.7	-121.6	174.4	178.5	153.7	0.9	113.7
353	N	27.9	Very low	28.8	Very low	164 Å²	164	141.8 Å²	141.8	88%	0.877	79%	0.789	S	S	*	*			trans	-84.2	156.9	-178.8	-58	-21.3	0	0	0	112
354	G	30.2	Very low	28.4	Very low	77 Å²	77	144.9 Å²	144.9	79%	0.794	79%	0.788	S	S	*	*			trans	-171.7	102.7	169.4	0	0	0	0	0	112.3
355	N	26	Very low	28.1	Very low	153 Å²	153	142.4 Å²	142.4	82%	0.818	79%	0.788	S	S	*	*			trans	-76.7	155.3	170.9	-67.6	-19.1	0	0	0	110.6
356	I	29	Very low	27.9	Very low	170 Å²	170	141.5 Å²	141.5	87%	0.872	78%	0.783	S	S	*	*				-178.5	134.6	126.5	-91.7	151	0	0	0	108.6
357	P	28	Very low	27.9	Very low	107 Å²	107	140.4 Å²	140.4	70%	0.695	79%	0.788	S	S	*	*			trans	-117.8	177.9	-178.8	43.3	-34.7	0	0	0	114.8
358	C	24.4	Very low	28	Very low	118 Å²	118	139.6 Å²	139.6	80%	0.797	79%	0.788	S	S	*	*			trans	79.5	165.5	154.9	-67.2	0	0	0	0	120.5
359	E	27.1	Very low	27.8	Very low	181 Å²	181	146.5 Å²	146.5	85%	0.846	80%	0.804	S	S	*	*			trans	70	148.2	170.3	-58.9	-168.9	169.8	0	0	117.7
360	T	25.8	Very low	28	Very low	113 Å²	113	142.3 Å²	142.3	69%	0.693	80%	0.8	S	S	*	*				176.2	142.2	-51.3	25.8	0	0	0	0	104.7
361	D	25.2	Very low	27.9	Very low	148 Å²	148	141 Å²	141	79%	0.791	80%	0.802	S	S	*	*			trans	39	129.9	162.1	-60.8	-29.1	0	0	0	121.2
362	L	28.3	Very low	27.9	Very low	168 Å²	168	137.5 Å²	137.5	88%	0.88	80%	0.797	S	S	*	*				-171.1	165.6	109.7	-99.7	163.5	0	0	0	113.6
363	T	25.2	Very low	27.8	Very low	99 Å²	99	130.9 Å²	130.9	61%	0.607	79%	0.788	S	S	*	*			trans	-111.6	162	-157.1	65.3	0	0	0	0	115.3
364	K	26.3	Very low	27.8	Very low	181 Å²	181	131.4 Å²	131.4	79%	0.787	78%	0.783	S	S	*	*			trans	71.6	124.3	151.8	-67.4	160.6	-179.3	171.8	0	119.6
365	C	26.3	Very low	27.6	Very low	118 Å²	118	135.9 Å²	135.9	80%	0.797	79%	0.785	S	S	*	*				179.2	124.7	114.4	-91.6	0	0	0	0	107.2
366	T	27.3	Very low	27.6	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.724	78%	0.782	S	S	*	*			cis	88.8	132.6	40.4	63.6	0	0	0	0	115.4
367	C	30.1	Very low	27.5	Very low	125 Å²	125	131.9 Å²	131.9	85%	0.845	78%	0.783	S	S	*	*			trans	107.5	137.8	176.6	-65.4	0	0	0	0	115.7
368	S	32.2	Very low	27.3	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	78%	0.783	S	S	*	*			cis	-166.4	127.2	-14.2	46.7	0	0	0	0	114.9
369	K	28.9	Very low	27.3	Very low	221 Å²	221	138 Å²	138	96%	0.961	78%	0.782	S	S	*	*			trans	50.5	136.9	144.9	-63.2	-176.8	177.9	179.4	0	122.8
370	G	29.7	Very low	27.3	Very low	72 Å²	72	137.6 Å²	137.6	74%	0.742	78%	0.784	S	S	*	*			trans	139.7	75.5	165.9	0	0	0	0	0	112.4
371	A	28.9	Very low	27.3	Very low	102 Å²	102	143.8 Å²	143.8	84%	0.843	79%	0.794	S	S	*	*				64.1	125.3	83	0	0	0	0	0	114.1
372	S	28.9	Very low	27.4	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	79%	0.789	S	S	*	*			cis	-163.4	139.8	2	44.4	0	0	0	0	115.5
373	S	27.5	Very low	27.2	Very low	107 Å²	107	137.5 Å²	137.5	75%	0.748	78%	0.782	S	S	*	*			trans	67.5	151.9	153.8	84.7	0	0	0	0	118.8
374	K	29	Very low	27.2	Very low	176 Å²	176	139.7 Å²	139.7	77%	0.765	80%	0.795	S	S	*	*			cis	-129.8	128.2	-4.7	-71.1	-176.8	-178.7	178.5	0	107.7
375	M	26	Very low	27.2	Very low	171 Å²	171	137.9 Å²	137.9	84%	0.842	79%	0.792	S	S	*	*				58.6	137.9	94.1	-66.4	-169.1	-71.1	0	0	116.3
376	A	24.9	Very low	27.1	Very low	89 Å²	89	141.3 Å²	141.3	74%	0.736	79%	0.789	S	S	*	*			cis	-167.8	155.2	-14	0	0	0	0	0	111.1
377	V	27.3	Very low	27.1	Very low	149 Å²	149	143.4 Å²	143.4	90%	0.903	80%	0.795	S	S	*	*			trans	174.1	111.9	140.7	149.8	0	0	0	0	107.4
378	E	23.9	Very low	26.9	Very low	150 Å²	150	144.4 Å²	144.4	70%	0.701	79%	0.786	S	S	*	*			trans	-153.5	151	169.2	-155.6	-165.2	-127.9	0	0	109.7
379	R	24.1	Very low	26.7	Very low	205 Å²	205	144.6 Å²	144.6	77%	0.774	79%	0.788	S	S	*	*			trans	74	96.1	168.9	-50.6	175.9	-165	155.5	17.4	118
380	I	27.9	Very low	26.6	Very low	171 Å²	171	142.3 Å²	142.3	88%	0.877	78%	0.78	S	S	*	*				-122.3	130.6	115.9	-62	-176.9	0	0	0	107.4
381	R	26	Very low	26.4	Very low	244 Å²	244	145.3 Å²	145.3	92%	0.921	78%	0.784	S	S	*	*			trans	-86.6	131	172.2	-74.8	176.8	168.8	172.5	-5.1	108.9
382	G	25.8	Very low	26.4	Very low	66 Å²	66	143.3 Å²	143.3	68%	0.68	77%	0.774	S	S	*	*			trans	-143.7	67.1	-171.7	0	0	0	0	0	115.6
383	T	25.5	Very low	26.4	Very low	118 Å²	118	147.2 Å²	147.2	72%	0.724	78%	0.781	S	S	*	*			trans	38.5	90.6	155.2	54.6	0	0	0	0	118.9	I385	T383-I385 PolarHBondContact O-N 3.16Å
384	T	24.3	Very low	26.3	Very low	144 Å²	144	148 Å²	148	88%	0.883	79%	0.786	S	S	*	*			trans	-73.9	101	156	31.7	0	0	0	0	110.8	R386	T384-R386 PolarHBondContact O-N 3.34Å; T384-R386 VanDerWaalsContact O-N 3.15Å
385	I	26.1	Very low	26.2	Very low	143 Å²	143	148.2 Å²	148.2	73%	0.733	79%	0.787	S	S	*	*			trans	-77	100.6	173.8	-59.1	179	0	0	0	109.2	T383 L387	T383-I385 PolarHBondContact O-N 3.16Å; I385-L387 PolarHBondContact O-N 3.18Å
386	R	25.6	Very low	26.3	Very low	191 Å²	191	146 Å²	146	72%	0.721	78%	0.784	S	S	*	*			trans	-70.5	112.1	161.6	-87.4	-174.4	171.1	137.4	-2.4	109.2	T384 H388	T384-R386 PolarHBondContact O-N 3.34Å; T384-R386 VanDerWaalsContact O-N 3.15Å; R386-H388 PolarHBondContact O-N 2.93Å
387	L	26.5	Very low	26.5	Very low	162 Å²	162	149.2 Å²	149.2	85%	0.848	79%	0.787	S	S	*	*			trans	-79.4	108.1	153.7	-69.3	177.3	0	0	0	107.8	I385 S389	I385-L387 PolarHBondContact O-N 3.18Å; L387-S389 PolarHBondContact O-N 3.34Å
388	H	26.3	Very low	26.4	Very low	145 Å²	145	149.5 Å²	149.5	67%	0.671	78%	0.783	S	S	*	*			trans	-71.4	105.8	170.9	-89.5	-109.5	0	0	0	109.3	R386 H390	R386-H388 PolarHBondContact O-N 2.93Å; H388-H390 PolarHBondContact O-N 3.49Å
389	S	26.9	Very low	26.6	Very low	107 Å²	107	151.5 Å²	151.5	75%	0.748	79%	0.789	S	S	*	*			trans	-68.3	96.8	159.6	53.3	0	0	0	0	108.3	L387 T391	L387-S389 PolarHBondContact O-N 3.34Å; S389-T391 PolarHBondContact O-N 3.42Å; S389-T391 VanDerWaalsContact O-N 3.11Å
390	H	26.7	Very low	26.8	Very low	173 Å²	173	146.2 Å²	146.2	80%	0.801	78%	0.784	S	S	*	*			trans	-67	109.6	178.5	-126.2	-87	0	0	0	109.5	H388 G392	H388-H390 PolarHBondContact O-N 3.49Å; H390-G392 PolarHBondContact O-N 2.67Å
391	T	26.8	Very low	26.7	Very low	134 Å²	134	148.8 Å²	148.8	82%	0.822	78%	0.784	S	S	*	*			trans	-73.6	78.6	172.8	51.4	0	0	0	0	109.4	S389	S389-T391 PolarHBondContact O-N 3.42Å; S389-T391 VanDerWaalsContact O-N 3.11Å
392	G	28.3	Very low	26.7	Very low	60 Å²	60	146.8 Å²	146.8	62%	0.619	78%	0.782	S	S	*	*			trans	-81.6	127.4	175.8	0	0	0	0	0	111.5	H390 S394	H390-G392 PolarHBondContact O-N 2.67Å; G392-S394 PolarHBondContact O-N 3.01Å
393	E	28.6	Very low	27.1	Very low	187 Å²	187	148.5 Å²	148.5	87%	0.874	78%	0.782	S	S	*	*			trans	-74.8	120	-179	-61.8	-172.9	114.2	0	0	112	K395	E393-K395 PolarHBondContact O-N 3.1Å
394	S	25.1	Very low	27.2	Very low	124 Å²	124	153.2 Å²	153.2	87%	0.867	79%	0.786	S	S	*	*			trans	-81.7	93.6	174.9	-62.9	0	0	0	0	111.7	G392	G392-S394 PolarHBondContact O-N 3.01Å
395	K	28.1	Very low	27.2	Very low	179 Å²	179	153.9 Å²	153.9	78%	0.778	78%	0.779	S	S	*	*			trans	-138.1	139.4	165.6	-77.6	-171.7	179.3	170.1	0	114.1	E393	E393-K395 PolarHBondContact O-N 3.1Å
396	T	28.4	Very low	27.3	Very low	126 Å²	126	154.9 Å²	154.9	77%	0.773	79%	0.786	S	S	*	*			trans	67.5	116.6	156	42.8	0	0	0	0	121.1
397	L	29.2	Very low	27.2	Very low	155 Å²	155	153.6 Å²	153.6	81%	0.812	79%	0.788	S	S	*	*			trans	81.2	79.3	138.4	-60.7	171.3	0	0	0	120.6
398	L	24.5	Very low	27.3	Very low	156 Å²	156	153.6 Å²	153.6	82%	0.817	78%	0.784	S	S	*	*				29.2	137.3	110.8	-105.8	165	0	0	0	120.4
399	K	28	Very low	27.4	Very low	192 Å²	192	154.3 Å²	154.3	84%	0.835	79%	0.793	S	S	*	*			trans	82.4	138.5	173.1	-55	175.4	-178.8	-179.4	0	114.7
400	S	27.2	Very low	27.3	Very low	93 Å²	93	158.5 Å²	158.5	65%	0.65	80%	0.797	S	S	*	*			cis	-170.6	159.7	-11	46.2	0	0	0	0	111.7
401	Y	27.3	Very low	27.5	Very low	226 Å²	226	159.6 Å²	159.6	89%	0.886	80%	0.803	S	S	*	*			trans	75	126.5	165.4	-69	-75.8	0	0	0	120.9
402	F	25.7	Very low	27.4	Very low	201 Å²	201	159.9 Å²	159.9	88%	0.882	80%	0.799	S	S	*	*			trans	-88.1	-176.5	155	-80	-84	0	0	0	109.6
403	P	33.1	Very low	27.4	Very low	103 Å²	103	165.1 Å²	165.1	67%	0.669	81%	0.812	S	S	*	*			cis	-132.6	178.5	-41	35.8	-19.7	0	0	0	112.9
404	R	27.9	Very low	27.3	Very low	217 Å²	217	163.6 Å²	163.6	82%	0.819	81%	0.81	S	S	*	*			trans	161.9	120.4	137.7	-90.3	175.7	-174.3	-170.4	1.5	109.8
405	E	24.1	Very low	27.5	Very low	158 Å²	158	163 Å²	163	74%	0.738	81%	0.806	S	S	*	*				63.4	98.1	90.7	-67.3	177.3	161.8	0	0	114.5
406	N	28.2	Very low	27.6	Very low	164 Å²	164	160.1 Å²	160.1	88%	0.877	81%	0.808	S	S	*	*				-168.9	170.2	111.5	-103.1	-48.6	0	0	0	113.3
407	E	25.4	Very low	27.5	Very low	164 Å²	164	160.9 Å²	160.9	77%	0.766	81%	0.807	S	S	*	*			trans	-86.1	-171.6	-168.7	-57.3	-171.8	120.4	0	0	115.5
408	Q	27.3	Very low	27.4	Very low	162 Å²	162	158.4 Å²	158.4	76%	0.757	80%	0.803	S	S	*	*			trans	73.4	97.8	163.3	-53.4	176.4	23.8	0	0	115.3
409	N	28.5	Very low	27.6	Very low	160 Å²	160	156.4 Å²	156.4	86%	0.856	80%	0.799	S	S	*	*				-158.4	151.8	81.2	-102.4	-69.1	0	0	0	115
410	K	25.4	Very low	27.6	Very low	195 Å²	195	155 Å²	155	85%	0.848	80%	0.799	S	S	*	*			trans	-90.6	130.1	165.2	-65.7	169.3	179.7	167.6	0	109.4
411	Q	29.6	Very low	27.7	Very low	195 Å²	195	161.2 Å²	161.2	91%	0.911	81%	0.808	S	S	*	*			trans	-160.4	153.1	142.5	-112.9	162.3	45.2	0	0	112.5
412	N	26.2	Very low	27.7	Very low	140 Å²	140	158.7 Å²	158.7	75%	0.749	80%	0.802	S	S	*	*			trans	-81.3	151.8	-168.3	-54.3	-67.1	0	0	0	112.7
413	L	28.3	Very low	27.8	Very low	171 Å²	171	160.8 Å²	160.8	90%	0.895	80%	0.804	S	S	*	*			trans	-148.6	120.6	137.6	-123.4	131.5	0	0	0	111
414	N	25.5	Very low	27.6	Very low	154 Å²	154	165.6 Å²	165.6	82%	0.824	81%	0.814	S	S	*	*			trans	-105	113.1	-178.9	-82.6	-62.8	0	0	0	110.6
415	S	29.7	Very low	27.8	Very low	111 Å²	111	158.2 Å²	158.2	78%	0.776	80%	0.796	S	S	*	*			trans	-161	144.1	157.1	59.4	0	0	0	0	109.6
416	S	30.5	Very low	28.3	Very low	120 Å²	120	157.6 Å²	157.6	84%	0.839	80%	0.798	S	S	*	*			cis	-139.2	149.3	-15.9	56.2	0	0	0	0	109.2
417	L	25.2	Very low	28.8	Very low	142 Å²	142	155 Å²	155	74%	0.743	79%	0.788	S	S	*	*			trans	-108	144.8	180	-83	166.7	0	0	0	110.9
418	S	28.5	Very low	29.2	Very low	103 Å²	103	151.5 Å²	151.5	72%	0.72	77%	0.774	S	S	*	*			trans	-111.3	143.6	151.7	54.6	0	0	0	0	109.6
419	P	27.4	Very low	29.7	Very low	113 Å²	113	150.1 Å²	150.1	73%	0.734	77%	0.767	S	S	*	*			trans	-121.7	135	-151.7	35.8	-20.6	0	0	0	114.3
420	I	28.9	Very low	30.2	Very low	162 Å²	162	145.3 Å²	145.3	83%	0.831	75%	0.746	S	S	*	*	S	Bend	trans	-158.1	-14.9	157.7	-114	148.6	0	0	0	116.9
421	W	28.6	Very low	30.8	Very low	224 Å²	224	141.1 Å²	141.1	85%	0.848	73%	0.731	S	S	*	*			trans	-120.4	39.3	-179.7	-75.5	70.4	0	0	0	116.3
422	K	27.1	Very low	31.5	Very low	174 Å²	174	136 Å²	136	76%	0.757	71%	0.709	S	S	*	*			trans	-113.2	83	170.5	-80.3	-167.6	176.1	-176.4	0	112.6
423	R	28.7	Very low	32.3	Very low	244 Å²	244	135.7 Å²	135.7	92%	0.921	70%	0.701	S	S	*	*	S	Bend	trans	-167.5	143	160	-104.3	157.8	-165.6	-175.1	4.2	110.4
424	K	28.7	Very low	33.3	Very low	204 Å²	204	132 Å²	132	89%	0.887	68%	0.682	S	S	*	*	S	Bend	trans	76.4	147.9	-173.8	-54.5	-175	177	-174.9	0	115.6
425	S	32	Very low	34.5	Very low	63 Å²	63	131.9 Å²	131.9	44%	0.441	68%	0.675	S	S	.	*			trans	84.5	20.1	171.4	-153.8	0	0	0	0	121.4	L428	S425-L428 WeakPolarHBondContact OG-CB 3.33Å
426	N	34.9	Very low	35.2	Very low	144 Å²	144	130.4 Å²	130.4	77%	0.77	66%	0.657	S	S	*	*	H	α-helix	trans	-70	-34	164.7	-75.7	30	0	0	0	112.6	Q429	N426-Q429 PolarHBondContact O-N 3.42Å
427	T	39	Very low	35.8	Very low	110 Å²	110	130.2 Å²	130.2	68%	0.675	64%	0.643	S	S	*	*	H	α-helix	trans	-73.2	-23.5	-179.8	30.5	0	0	0	0	114.4	S430	T427-S430 PolarHBondContact O-OG 3.15Å
428	L	34.3	Very low	36.9	Very low	91 Å²	91	128 Å²	128	48%	0.476	63%	0.631	S	S	.	*	H	α-helix	trans	-74.7	-30.3	176.6	-145.8	80.6	0	0	0	111.6	S425 M431 I432	S425-L428 WeakPolarHBondContact OG-CB 3.33Å; L428-M431 HydrophobicContact CD1-CE 4.04Å; L428-I432 HydrophobicContact CD2-CD1 4.08Å; L428-I432 HydrophobicContact CG-CD1 4.08Å; L428-I432 WeakPolarHBondContact O-CB 3.44Å; L428-I432 WeakPolarHBondContact O-CD1 3.32Å; L428-I432 VanDerWaalsContact O-CG1 3.26Å; L428-I432 WeakPolarHBondContact O-CG1 3.31Å; L428-I432 PolarHBondContact O-N 2.93Å; L428-I432 VanDerWaalsContact O-N 3.13Å
429	Q	35.9	Very low	37.5	Very low	132 Å²	132	127.8 Å²	127.8	62%	0.617	62%	0.621	S	S	*	*	H	α-helix	trans	-74.4	-27.8	-176.4	-73.8	-171.8	-24.6	0	0	113.9	N426 K433	N426-Q429 PolarHBondContact O-N 3.42Å; Q429-K433 PolarHBondContact O-N 2.92Å
430	S	40.4	Very low	38.1	Very low	59 Å²	59	126.4 Å²	126.4	41%	0.413	61%	0.605	S	S	.	*	H	α-helix	trans	-71.4	-53.8	170.4	62.1	0	0	0	0	110.6	T427 I432 K433 D434	T427-S430 PolarHBondContact O-OG 3.15Å; S430-I432 PolarHBondContact O-N 3.47Å; S430-K433 WeakPolarHBondContact O-CA 3.44Å; S430-K433 WeakPolarHBondContact O-CB 3.19Å; S430-K433 PolarHBondContact O-N 3.47Å; S430-D434 PolarHBondContact O-N 2.97Å; S430-D434 VanDerWaalsContact O-OD2 3.12Å
431	M	37.3	Very low	39	Very low	107 Å²	107	123.6 Å²	123.6	53%	0.527	59%	0.588	S	S	.	*	H	α-helix	trans	-57	-29.5	-178.8	-65.6	-169.1	-65.1	0	0	113.9	L428 K435	L428-M431 HydrophobicContact CD1-CE 4.04Å; M431-K435 WeakPolarHBondContact O-CB 3.24Å; M431-K435 PolarHBondContact O-N 2.85Å
432	I	43.6	Very low	39.7	Very low	88 Å²	88	119.4 Å²	119.4	45%	0.451	58%	0.578	S	S	.	*	H	α-helix	trans	-74.6	-41.8	173.4	-70.3	168.4	0	0	0	111.4	L428 S430 I436	L428-I432 HydrophobicContact CD2-CD1 4.08Å; L428-I432 HydrophobicContact CG-CD1 4.08Å; L428-I432 WeakPolarHBondContact O-CB 3.44Å; L428-I432 WeakPolarHBondContact O-CD1 3.32Å; L428-I432 VanDerWaalsContact O-CG1 3.26Å; L428-I432 WeakPolarHBondContact O-CG1 3.31Å; L428-I432 PolarHBondContact O-N 2.93Å; L428-I432 VanDerWaalsContact O-N 3.13Å; S430-I432 PolarHBondContact O-N 3.47Å; I432-I436 HydrophobicContact CG2-CD1 3.79Å; I432-I436 VanDerWaalsContact O-CG1 3.27Å; I432-I436 WeakPolarHBondContact O-CG1 3.46Å; I432-I436 PolarHBondContact O-N 3.23Å
433	K	44.1	Very low	40.5	Very low	134 Å²	134	114.4 Å²	114.4	58%	0.583	56%	0.559	S	S	*	*	H	α-helix	trans	-61.9	-47.8	173.6	-81.7	-167.9	168.2	-162.5	0	111.9	Q429 S430 K435 I436 Q437	Q429-K433 PolarHBondContact O-N 2.92Å; S430-K433 WeakPolarHBondContact O-CA 3.44Å; S430-K433 WeakPolarHBondContact O-CB 3.19Å; S430-K433 PolarHBondContact O-N 3.47Å; K433-K435 VanDerWaalsContact C-N 3.27Å; K433-K435 PolarHBondContact O-N 3.24Å; K433-I436 PolarHBondContact O-N 3Å; K433-I436 VanDerWaalsContact O-N 3.09Å; K433-Q437 PolarHBondContact O-N 3.35Å
434	D	48.6	Very low	40.9	Very low	93 Å²	93	110.8 Å²	110.8	50%	0.497	55%	0.547	S	S	.	.	H	α-helix	trans	-60.3	-39.2	-177.9	-52.1	-29.5	0	0	0	111	S430 L438	S430-D434 PolarHBondContact O-N 2.97Å; S430-D434 VanDerWaalsContact O-OD2 3.12Å; D434-L438 WeakPolarHBondContact O-CG 3.37Å; D434-L438 PolarHBondContact O-N 3.31Å
435	K	50.8	Low	41.5	Very low	152 Å²	152	105.5 Å²	105.5	66%	0.661	54%	0.536	S	S	*	.	H	α-helix	trans	-71.3	-35.8	173.8	-82.8	-169.1	172.1	-173.4	0	114.2	M431 K433 I439	M431-K435 WeakPolarHBondContact O-CB 3.24Å; M431-K435 PolarHBondContact O-N 2.85Å; K433-K435 VanDerWaalsContact C-N 3.27Å; K433-K435 PolarHBondContact O-N 3.24Å; K435-I439 WeakPolarHBondContact O-CD1 3.38Å; K435-I439 VanDerWaalsContact O-CG1 3.28Å; K435-I439 WeakPolarHBondContact O-CG1 3.4Å; K435-I439 PolarHBondContact O-N 2.92Å
436	I	45.7	Very low	41.9	Very low	80 Å²	80	111.5 Å²	111.5	41%	0.41	55%	0.554	S	S	.	*	H	α-helix	trans	-66.2	-45.3	176.5	-72.4	166.9	0	0	0	109.9	I432 K433 L438 I439 E440	I432-I436 HydrophobicContact CG2-CD1 3.79Å; I432-I436 VanDerWaalsContact O-CG1 3.27Å; I432-I436 WeakPolarHBondContact O-CG1 3.46Å; I432-I436 PolarHBondContact O-N 3.23Å; K433-I436 PolarHBondContact O-N 3Å; K433-I436 VanDerWaalsContact O-N 3.09Å; I436-L438 PolarHBondContact O-N 2.89Å; I436-I439 PolarHBondContact O-N 3.43Å; I436-E440 HydrophobicContact CG2-CG 4.4Å; I436-E440 PolarHBondContact O-N 3.09Å
437	Q	42.4	Very low	41.8	Very low	116 Å²	116	109.1 Å²	109.1	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-61.9	-43.8	-179.3	-173.3	169.4	-24.3	0	0	112.2	K433 I439 E440 E441	K433-Q437 PolarHBondContact O-N 3.35Å; Q437-I439 VanDerWaalsContact C-N 3.25Å; Q437-I439 PolarHBondContact O-N 3.36Å; Q437-E440 PolarHBondContact O-N 3.36Å; Q437-E441 WeakPolarHBondContact CG-OE1 3.48Å; Q437-E441 PolarHBondContact NE2-OE1 3.47Å; Q437-E441 WeakPolarHBondContact O-CG 3.29Å; Q437-E441 PolarHBondContact O-N 3.44Å
438	L	47.1	Very low	41.6	Very low	95 Å²	95	109.7 Å²	109.7	50%	0.497	55%	0.546	S	S	.	.	H	α-helix	trans	-59.6	-32.9	173.1	-76.2	168.1	0	0	0	113.4	D434 I436 Q442	D434-L438 WeakPolarHBondContact O-CG 3.37Å; D434-L438 PolarHBondContact O-N 3.31Å; I436-L438 PolarHBondContact O-N 2.89Å; L438-Q442 WeakPolarHBondContact O-CB 3.23Å; L438-Q442 VanDerWaalsContact O-CG 3.31Å; L438-Q442 WeakPolarHBondContact O-CG 3.3Å; L438-Q442 PolarHBondContact O-N 2.98Å
439	I	41.6	Very low	41.6	Very low	98 Å²	98	114 Å²	114	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-76.2	-38.2	177	-70.1	168	0	0	0	110.8	K435 I436 Q437 N443	K435-I439 WeakPolarHBondContact O-CD1 3.38Å; K435-I439 VanDerWaalsContact O-CG1 3.28Å; K435-I439 WeakPolarHBondContact O-CG1 3.4Å; K435-I439 PolarHBondContact O-N 2.92Å; I436-I439 PolarHBondContact O-N 3.43Å; Q437-I439 VanDerWaalsContact C-N 3.25Å; Q437-I439 PolarHBondContact O-N 3.36Å; I439-N443 WeakPolarHBondContact O-CB 3.38Å; I439-N443 PolarHBondContact O-N 3.3Å; I439-N443 VanDerWaalsContact O-N 3.11Å; I439-N443 PolarHBondContact O-ND2 2.84Å
440	E	41	Very low	41.3	Very low	85 Å²	85	114.9 Å²	114.9	40%	0.397	57%	0.571	S	S	.	*	H	α-helix	trans	-67.9	-43.6	177	-69	-168	127.8	0	0	111.9	I436 Q437 Q442 N443 Y444 Y541	I436-E440 HydrophobicContact CG2-CG 4.4Å; I436-E440 PolarHBondContact O-N 3.09Å; Q437-E440 PolarHBondContact O-N 3.36Å; E440-Q442 PolarHBondContact O-N 3.1Å; E440-N443 PolarHBondContact O-N 3.46Å; E440-Y444 PolarHBondContact O-N 2.96Å; E440-Y541 WeakPolarHBondContact OE1-CE1 3.4Å; E440-Y541 PolarHBondContact OE1-OH 2.83Å
441	E	47.1	Very low	40.8	Very low	103 Å²	103	118.4 Å²	118.4	48%	0.481	59%	0.591	S	S	.	*	H	α-helix	trans	-57.7	-49.4	174.3	-72.3	171.1	-169.7	0	0	111.5	Q437 N443 Y444 S445	Q437-E441 WeakPolarHBondContact CG-OE1 3.48Å; Q437-E441 PolarHBondContact NE2-OE1 3.47Å; Q437-E441 WeakPolarHBondContact O-CG 3.29Å; Q437-E441 PolarHBondContact O-N 3.44Å; E441-N443 VanDerWaalsContact C-N 3.26Å; E441-N443 PolarHBondContact O-N 3.11Å; E441-Y444 PolarHBondContact O-N 3.47Å; E441-S445 PolarHBondContact O-N 2.88Å; E441-S445 PolarHBondContact O-OG 3.41Å
442	Q	44.5	Very low	40.6	Very low	135 Å²	135	123.4 Å²	123.4	63%	0.631	61%	0.609	S	S	*	*	H	α-helix	trans	-66	-23	177.8	-73.3	-176.1	15.3	0	0	114.5	L438 E440	L438-Q442 WeakPolarHBondContact O-CB 3.23Å; L438-Q442 VanDerWaalsContact O-CG 3.31Å; L438-Q442 WeakPolarHBondContact O-CG 3.3Å; L438-Q442 PolarHBondContact O-N 2.98Å; E440-Q442 PolarHBondContact O-N 3.1Å
443	N	43.2	Very low	40.2	Very low	69 Å²	69	125.2 Å²	125.2	37%	0.369	63%	0.63	S	S	.	*	H	α-helix	trans	-82.2	-42	174.3	-85.4	-97.2	0	0	0	111.5	I439 E440 E441 S445 K446 K539	I439-N443 WeakPolarHBondContact O-CB 3.38Å; I439-N443 PolarHBondContact O-N 3.3Å; I439-N443 VanDerWaalsContact O-N 3.11Å; I439-N443 PolarHBondContact O-ND2 2.84Å; E440-N443 PolarHBondContact O-N 3.46Å; E441-N443 VanDerWaalsContact C-N 3.26Å; E441-N443 PolarHBondContact O-N 3.11Å; N443-S445 VanDerWaalsContact C-N 3.3Å; N443-S445 PolarHBondContact O-N 2.76Å; N443-K446 PolarHBondContact O-N 3.38Å; N443-K446 VanDerWaalsContact O-N 3.1Å; N443-K539 VanDerWaalsContact CG-NZ 3.33Å; N443-K539 PolarHBondContact OD1-NZ 3.23Å
444	Y	37.2	Very low	39.6	Very low	168 Å²	168	128 Å²	128	66%	0.659	64%	0.642	S	S	*	*	H	α-helix	trans	-60.9	-38.3	179.7	-118.5	-87.8	0	0	0	112.3	E440 E441 K446 S447 I448	E440-Y444 PolarHBondContact O-N 2.96Å; E441-Y444 PolarHBondContact O-N 3.47Å; Y444-K446 PolarHBondContact O-N 2.77Å; Y444-K446 VanDerWaalsContact O-N 3.17Å; Y444-S447 PolarHBondContact O-N 3.05Å; Y444-S447 PolarHBondContact O-OG 3.46Å; Y444-I448 HydrophobicContact CD1-CD1 4.01Å
445	S	41.9	Very low	38.8	Very low	93 Å²	93	132.8 Å²	132.8	65%	0.65	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-16	176.8	-54.7	0	0	0	0	114.7	E441 N443	E441-S445 PolarHBondContact O-N 2.88Å; E441-S445 PolarHBondContact O-OG 3.41Å; N443-S445 VanDerWaalsContact C-N 3.3Å; N443-S445 PolarHBondContact O-N 2.76Å
446	K	39.6	Very low	37.9	Very low	189 Å²	189	129.5 Å²	129.5	82%	0.822	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-10.2	-177.6	-72.4	-175.4	175.4	-179.9	0	114.7	N443 Y444	N443-K446 PolarHBondContact O-N 3.38Å; N443-K446 VanDerWaalsContact O-N 3.1Å; Y444-K446 PolarHBondContact O-N 2.77Å; Y444-K446 VanDerWaalsContact O-N 3.17Å
447	S	33.2	Very low	37.1	Very low	94 Å²	94	129.1 Å²	129.1	66%	0.657	69%	0.686	S	S	*	*	S	Bend	trans	-108.3	14.1	-175.1	54.7	0	0	0	0	114.9	Y444	Y444-S447 PolarHBondContact O-N 3.05Å; Y444-S447 PolarHBondContact O-OG 3.46Å
448	I	34.8	Very low	36.6	Very low	122 Å²	122	129.7 Å²	129.7	63%	0.626	70%	0.697	S	S	*	*	S	Bend	trans	-111.2	-8.8	-173	-73.6	177.1	0	0	0	113.8	Y444	Y444-I448 HydrophobicContact CD1-CD1 4.01Å
449	Q	33.6	Very low	35.9	Very low	182 Å²	182	131.1 Å²	131.1	85%	0.85	71%	0.705	S	S	*	*	S	Bend	trans	-97.4	12.8	-171.2	-73.1	-167.3	-26.6	0	0	116.7
450	I	30.3	Very low	35.4	Very low	151 Å²	151	134.5 Å²	134.5	77%	0.774	72%	0.716	S	S	*	*	S	Bend	trans	-130.1	144.7	178.2	-50.5	-177.5	0	0	0	109.5
451	T	28.8	Very low	34.9	Very low	133 Å²	133	140.1 Å²	140.1	82%	0.816	73%	0.734	S	S	*	*	S	Bend	trans	78.8	49.2	178.9	76	0	0	0	0	120.1
452	K	33.6	Very low	34.1	Very low	212 Å²	212	142.1 Å²	142.1	92%	0.922	74%	0.743	S	S	*	*			trans	-144.9	80.4	155.1	-80.6	-159.9	178.5	-178.4	0	115.8
453	S	35.6	Very low	33.3	Very low	125 Å²	125	144 Å²	144	87%	0.874	75%	0.752	S	S	*	*			trans	-175.7	136.8	147.9	48.3	0	0	0	0	110.8
454	K	31.3	Very low	32.8	Very low	194 Å²	194	149 Å²	149	84%	0.843	77%	0.771	S	S	*	*			trans	-101.3	173.3	164.1	-75.5	-172	174.5	-178.7	0	109.4
455	E	32.4	Very low	32.7	Very low	193 Å²	193	147.5 Å²	147.5	90%	0.902	77%	0.774	S	S	*	*			trans	82.4	132.6	161.4	-52.8	-176.9	175.3	0	0	118.4
456	G	30.9	Very low	32.1	Very low	82 Å²	82	150.5 Å²	150.5	85%	0.845	78%	0.783	S	S	*	*			trans	115.2	107.6	152.8	0	0	0	0	0	118.7
457	G	30.1	Very low	31.7	Very low	72 Å²	72	148.7 Å²	148.7	74%	0.742	78%	0.782	S	S	*	*				90.1	64.2	128.5	0	0	0	0	0	121.7
458	V	30.2	Very low	31.6	Very low	129 Å²	129	152.3 Å²	152.3	78%	0.782	79%	0.788	S	S	*	*				49	135.1	118.8	173.9	0	0	0	0	121.3
459	N	33.1	Very low	31.4	Very low	125 Å²	125	152.1 Å²	152.1	67%	0.668	79%	0.793	S	S	*	*			trans	89.9	95.2	157.9	-77.9	-24.1	0	0	0	121.5
460	K	31.4	Very low	31.2	Very low	168 Å²	168	149.5 Å²	149.5	73%	0.73	78%	0.781	S	S	*	*				69.7	129.8	106.8	-81.1	-178.7	-174.8	170.1	0	121.8
461	R	30	Very low	31.2	Very low	203 Å²	203	151.8 Å²	151.8	77%	0.766	78%	0.78	S	S	*	*			trans	76.4	150.9	146.7	-67.1	-174	155	161.7	-5	118.1
462	E	31.3	Very low	31.4	Very low	146 Å²	146	155.9 Å²	155.9	68%	0.682	79%	0.786	S	S	*	*			cis	-153	175.4	-21.2	-117.1	150.3	-160.3	0	0	107.3
463	E	27.8	Very low	31.2	Very low	174 Å²	174	149.4 Å²	149.4	81%	0.813	78%	0.78	S	S	*	*			trans	-55	153.9	-178.5	-56	160.3	131.1	0	0	114
464	K	32.6	Very low	30.8	Very low	175 Å²	175	153.4 Å²	153.4	76%	0.761	78%	0.781	S	S	*	*				-179.5	160.6	108.1	-104.3	-174.9	172.5	-161.6	0	119.4
465	D	34.6	Very low	30.5	Very low	135 Å²	135	151.6 Å²	151.6	72%	0.722	78%	0.775	S	S	*	*			trans	66	105.5	153.4	-54	-18.1	0	0	0	120.4
466	D	28.5	Very low	30.4	Very low	156 Å²	156	150.4 Å²	150.4	83%	0.834	78%	0.775	S	S	*	*			trans	-69.6	157.4	151.4	-58.9	-81.7	0	0	0	110.9
467	D	32.8	Very low	30.2	Very low	152 Å²	152	151.8 Å²	151.8	81%	0.813	76%	0.761	S	S	*	*				177.3	162.1	107.7	-123.9	-36.9	0	0	0	116.4
468	E	29.3	Very low	30	Very low	169 Å²	169	156.2 Å²	156.2	79%	0.79	77%	0.768	S	S	*	*			trans	63.8	166.9	152.8	-72.9	-145	112.5	0	0	124.8
469	V	32.2	Very low	29.7	Very low	119 Å²	119	159.1 Å²	159.1	72%	0.721	77%	0.77	S	S	*	*			trans	69.5	78.6	168.5	-161.2	0	0	0	0	117.7
470	E	28.6	Very low	29.4	Very low	127 Å²	127	158 Å²	158	59%	0.593	77%	0.767	S	S	*	*				90.8	149.1	76.4	-93.4	-154.3	111.6	0	0	119.2
471	R	29.2	Very low	29	Very low	199 Å²	199	158.4 Å²	158.4	75%	0.751	77%	0.772	S	S	*	*			trans	58	72.3	152.8	-67.1	174.7	-168.4	120.8	7.6	120.3
472	K	33.9	Very low	28.8	Very low	218 Å²	218	158.2 Å²	158.2	95%	0.948	77%	0.773	S	S	*	*	S	Bend	trans	-142.5	138.1	132.7	-68.7	-167.6	-179.5	171.4	0	111.8
473	G	30.4	Very low	28.4	Very low	77 Å²	77	158.5 Å²	158.5	79%	0.794	77%	0.774	S	S	*	*			trans	102.6	9.4	150.8	0	0	0	0	0	121.5	H475	G473-H475 VanDerWaalsContact C-N 3.34Å; G473-H475 PolarHBondContact O-N 3.19Å
474	K	25.7	Very low	28.1	Very low	209 Å²	209	157 Å²	157	91%	0.909	77%	0.772	S	S	*	*			trans	-72.4	78	172.2	-78.5	-173.3	178.5	175.6	0	112.6
475	H	26.3	Very low	27.7	Very low	155 Å²	155	154.8 Å²	154.8	72%	0.718	77%	0.773	S	S	*	*			trans	-175.7	101.6	153.7	-97.4	-42.8	0	0	0	113.9	G473 I477	G473-H475 VanDerWaalsContact C-N 3.34Å; G473-H475 PolarHBondContact O-N 3.19Å; H475-I477 HydrophobicContact CB-CD1 4.34Å; H475-I477 WeakPolarHBondContact ND1-CD1 3.46Å
476	L	29.7	Very low	27.3	Very low	169 Å²	169	155.4 Å²	155.4	89%	0.885	78%	0.782	S	S	*	*			trans	-172.3	67.1	147.1	-130.1	73.5	0	0	0	107.9
477	I	26.1	Very low	27	Very low	110 Å²	110	154 Å²	154	56%	0.564	78%	0.779	S	S	*	*				57.6	126.3	82.4	-52.6	175.6	0	0	0	113.6	H475 K479	H475-I477 HydrophobicContact CB-CD1 4.34Å; H475-I477 WeakPolarHBondContact ND1-CD1 3.46Å; I477-K479 PolarHBondContact O-N 3.18Å
478	N	26.1	Very low	26.7	Very low	166 Å²	166	154 Å²	154	89%	0.888	78%	0.778	S	S	*	*	S	Bend	trans	-43.5	105.6	164.9	-69.3	-20.1	0	0	0	113
479	K	24.8	Very low	26.7	Very low	189 Å²	189	154.9 Å²	154.9	82%	0.822	78%	0.779	S	S	*	*			trans	-158.1	131.9	167.6	-105.4	172.1	-176.4	-179.9	0	104.7	I477	I477-K479 PolarHBondContact O-N 3.18Å
480	V	26.6	Very low	26.3	Very low	101 Å²	101	156 Å²	156	61%	0.612	78%	0.78	S	S	*	*			cis	-146.3	135	33.7	158.3	0	0	0	0	111.6	Y482	V480-Y482 HydrophobicContact CG1-CD2 3.38Å; V480-Y482 HydrophobicContact CG1-CE2 4.39Å; V480-Y482 HydrophobicContact CG1-CG 3.81Å; V480-Y482 VanDerWaalsContact CG1-N 3.29Å
481	Q	23.1	Very low	26.3	Very low	177 Å²	177	157 Å²	157	83%	0.827	79%	0.79	S	S	*	*			trans	-87.9	112.8	144.6	-74.1	176.1	-85.5	0	0	107.6
482	Y	24.6	Very low	26.3	Very low	199 Å²	199	153.8 Å²	153.8	78%	0.78	79%	0.788	S	S	*	*			trans	-153.4	111.5	160	-83.7	-52.8	0	0	0	103.3	V480	V480-Y482 HydrophobicContact CG1-CD2 3.38Å; V480-Y482 HydrophobicContact CG1-CE2 4.39Å; V480-Y482 HydrophobicContact CG1-CG 3.81Å; V480-Y482 VanDerWaalsContact CG1-N 3.29Å
483	E	22.9	Very low	26.1	Very low	152 Å²	152	148.9 Å²	148.9	71%	0.71	77%	0.772	S	S	*	*			cis	46.6	100.1	44.1	-58.6	-162.6	147.6	0	0	112
484	N	22.9	Very low	26.1	Very low	144 Å²	144	152.6 Å²	152.6	77%	0.77	77%	0.768	S	S	*	*	S	Bend	trans	49.9	140.5	148	-59.8	-29.2	0	0	0	121.1
485	T	22.7	Very low	26.3	Very low	128 Å²	128	148.7 Å²	148.7	79%	0.785	76%	0.757	S	S	*	*			trans	61.6	77.4	152.2	46.6	0	0	0	0	118.3
486	T	26.6	Very low	26.4	Very low	148 Å²	148	150.3 Å²	150.3	91%	0.908	76%	0.757	S	S	*	*			trans	-120.4	100.4	130.4	54.1	0	0	0	0	109.6
487	T	23.6	Very low	26.5	Very low	126 Å²	126	147.5 Å²	147.5	77%	0.773	74%	0.742	S	S	*	*			trans	-70.7	136.6	167.2	38.8	0	0	0	0	110.1
488	I	26.6	Very low	26.6	Very low	153 Å²	153	148.9 Å²	148.9	79%	0.785	75%	0.746	S	S	*	*			trans	-168.8	116.1	146.1	-100.9	148.4	0	0	0	110.5
489	K	27.8	Very low	26.7	Very low	186 Å²	186	145.8 Å²	145.8	81%	0.809	73%	0.729	S	S	*	*			trans	53.9	87.8	150.4	-57.1	177.1	-175.6	177	0	119
490	N	24.9	Very low	26.9	Very low	142 Å²	142	141 Å²	141	76%	0.759	72%	0.719	S	S	*	*			trans	21.3	118.9	132.9	-51.9	5.2	0	0	0	118.8
491	D	28.1	Very low	27.1	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	71%	0.711	S	S	*	*			trans	-146.4	116.3	137.5	-130.4	-26.5	0	0	0	110.7	N493	D491-N493 PolarHBondContact O-N 3.46Å
492	N	28.2	Very low	27.4	Very low	131 Å²	131	134.7 Å²	134.7	70%	0.701	69%	0.692	S	S	*	*			trans	-88.5	67.9	-155.5	-66.5	-7.5	0	0	0	113.5
493	N	31.8	Very low	27.8	Very low	115 Å²	115	131.8 Å²	131.8	62%	0.615	69%	0.689	S	S	*	*			trans	-118.9	-17.2	-179.3	-80.1	-57.1	0	0	0	116.6	D491	D491-N493 PolarHBondContact O-N 3.46Å
494	H	29.4	Very low	28.3	Very low	156 Å²	156	126.7 Å²	126.7	72%	0.722	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-71.8	-32.8	-175.5	-96.5	-74.5	0	0	0	114.6	R496 I497	H494-R496 PolarHBondContact O-N 3.42Å; H494-R496 VanDerWaalsContact O-N 3.07Å; H494-I497 PolarHBondContact O-N 3.1Å
495	D	29.2	Very low	28.6	Very low	126 Å²	126	123.9 Å²	123.9	67%	0.674	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-65.9	-15.4	-173.5	-59.5	-42.8	0	0	0	114.6	I497 N499	D495-I497 VanDerWaalsContact C-N 3.3Å; D495-I497 PolarHBondContact O-N 3.04Å; D495-N499 PolarHBondContact O-ND2 2.6Å
496	R	29.6	Very low	28.9	Very low	189 Å²	189	124.5 Å²	124.5	71%	0.713	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-73.1	-19.9	177.3	-89.3	-177.4	160.5	-175.2	-7	113.9	H494	H494-R496 PolarHBondContact O-N 3.42Å; H494-R496 VanDerWaalsContact O-N 3.07Å
497	I	30.7	Very low	29	Very low	110 Å²	110	121.2 Å²	121.2	56%	0.564	63%	0.633	S	S	*	*	S	Bend	trans	-79.3	-27.3	-174	-61.1	175.2	0	0	0	111.9	H494 D495 N499	H494-I497 PolarHBondContact O-N 3.1Å; D495-I497 VanDerWaalsContact C-N 3.3Å; D495-I497 PolarHBondContact O-N 3.04Å; I497-N499 PolarHBondContact O-N 3.48Å
498	H	29.2	Very low	29.3	Very low	140 Å²	140	120.5 Å²	120.5	65%	0.648	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-74.5	-22.5	-179.5	-100.7	-89.9	0	0	0	114.7	S500	H498-S500 PolarHBondContact O-N 2.77Å
499	N	28.2	Very low	29.7	Very low	101 Å²	101	121.4 Å²	121.4	54%	0.54	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-84.3	-8.6	-161.5	-67.5	-26.2	0	0	0	115.6	D495 I497 L502	D495-N499 PolarHBondContact O-ND2 2.6Å; I497-N499 PolarHBondContact O-N 3.48Å; N499-L502 HydrophobicContact CB-CD1 4.14Å; N499-L502 WeakPolarHBondContact OD1-CD1 3.47Å
500	S	29.5	Very low	30	Very low	87 Å²	87	122.1 Å²	122.1	61%	0.608	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-85	-15.2	177.7	54.5	0	0	0	0	114.3	H498	H498-S500 PolarHBondContact O-N 2.77Å
501	C	29.8	Very low	31	Very low	66 Å²	66	123.2 Å²	123.2	45%	0.446	63%	0.634	S	S	.	*	S	Bend	trans	-97.4	0.4	177.9	-80.9	0	0	0	0	114.7	L503	C501-L503 PolarHBondContact O-N 3.08Å
502	L	29.9	Very low	32.2	Very low	80 Å²	80	123.7 Å²	123.7	42%	0.419	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	3.5	-166.5	-74.4	177.2	0	0	0	117.4	N499 L504 N505	N499-L502 HydrophobicContact CB-CD1 4.14Å; N499-L502 WeakPolarHBondContact OD1-CD1 3.47Å; L502-L504 VanDerWaalsContact C-N 3.31Å; L502-L504 PolarHBondContact O-N 3Å; L502-N505 HydrophobicContact CD2-CB 4.27Å
503	L	32.6	Very low	33.9	Very low	138 Å²	138	122.5 Å²	122.5	72%	0.723	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-4.7	177.5	-71	177.4	0	0	0	114.8	C501	C501-L503 PolarHBondContact O-N 3.08Å
504	L	32.7	Very low	35.9	Very low	45 Å²	45	118.1 Å²	118.1	24%	0.236	61%	0.607	C	S	.	*	S	Bend	trans	-131.7	-1.5	179.7	-68.4	172.1	0	0	0	114.8	L502 D506 W521 E1095 L1098	L502-L504 VanDerWaalsContact C-N 3.31Å; L502-L504 PolarHBondContact O-N 3Å; L504-D506 PolarHBondContact O-N 2.86Å; L504-W521 HydrophobicContact CD1-CH2 4.45Å; L504-W521 HydrophobicContact CD1-CZ2 3.62Å; L504-E1095 HydrophobicContact CD2-CG 3.93Å; L504-L1098 HydrophobicContact CD1-CD2 4.23Å
505	N	30	Very low	37.9	Very low	86 Å²	86	115.5 Å²	115.5	46%	0.46	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	-4.9	-170.2	-72.2	-2.7	0	0	0	114.9	L502	L502-N505 HydrophobicContact CD2-CB 4.27Å
506	D	29.5	Very low	39.9	Very low	141 Å²	141	109.5 Å²	109.5	75%	0.754	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-5.7	-168.4	-67.7	-16.6	0	0	0	115.2	L504	L504-D506 PolarHBondContact O-N 2.86Å
507	S	28.8	Very low	41.9	Very low	79 Å²	79	100.8 Å²	100.8	55%	0.552	54%	0.538	S	S	*	.	S	Bend	trans	-132.9	-7.1	-162.1	58.2	0	0	0	0	117.4
508	T	29.9	Very low	43.8	Very low	110 Å²	110	98.3 Å²	98.3	68%	0.675	53%	0.528	S	S	*	.	S	Bend	trans	-121.6	135.7	175.1	50.5	0	0	0	0	111.4	Q510	T508-Q510 PolarHBondContact O-N 2.91Å
509	K	34	Very low	45.7	Very low	172 Å²	172	93.8 Å²	93.8	75%	0.748	51%	0.508	S	S	*	.			trans	-59	135	174.8	-63.5	172.9	-176.9	169.2	0	108.6	Q511	K509-Q511 PolarHBondContact O-N 3.31Å
510	Q	34.6	Very low	47.7	Very low	202 Å²	202	89 Å²	89	94%	0.944	48%	0.483	S	S	*	.			trans	-59.7	108.8	176.9	-69.4	163.9	-67.4	0	0	110.3	T508	T508-Q510 PolarHBondContact O-N 2.91Å
511	Q	46.4	Very low	49.6	Very low	165 Å²	165	87.4 Å²	87.4	77%	0.771	46%	0.464	S	S	*	.			trans	-122.9	139.3	162	-72.4	-175.3	-43.4	0	0	106.7	K509 I513	K509-Q511 PolarHBondContact O-N 3.31Å; Q511-I513 PolarHBondContact O-N 2.92Å
512	D	52.7	Low	51.4	Low	158 Å²	158	87.2 Å²	87.2	85%	0.845	46%	0.456	S	S	*	.			trans	-65.2	98	-157.4	-55.6	-79.3	0	0	0	114.1	C514	D512-C514 PolarHBondContact O-N 2.72Å
513	I	63.2	Low	53.3	Low	106 Å²	106	83.7 Å²	83.7	54%	0.544	44%	0.437	S	S	.	.			trans	-71.1	108.3	168.6	-55.8	179.8	0	0	0	107.2	Q511 C517 T518	Q511-I513 PolarHBondContact O-N 2.92Å; I513-C517 HydrophobicContact CG2-CB 3.62Å; I513-T518 WeakPolarHBondContact CG2-OG1 3.45Å
514	C	73.4	Confident	55.2	Low	24 Å²	24	77.1 Å²	77.1	16%	0.162	40%	0.403	C	S	.	.			trans	-65.6	158	-177.4	79.9	0	0	0	0	111.9	D512 A516 C517 T518 C569 C572	D512-C514 PolarHBondContact O-N 2.72Å; C514-A516 PolarHBondContact O-N 3.12Å; C514-A516 VanDerWaalsContact O-N 3.12Å; C514-C517 PolarHBondContact O-N 3.4Å; C514-T518 PolarHBondContact O-N 3.34Å; C514-T518 VanDerWaalsContact O-N 3.09Å; C514-T518 PolarHBondContact O-OG1 3.27Å; C514-C569 HydrophobicContact CB-CB 3.89Å; C514-C569 VanDerWaalsContact SG-SG 3.61Å; C514-C572 PolarHBondContact SG-SG 3.33Å
515	T	71.3	Confident	56.6	Low	101 Å²	101	76.5 Å²	76.5	62%	0.62	40%	0.399	S	S	*	.	H	α-helix	trans	-53	-36.1	-178.8	50.1	0	0	0	0	113.3	T518 L519	T515-T518 PolarHBondContact O-N 2.93Å; T515-L519 WeakPolarHBondContact O-CB 3.21Å; T515-L519 WeakPolarHBondContact O-CD1 3.34Å; T515-L519 VanDerWaalsContact O-CG 3.27Å; T515-L519 WeakPolarHBondContact O-CG 3.31Å; T515-L519 PolarHBondContact O-N 2.86Å
516	A	72.2	Confident	57.7	Low	0 Å²	0	74 Å²	74	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-63	-46.7	176.4	0	0	0	0	0	112.6	C514 T518 N520 L563	C514-A516 PolarHBondContact O-N 3.12Å; C514-A516 VanDerWaalsContact O-N 3.12Å; A516-T518 VanDerWaalsContact C-N 3.34Å; A516-T518 PolarHBondContact O-N 3.23Å; A516-N520 WeakPolarHBondContact O-CB 3.2Å; A516-N520 PolarHBondContact O-N 3.47Å; A516-L563 VanDerWaalsContact CB-C 3.49Å; A516-L563 HydrophobicContact CB-CB 3.65Å; A516-L563 VanDerWaalsContact CB-O 3.25Å; A516-L563 WeakPolarHBondContact CB-O 3.43Å
517	C	71.7	Confident	58.5	Low	6 Å²	6	72.8 Å²	72.8	4%	0.041	38%	0.379	C	S	.	.	H	α-helix	trans	-62.2	-42.3	175.7	-70.1	0	0	0	0	111.4	I513 C514 W521 C572	I513-C517 HydrophobicContact CG2-CB 3.62Å; C514-C517 PolarHBondContact O-N 3.4Å; C517-W521 VanDerWaalsContact O-CB 3.27Å; C517-W521 WeakPolarHBondContact O-CB 3.4Å; C517-W521 PolarHBondContact O-N 3.26Å; C517-C572 VanDerWaalsContact SG-SG 3.63Å
518	T	69.5	Low	58.8	Low	57 Å²	57	73.7 Å²	73.7	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-45.7	179.3	-55.7	0	0	0	0	112.4	I513 C514 T515 A516 W521 Q522	I513-T518 WeakPolarHBondContact CG2-OG1 3.45Å; C514-T518 PolarHBondContact O-N 3.34Å; C514-T518 VanDerWaalsContact O-N 3.09Å; C514-T518 PolarHBondContact O-OG1 3.27Å; T515-T518 PolarHBondContact O-N 2.93Å; A516-T518 VanDerWaalsContact C-N 3.34Å; A516-T518 PolarHBondContact O-N 3.23Å; T518-W521 PolarHBondContact O-N 3.4Å; T518-Q522 WeakPolarHBondContact O-CG 3.45Å; T518-Q522 PolarHBondContact O-N 3.47Å
519	L	69.2	Low	58.9	Low	45 Å²	45	70.3 Å²	70.3	24%	0.236	36%	0.363	C	S	.	.	H	α-helix	trans	-66.1	-42.8	178	-73.3	165.1	0	0	0	111.8	T515 W521 Q522 F523 L563	T515-L519 WeakPolarHBondContact O-CB 3.21Å; T515-L519 WeakPolarHBondContact O-CD1 3.34Å; T515-L519 VanDerWaalsContact O-CG 3.27Å; T515-L519 WeakPolarHBondContact O-CG 3.31Å; T515-L519 PolarHBondContact O-N 2.86Å; L519-W521 VanDerWaalsContact C-N 3.33Å; L519-W521 PolarHBondContact O-N 3.21Å; L519-Q522 PolarHBondContact O-N 2.98Å; L519-F523 PolarHBondContact O-N 3.2Å; L519-L563 HydrophobicContact CD1-CD1 3.65Å
520	N	71.2	Confident	58.6	Low	2 Å²	2	66.6 Å²	66.6	1%	0.011	36%	0.359	C	S	.	.	H	α-helix	trans	-61.2	-42.5	176	-165.3	57.6	0	0	0	111.2	A516 F523 Y524 T560 Y1102 C1106	A516-N520 WeakPolarHBondContact O-CB 3.2Å; A516-N520 PolarHBondContact O-N 3.47Å; N520-F523 PolarHBondContact O-N 3.44Å; N520-Y524 WeakPolarHBondContact O-CD2 3.13Å; N520-Y524 PolarHBondContact O-N 2.85Å; N520-Y524 WeakPolarHBondContact OD1-CE2 3.44Å; N520-T560 HydrophobicContact CB-CG2 3.76Å; N520-Y1102 PolarHBondContact ND2-OH 2.87Å; N520-C1106 PolarHBondContact ND2-SG 3.48Å
521	W	70.1	Confident	58.4	Low	53 Å²	53	60.9 Å²	60.9	20%	0.201	33%	0.329	C	S	.	.	H	α-helix	trans	-61.4	-48	174.5	-171.9	-79	0	0	0	112.1	L504 C517 T518 L519 F523 Y524 L525 L1098 N1099 Y1102	L504-W521 HydrophobicContact CD1-CH2 4.45Å; L504-W521 HydrophobicContact CD1-CZ2 3.62Å; C517-W521 VanDerWaalsContact O-CB 3.27Å; C517-W521 WeakPolarHBondContact O-CB 3.4Å; C517-W521 PolarHBondContact O-N 3.26Å; T518-W521 PolarHBondContact O-N 3.4Å; L519-W521 VanDerWaalsContact C-N 3.33Å; L519-W521 PolarHBondContact O-N 3.21Å; W521-F523 VanDerWaalsContact C-N 3.33Å; W521-F523 PolarHBondContact O-N 3.15Å; W521-Y524 PolarHBondContact O-N 3.46Å; W521-L525 WeakPolarHBondContact O-CB 3.43Å; W521-L525 WeakPolarHBondContact O-CG 3.02Å; W521-L525 PolarHBondContact O-N 2.64Å; W521-L525 VanDerWaalsContact O-N 3.07Å; W521-L1098 HydrophobicContact CZ2-CG 4.45Å; W521-N1099 WeakPolarHBondContact CH2-OD1 3.45Å; W521-Y1102 VanDerWaalsContact CA-CE2 3.47Å; W521-Y1102 HydrophobicContact CB-CE2 4.01Å; W521-Y1102 HydrophobicContact CD2-CD1 4.49Å; W521-Y1102 HydrophobicContact CD2-CD2 4.26Å; W521-Y1102 HydrophobicContact CD2-CE2 4.43Å; W521-Y1102 HydrophobicContact CD2-CG 4.28Å; W521-Y1102 AromaticContact CE3-CD1 3.34Å; W521-Y1102 HydrophobicContact CE3-CD1 3.34Å; W521-Y1102 AromaticContact CE3-CD2 3.81Å; W521-Y1102 HydrophobicContact CE3-CD2 3.81Å; W521-Y1102 AromaticContact CE3-CE1 3.52Å; W521-Y1102 HydrophobicContact CE3-CE1 3.52Å; W521-Y1102 AromaticContact CE3-CE2 3.98Å; W521-Y1102 HydrophobicContact CE3-CE2 3.98Å; W521-Y1102 AromaticContact CE3-CG 3.48Å; W521-Y1102 HydrophobicContact CE3-CG 3.48Å; W521-Y1102 VanDerWaalsContact CE3-CG 3.48Å; W521-Y1102 AromaticContact CE3-CZ 3.82Å; W521-Y1102 HydrophobicContact CH2-CD1 4.47Å; W521-Y1102 HydrophobicContact CH2-CG 4.42Å; W521-Y1102 AromaticContact CZ3-CD1 3.34Å; W521-Y1102 HydrophobicContact CZ3-CD1 3.34Å; W521-Y1102 HydrophobicContact CZ3-CD2 4.35Å; W521-Y1102 AromaticContact CZ3-CE1 3.92Å; W521-Y1102 HydrophobicContact CZ3-CE1 3.92Å; W521-Y1102 AromaticContact CZ3-CG 3.57Å; W521-Y1102 HydrophobicContact CZ3-CG 3.57Å
522	Q	67.8	Low	57.6	Low	61 Å²	61	57.8 Å²	57.8	29%	0.285	32%	0.321	S	S	.	.	H	α-helix	trans	-58.1	-42	176.4	-74.8	172.5	-11	0	0	112.5	T518 L519 Y524 L525	T518-Q522 WeakPolarHBondContact O-CG 3.45Å; T518-Q522 PolarHBondContact O-N 3.47Å; L519-Q522 PolarHBondContact O-N 2.98Å; Q522-Y524 PolarHBondContact O-N 3.26Å; Q522-L525 PolarHBondContact O-N 2.86Å
523	F	69.1	Low	56.6	Low	6 Å²	6	59.3 Å²	59.3	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-40	179.9	173.9	-95.3	0	0	0	113.6	L519 N520 W521 H553 F556 K1047	L519-F523 PolarHBondContact O-N 3.2Å; N520-F523 PolarHBondContact O-N 3.44Å; W521-F523 VanDerWaalsContact C-N 3.33Å; W521-F523 PolarHBondContact O-N 3.15Å; F523-H553 AromaticContact CE1-NE2 3.92Å; F523-H553 AromaticContact CZ-CD2 3.69Å; F523-F556 HydrophobicContact CB-CD1 3.85Å; F523-F556 HydrophobicContact CB-CD2 4.38Å; F523-F556 HydrophobicContact CB-CE1 3.23Å; F523-F556 HydrophobicContact CB-CE2 3.84Å; F523-F556 HydrophobicContact CB-CG 4.39Å; F523-F556 HydrophobicContact CB-CZ 3.24Å; F523-F556 AromaticContact CD1-CD1 3.51Å; F523-F556 HydrophobicContact CD1-CD1 3.51Å; F523-F556 AromaticContact CD1-CE1 3.58Å; F523-F556 HydrophobicContact CD1-CE1 3.58Å; F523-F556 HydrophobicContact CD1-CG 4.34Å; F523-F556 HydrophobicContact CD1-CZ 4.46Å; F523-F556 HydrophobicContact CD2-CB 3.86Å; F523-F556 AromaticContact CD2-CD1 3.21Å; F523-F556 HydrophobicContact CD2-CD1 3.21Å; F523-F556 AromaticContact CD2-CD2 3.52Å; F523-F556 HydrophobicContact CD2-CD2 3.52Å; F523-F556 AromaticContact CD2-CE1 3.6Å; F523-F556 HydrophobicContact CD2-CE1 3.6Å; F523-F556 AromaticContact CD2-CE2 3.87Å; F523-F556 HydrophobicContact CD2-CE2 3.87Å; F523-F556 AromaticContact CD2-CG 3.18Å; F523-F556 HydrophobicContact CD2-CG 3.18Å; F523-F556 AromaticContact CD2-CZ 3.92Å; F523-F556 HydrophobicContact CD2-CZ 3.92Å; F523-F556 AromaticContact CE1-CD1 3.72Å; F523-F556 HydrophobicContact CE1-CD1 3.72Å; F523-F556 HydrophobicContact CE1-CE1 4.25Å; F523-F556 HydrophobicContact CE1-CG 4.42Å; F523-F556 HydrophobicContact CE2-CB 3.38Å; F523-F556 AromaticContact CE2-CD1 3.43Å; F523-F556 HydrophobicContact CE2-CD1 3.43Å; F523-F556 VanDerWaalsContact CE2-CD1 3.43Å; F523-F556 AromaticContact CE2-CD2 3.99Å; F523-F556 HydrophobicContact CE2-CD2 3.99Å; F523-F556 HydrophobicContact CE2-CE1 4.26Å; F523-F556 AromaticContact CE2-CG 3.28Å; F523-F556 HydrophobicContact CE2-CG 3.28Å; F523-F556 AromaticContact CG-CD1 3.25Å; F523-F556 HydrophobicContact CG-CD1 3.25Å; F523-F556 HydrophobicContact CG-CD2 4.15Å; F523-F556 AromaticContact CG-CE1 3.19Å; F523-F556 HydrophobicContact CG-CE1 3.19Å; F523-F556 HydrophobicContact CG-CE2 4.1Å; F523-F556 AromaticContact CG-CG 3.76Å; F523-F556 HydrophobicContact CG-CG 3.76Å; F523-F556 AromaticContact CG-CZ 3.67Å; F523-F556 HydrophobicContact CG-CZ 3.67Å; F523-F556 HydrophobicContact CZ-CB 3.89Å; F523-F556 AromaticContact CZ-CD1 3.67Å; F523-F556 HydrophobicContact CZ-CD1 3.67Å; F523-F556 AromaticContact CZ-CG 3.92Å; F523-F556 HydrophobicContact CZ-CG 3.92Å; F523-K1047 VanDerWaalsContact CZ-NZ 3.31Å; F523-K1047 WeakPolarHBondContact O-CD 2.95Å; F523-K1047 WeakPolarHBondContact O-CE 3.38Å; F523-K1047 PolarHBondContact O-NZ 3.42Å
524	Y	71.6	Confident	55.3	Low	1 Å²	1	57.2 Å²	57.2	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-78.9	-21.3	176.9	-67.8	-65.1	0	0	0	113.3	N520 W521 Q522 S526 I1048 Y1102 L1105 N1109	N520-Y524 WeakPolarHBondContact O-CD2 3.13Å; N520-Y524 PolarHBondContact O-N 2.85Å; N520-Y524 WeakPolarHBondContact OD1-CE2 3.44Å; W521-Y524 PolarHBondContact O-N 3.46Å; Q522-Y524 PolarHBondContact O-N 3.26Å; Y524-S526 VanDerWaalsContact C-N 3.33Å; Y524-S526 PolarHBondContact O-N 3.11Å; Y524-I1048 PolarHBondContact O-N 3.44Å; Y524-Y1102 HydrophobicContact CD2-CD2 4.05Å; Y524-Y1102 AromaticContact CD2-CE2 3.93Å; Y524-Y1102 HydrophobicContact CD2-CE2 3.93Å; Y524-L1105 HydrophobicContact CD1-CB 4.02Å; Y524-L1105 HydrophobicContact CD1-CD1 4.01Å; Y524-L1105 HydrophobicContact CE1-CB 4.11Å; Y524-L1105 HydrophobicContact CG-CB 4.3Å; Y524-L1105 HydrophobicContact CG-CD1 4.3Å; Y524-N1109 WeakPolarHBondContact OH-CB 3.36Å
525	L	62.5	Low	53.3	Low	31 Å²	31	62 Å²	62	16%	0.162	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	0.5	179.5	-80.6	-151.8	0	0	0	116.4	W521 Q522 Q527 I1048 P1050 L1098	W521-L525 WeakPolarHBondContact O-CB 3.43Å; W521-L525 WeakPolarHBondContact O-CG 3.02Å; W521-L525 PolarHBondContact O-N 2.64Å; W521-L525 VanDerWaalsContact O-N 3.07Å; Q522-L525 PolarHBondContact O-N 2.86Å; L525-Q527 PolarHBondContact O-N 3.21Å; L525-I1048 CarbonylContact C-O 3.48Å; L525-I1048 WeakPolarHBondContact CA-O 3.47Å; L525-I1048 HydrophobicContact CD2-CB 4.5Å; L525-I1048 VanDerWaalsContact O-O 3.1Å; L525-P1050 HydrophobicContact CD1-CG 4.45Å; L525-P1050 HydrophobicContact CD2-CG 3.85Å; L525-L1098 HydrophobicContact CD2-CD1 4Å
526	S	53.8	Low	51.5	Low	33 Å²	33	65 Å²	65	23%	0.231	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	14.1	172.5	77.7	0	0	0	0	117.6	Y524 I1048 R1049	Y524-S526 VanDerWaalsContact C-N 3.33Å; Y524-S526 PolarHBondContact O-N 3.11Å; S526-I1048 WeakPolarHBondContact CB-O 3.2Å; S526-I1048 PolarHBondContact N-O 3.4Å; S526-I1048 PolarHBondContact OG-O 3.15Å; S526-R1049 VanDerWaalsContact OG-CA 3.27Å; S526-R1049 WeakPolarHBondContact OG-CA 3.45Å; S526-R1049 WeakPolarHBondContact OG-CB 3.46Å; S526-R1049 WeakPolarHBondContact OG-CG 3.33Å
527	Q	46.2	Very low	49.5	Very low	117 Å²	117	73.8 Å²	73.8	55%	0.547	39%	0.39	S	S	.	.			trans	-58.2	131.9	165.7	-75.7	-75.7	-13.9	0	0	109.3	L525 C529	L525-Q527 PolarHBondContact O-N 3.21Å; Q527-C529 PolarHBondContact O-N 2.88Å
528	P	34.2	Very low	47.4	Very low	98 Å²	98	75.9 Å²	75.9	64%	0.636	41%	0.408	S	S	*	.			trans	-72.8	82.4	168.4	30.6	-32.5	0	0	0	108.2	S530	P528-S530 PolarHBondContact O-N 3.01Å; P528-S530 VanDerWaalsContact O-N 3.1Å
529	C	31.8	Very low	45.4	Very low	39 Å²	39	80.6 Å²	80.6	26%	0.264	42%	0.423	S	S	.	.			trans	-62.6	113.7	-179.9	-65.7	0	0	0	0	110	Q527 Y531	Q527-C529 PolarHBondContact O-N 2.88Å; C529-Y531 HydrophobicContact CB-CD1 4.03Å; C529-Y531 HydrophobicContact CB-CD2 3.93Å; C529-Y531 HydrophobicContact CB-CE1 3.84Å; C529-Y531 HydrophobicContact CB-CE2 3.73Å; C529-Y531 HydrophobicContact CB-CG 4.08Å; C529-Y531 WeakPolarHBondContact O-CD2 3.45Å; C529-Y531 PolarHBondContact O-N 3.43Å
530	S	27.5	Very low	43.4	Very low	94 Å²	94	83.5 Å²	83.5	66%	0.657	45%	0.446	S	S	*	.			trans	-66	87.4	157.5	51.4	0	0	0	0	107.8	P528 T532	P528-S530 PolarHBondContact O-N 3.01Å; P528-S530 VanDerWaalsContact O-N 3.1Å; S530-T532 PolarHBondContact O-N 3.21Å
531	Y	31.5	Very low	41.5	Very low	82 Å²	82	90.8 Å²	90.8	32%	0.322	48%	0.475	S	S	.	.			trans	-71.7	87.8	-173.7	-73.4	-76.8	0	0	0	111.6	C529 F533 I534	C529-Y531 HydrophobicContact CB-CD1 4.03Å; C529-Y531 HydrophobicContact CB-CD2 3.93Å; C529-Y531 HydrophobicContact CB-CE1 3.84Å; C529-Y531 HydrophobicContact CB-CE2 3.73Å; C529-Y531 HydrophobicContact CB-CG 4.08Å; C529-Y531 WeakPolarHBondContact O-CD2 3.45Å; C529-Y531 PolarHBondContact O-N 3.43Å; Y531-F533 VanDerWaalsContact C-N 3.26Å; Y531-F533 PolarHBondContact O-N 2.68Å; Y531-I534 HydrophobicContact CD1-CD1 3.4Å; Y531-I534 HydrophobicContact CD1-CG1 3.97Å; Y531-I534 HydrophobicContact CE1-CD1 3.75Å; Y531-I534 HydrophobicContact CG-CD1 3.9Å; Y531-I534 HydrophobicContact CG-CG1 4.38Å
532	T	30.3	Very low	39.4	Very low	99 Å²	99	96.7 Å²	96.7	61%	0.607	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	28.8	169.4	60.5	0	0	0	0	112.2	S530	S530-T532 PolarHBondContact O-N 3.21Å
533	F	31.6	Very low	37.7	Very low	191 Å²	191	97.1 Å²	97.1	84%	0.838	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.4	11.2	-177	-142.1	-93	0	0	0	112.7	Y531	Y531-F533 VanDerWaalsContact C-N 3.26Å; Y531-F533 PolarHBondContact O-N 2.68Å
534	I	35.3	Very low	36.2	Very low	61 Å²	61	102 Å²	102	31%	0.313	54%	0.538	S	S	.	.			trans	-121.2	8.3	176.5	-45.2	-174.9	0	0	0	111	Y531 N536 M537 A538	Y531-I534 HydrophobicContact CD1-CD1 3.4Å; Y531-I534 HydrophobicContact CD1-CG1 3.97Å; Y531-I534 HydrophobicContact CE1-CD1 3.75Å; Y531-I534 HydrophobicContact CG-CD1 3.9Å; Y531-I534 HydrophobicContact CG-CG1 4.38Å; I534-N536 PolarHBondContact O-N 3.19Å; I534-M537 HydrophobicContact CG2-CB 4.29Å; I534-M537 PolarHBondContact O-N 3.44Å; I534-A538 HydrophobicContact CG2-CB 4.24Å; I534-A538 PolarHBondContact O-N 2.91Å
535	D	31.8	Very low	34.5	Very low	124 Å²	124	107.8 Å²	107.8	66%	0.663	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-25.1	-177.1	-58.9	13.8	0	0	0	113.5
536	N	33.1	Very low	33.1	Very low	166 Å²	166	113.9 Å²	113.9	89%	0.888	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	5.4	179	-72.6	-17.2	0	0	0	115.3	I534	I534-N536 PolarHBondContact O-N 3.19Å
537	M	29.5	Very low	32	Very low	183 Å²	183	114.3 Å²	114.3	90%	0.901	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.1	-13.5	-179.3	-85.1	-166.9	169.7	0	0	117	I534	I534-M537 HydrophobicContact CG2-CB 4.29Å; I534-M537 PolarHBondContact O-N 3.44Å
538	A	28.8	Very low	31.4	Very low	51 Å²	51	116.3 Å²	116.3	42%	0.421	61%	0.611	S	S	.	*			trans	-150.1	118.4	173.8	0	0	0	0	0	113.4	I534 C540	I534-A538 HydrophobicContact CG2-CB 4.24Å; I534-A538 PolarHBondContact O-N 2.91Å; A538-C540 VanDerWaalsContact C-N 3.35Å; A538-C540 PolarHBondContact O-N 3.19Å
539	K	25.9	Very low	31.4	Very low	156 Å²	156	118 Å²	118	68%	0.678	61%	0.605	S	S	*	*			trans	-69.7	87.9	167	-68.9	-178.6	177.9	178.9	0	109.8	N443	N443-K539 VanDerWaalsContact CG-NZ 3.33Å; N443-K539 PolarHBondContact OD1-NZ 3.23Å
540	C	28.6	Very low	32	Very low	106 Å²	106	120.4 Å²	120.4	72%	0.716	61%	0.611	S	S	*	*			trans	-127.7	74.6	-178	-76.2	0	0	0	0	112.1	A538	A538-C540 VanDerWaalsContact C-N 3.35Å; A538-C540 PolarHBondContact O-N 3.19Å
541	Y	29.9	Very low	33.3	Very low	155 Å²	155	119.1 Å²	119.1	61%	0.608	60%	0.599	S	S	*	*			trans	8.8	110.6	159.7	-65.8	-82.3	0	0	0	118.7	E440	E440-Y541 WeakPolarHBondContact OE1-CE1 3.4Å; E440-Y541 PolarHBondContact OE1-OH 2.83Å
542	H	27.4	Very low	34.7	Very low	176 Å²	176	121.5 Å²	121.5	82%	0.815	61%	0.611	S	S	*	*			trans	-80	110.7	153.8	-113.4	-67.1	0	0	0	109
543	D	31.3	Very low	36.4	Very low	70 Å²	70	117.4 Å²	117.4	37%	0.374	59%	0.585	S	S	.	*			trans	-103.4	153.6	167.1	-173.3	25.8	0	0	0	111.3	N545 Y549	D543-N545 PolarHBondContact O-N 3.35Å; D543-N545 PolarHBondContact OD1-ND2 3.29Å; D543-N545 PolarHBondContact OD2-ND2 2.77Å; D543-Y549 HydrophobicContact CB-CE2 4.01Å; D543-Y549 WeakPolarHBondContact CB-OH 3.44Å
544	V	37.4	Very low	38.1	Very low	108 Å²	108	110.4 Å²	110.4	66%	0.655	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-2.3	-169.6	-158.5	0	0	0	0	112.4
545	N	35.1	Very low	39.6	Very low	123 Å²	123	110.6 Å²	110.6	66%	0.658	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	14.5	-163.3	-68.6	-50.6	0	0	0	116	D543 A547	D543-N545 PolarHBondContact O-N 3.35Å; D543-N545 PolarHBondContact OD1-ND2 3.29Å; D543-N545 PolarHBondContact OD2-ND2 2.77Å; N545-A547 PolarHBondContact O-N 3.34Å; N545-A547 VanDerWaalsContact O-N 3.12Å
546	N	34.5	Very low	41.3	Very low	159 Å²	159	105.4 Å²	105.4	85%	0.85	53%	0.534	S	S	*	.			trans	54.7	24.5	-175.6	-78.6	-21.6	0	0	0	114.7
547	A	30.8	Very low	43.1	Very low	43 Å²	43	97.6 Å²	97.6	36%	0.355	49%	0.492	S	S	.	.			trans	-70.2	142.9	176.9	0	0	0	0	0	111.7	N545 Y549	N545-A547 PolarHBondContact O-N 3.34Å; N545-A547 VanDerWaalsContact O-N 3.12Å; A547-Y549 HydrophobicContact CB-CE2 3.86Å; A547-Y549 VanDerWaalsContact O-CD2 3.31Å; A547-Y549 WeakPolarHBondContact O-CD2 3.3Å; A547-Y549 PolarHBondContact O-N 2.82Å; A547-Y549 VanDerWaalsContact O-N 3.14Å
548	W	33.6	Very low	45.1	Very low	159 Å²	159	91.7 Å²	91.7	60%	0.602	46%	0.464	S	S	*	.			trans	-81.5	92.2	-178.8	-68.8	81.6	0	0	0	111.4	F550	W548-F550 HydrophobicContact CB-CD2 4.21Å; W548-F550 HydrophobicContact CB-CE1 4.26Å; W548-F550 HydrophobicContact CB-CE2 3.59Å; W548-F550 HydrophobicContact CB-CZ 3.62Å; W548-F550 HydrophobicContact CD2-CZ 4.09Å; W548-F550 AromaticContact CE3-CE1 3.85Å; W548-F550 HydrophobicContact CE3-CE1 3.85Å; W548-F550 AromaticContact CE3-CZ 3.84Å; W548-F550 HydrophobicContact CE3-CZ 3.84Å; W548-F550 HydrophobicContact CG-CE2 4.38Å; W548-F550 HydrophobicContact CG-CZ 4.05Å; W548-F550 WeakPolarHBondContact O-CD2 3.38Å; W548-F550 PolarHBondContact O-N 2.98Å
549	Y	32.9	Very low	47	Very low	133 Å²	133	92.6 Å²	92.6	52%	0.522	47%	0.468	S	S	.	.			trans	-75.3	86.9	174.2	-69.1	-77.9	0	0	0	111.7	D543 A547 V551	D543-Y549 HydrophobicContact CB-CE2 4.01Å; D543-Y549 WeakPolarHBondContact CB-OH 3.44Å; A547-Y549 HydrophobicContact CB-CE2 3.86Å; A547-Y549 VanDerWaalsContact O-CD2 3.31Å; A547-Y549 WeakPolarHBondContact O-CD2 3.3Å; A547-Y549 PolarHBondContact O-N 2.82Å; A547-Y549 VanDerWaalsContact O-N 3.14Å; Y549-V551 PolarHBondContact O-N 2.97Å
550	F	45.8	Very low	49	Very low	90 Å²	90	85.4 Å²	85.4	40%	0.395	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-77.7	117.2	173.2	-60.7	-61.7	0	0	0	111.3	W548 K552 F1065 P1080	W548-F550 HydrophobicContact CB-CD2 4.21Å; W548-F550 HydrophobicContact CB-CE1 4.26Å; W548-F550 HydrophobicContact CB-CE2 3.59Å; W548-F550 HydrophobicContact CB-CZ 3.62Å; W548-F550 HydrophobicContact CD2-CZ 4.09Å; W548-F550 AromaticContact CE3-CE1 3.85Å; W548-F550 HydrophobicContact CE3-CE1 3.85Å; W548-F550 AromaticContact CE3-CZ 3.84Å; W548-F550 HydrophobicContact CE3-CZ 3.84Å; W548-F550 HydrophobicContact CG-CE2 4.38Å; W548-F550 HydrophobicContact CG-CZ 4.05Å; W548-F550 WeakPolarHBondContact O-CD2 3.38Å; W548-F550 PolarHBondContact O-N 2.98Å; F550-K552 PolarHBondContact O-N 3.25Å; F550-F1065 AromaticContact CD1-CE1 3.84Å; F550-F1065 HydrophobicContact CD1-CE1 3.84Å; F550-F1065 AromaticContact CE1-CE1 3.67Å; F550-F1065 HydrophobicContact CE1-CE1 3.67Å; F550-F1065 HydrophobicContact CE1-CZ 4.35Å; F550-F1065 HydrophobicContact CG-CE1 4.41Å; F550-F1065 HydrophobicContact CZ-CE1 4.08Å; F550-P1080 HydrophobicContact CZ-CG 4.37Å
551	V	53.5	Low	51	Low	67 Å²	67	82.4 Å²	82.4	41%	0.406	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-56.3	123.3	161.4	-177.3	0	0	0	0	107.8	Y549 H553 F556	Y549-V551 PolarHBondContact O-N 2.97Å; V551-H553 PolarHBondContact O-N 2.97Å; V551-F556 HydrophobicContact CG1-CB 3.96Å
552	K	61.9	Low	53	Low	132 Å²	132	85.2 Å²	85.2	57%	0.574	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-49.7	129.5	178.3	-71.8	-178.2	179.8	179.2	0	109.6	F550 D554 C555 F556	F550-K552 PolarHBondContact O-N 3.25Å; K552-D554 VanDerWaalsContact C-N 3.33Å; K552-D554 PolarHBondContact O-N 3.07Å; K552-C555 HydrophobicContact CB-CB 3.99Å; K552-C555 WeakPolarHBondContact O-CA 3.41Å; K552-C555 WeakPolarHBondContact O-CB 3.35Å; K552-C555 PolarHBondContact O-N 3.24Å; K552-F556 PolarHBondContact O-N 3.31Å
553	H	66	Low	55.1	Low	13 Å²	13	80.2 Å²	80.2	6%	0.06	40%	0.402	C	S	.	.	H	α-helix	trans	-52.4	-50.6	-171.1	-170.7	-83.2	0	0	0	112.2	F523 V551 C555 F556 L557 N1109	F523-H553 AromaticContact CE1-NE2 3.92Å; F523-H553 AromaticContact CZ-CD2 3.69Å; V551-H553 PolarHBondContact O-N 2.97Å; H553-C555 VanDerWaalsContact C-N 3.33Å; H553-C555 PolarHBondContact O-N 3.35Å; H553-F556 PolarHBondContact O-N 3.05Å; H553-L557 WeakPolarHBondContact O-CG 3.19Å; H553-L557 PolarHBondContact O-N 2.96Å; H553-N1109 PolarHBondContact CE1-OD1 3.43Å
554	D	67.9	Low	57.1	Low	44 Å²	44	78 Å²	78	24%	0.235	39%	0.389	C	S	.	.	H	α-helix	trans	-67.8	-29.1	179.5	-52	-86.7	0	0	0	113	K552 N558 K1116	K552-D554 VanDerWaalsContact C-N 3.33Å; K552-D554 PolarHBondContact O-N 3.07Å; D554-N558 WeakPolarHBondContact O-CB 3.26Å; D554-N558 PolarHBondContact O-N 3.13Å; D554-N558 PolarHBondContact O-ND2 2.61Å; D554-K1116 IonicContact OD1-NZ 2.98Å; D554-K1116 PolarHBondContact OD1-NZ 3.19Å
555	C	66	Low	58.6	Low	64 Å²	64	79.3 Å²	79.3	43%	0.432	39%	0.385	S	S	.	.	H	α-helix	trans	-69.5	-40.5	172.9	-62.4	0	0	0	0	111.5	K552 H553 N558 S559	K552-C555 HydrophobicContact CB-CB 3.99Å; K552-C555 WeakPolarHBondContact O-CA 3.41Å; K552-C555 WeakPolarHBondContact O-CB 3.35Å; K552-C555 PolarHBondContact O-N 3.24Å; H553-C555 VanDerWaalsContact C-N 3.33Å; H553-C555 PolarHBondContact O-N 3.35Å; C555-N558 PolarHBondContact O-N 3.49Å; C555-S559 PolarHBondContact O-N 2.9Å; C555-S559 PolarHBondContact O-OG 2.84Å
556	F	68.1	Low	60.3	Low	15 Å²	15	74.9 Å²	74.9	7%	0.066	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-42.2	174.4	-178.2	-89.3	0	0	0	112	F523 V551 K552 H553 S559 T560	F523-F556 HydrophobicContact CB-CD1 3.85Å; F523-F556 HydrophobicContact CB-CD2 4.38Å; F523-F556 HydrophobicContact CB-CE1 3.23Å; F523-F556 HydrophobicContact CB-CE2 3.84Å; F523-F556 HydrophobicContact CB-CG 4.39Å; F523-F556 HydrophobicContact CB-CZ 3.24Å; F523-F556 AromaticContact CD1-CD1 3.51Å; F523-F556 HydrophobicContact CD1-CD1 3.51Å; F523-F556 AromaticContact CD1-CE1 3.58Å; F523-F556 HydrophobicContact CD1-CE1 3.58Å; F523-F556 HydrophobicContact CD1-CG 4.34Å; F523-F556 HydrophobicContact CD1-CZ 4.46Å; F523-F556 HydrophobicContact CD2-CB 3.86Å; F523-F556 AromaticContact CD2-CD1 3.21Å; F523-F556 HydrophobicContact CD2-CD1 3.21Å; F523-F556 AromaticContact CD2-CD2 3.52Å; F523-F556 HydrophobicContact CD2-CD2 3.52Å; F523-F556 AromaticContact CD2-CE1 3.6Å; F523-F556 HydrophobicContact CD2-CE1 3.6Å; F523-F556 AromaticContact CD2-CE2 3.87Å; F523-F556 HydrophobicContact CD2-CE2 3.87Å; F523-F556 AromaticContact CD2-CG 3.18Å; F523-F556 HydrophobicContact CD2-CG 3.18Å; F523-F556 AromaticContact CD2-CZ 3.92Å; F523-F556 HydrophobicContact CD2-CZ 3.92Å; F523-F556 AromaticContact CE1-CD1 3.72Å; F523-F556 HydrophobicContact CE1-CD1 3.72Å; F523-F556 HydrophobicContact CE1-CE1 4.25Å; F523-F556 HydrophobicContact CE1-CG 4.42Å; F523-F556 HydrophobicContact CE2-CB 3.38Å; F523-F556 AromaticContact CE2-CD1 3.43Å; F523-F556 HydrophobicContact CE2-CD1 3.43Å; F523-F556 VanDerWaalsContact CE2-CD1 3.43Å; F523-F556 AromaticContact CE2-CD2 3.99Å; F523-F556 HydrophobicContact CE2-CD2 3.99Å; F523-F556 HydrophobicContact CE2-CE1 4.26Å; F523-F556 AromaticContact CE2-CG 3.28Å; F523-F556 HydrophobicContact CE2-CG 3.28Å; F523-F556 AromaticContact CG-CD1 3.25Å; F523-F556 HydrophobicContact CG-CD1 3.25Å; F523-F556 HydrophobicContact CG-CD2 4.15Å; F523-F556 AromaticContact CG-CE1 3.19Å; F523-F556 HydrophobicContact CG-CE1 3.19Å; F523-F556 HydrophobicContact CG-CE2 4.1Å; F523-F556 AromaticContact CG-CG 3.76Å; F523-F556 HydrophobicContact CG-CG 3.76Å; F523-F556 AromaticContact CG-CZ 3.67Å; F523-F556 HydrophobicContact CG-CZ 3.67Å; F523-F556 HydrophobicContact CZ-CB 3.89Å; F523-F556 AromaticContact CZ-CD1 3.67Å; F523-F556 HydrophobicContact CZ-CD1 3.67Å; F523-F556 AromaticContact CZ-CG 3.92Å; F523-F556 HydrophobicContact CZ-CG 3.92Å; V551-F556 HydrophobicContact CG1-CB 3.96Å; K552-F556 PolarHBondContact O-N 3.31Å; H553-F556 PolarHBondContact O-N 3.05Å; F556-S559 PolarHBondContact O-N 2.84Å; F556-T560 WeakPolarHBondContact CD1-OG1 3.33Å; F556-T560 HydrophobicContact CE1-CG2 4.21Å; F556-T560 WeakPolarHBondContact CE1-OG1 2.84Å; F556-T560 HydrophobicContact CZ-CG2 4.37Å; F556-T560 WeakPolarHBondContact CZ-OG1 3.39Å; F556-T560 WeakPolarHBondContact O-CB 3.42Å; F556-T560 PolarHBondContact O-N 3Å; F556-T560 PolarHBondContact O-OG1 2.85Å
557	L	70.8	Confident	62.1	Low	2 Å²	2	73.5 Å²	73.5	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-57.3	-51.9	174.4	-69.8	178.7	0	0	0	110.8	H553 S559 T560 I561 N1109	H553-L557 WeakPolarHBondContact O-CG 3.19Å; H553-L557 PolarHBondContact O-N 2.96Å; L557-S559 PolarHBondContact O-N 2.64Å; L557-T560 PolarHBondContact O-N 3.49Å; L557-T560 VanDerWaalsContact O-N 3.11Å; L557-I561 HydrophobicContact CB-CD1 4.46Å; L557-I561 WeakPolarHBondContact O-CB 3.13Å; L557-I561 WeakPolarHBondContact O-CD1 3.18Å; L557-I561 WeakPolarHBondContact O-CG1 3.46Å; L557-I561 PolarHBondContact O-N 3.48Å; L557-N1109 HydrophobicContact CD1-CB 4.18Å; L557-N1109 HydrophobicContact CD2-CB 3.93Å
558	N	71.6	Confident	64.2	Low	60 Å²	60	75.4 Å²	75.4	32%	0.321	36%	0.364	S	S	.	.	H	α-helix	trans	-52	-50.2	175.9	-88.8	-74.1	0	0	0	112.5	D554 C555 T560 R562 F1113	D554-N558 WeakPolarHBondContact O-CB 3.26Å; D554-N558 PolarHBondContact O-N 3.13Å; D554-N558 PolarHBondContact O-ND2 2.61Å; C555-N558 PolarHBondContact O-N 3.49Å; N558-T560 VanDerWaalsContact C-N 3.32Å; N558-T560 PolarHBondContact O-N 3.03Å; N558-R562 WeakPolarHBondContact O-CG 3.4Å; N558-R562 PolarHBondContact O-N 3.31Å; N558-F1113 WeakPolarHBondContact OD1-CZ 3.39Å
559	S	67.5	Low	66.5	Low	70 Å²	70	68.2 Å²	68.2	49%	0.49	34%	0.338	S	S	.	.	H	α-helix	trans	-62.7	-38.5	178.8	-63.8	0	0	0	0	112.5	C555 F556 L557 L563	C555-S559 PolarHBondContact O-N 2.9Å; C555-S559 PolarHBondContact O-OG 2.84Å; F556-S559 PolarHBondContact O-N 2.84Å; L557-S559 PolarHBondContact O-N 2.64Å; S559-L563 WeakPolarHBondContact O-CG 3.49Å
560	T	67.6	Low	68.8	Low	4 Å²	4	66.9 Å²	66.9	3%	0.025	34%	0.335	C	S	.	.	H	α-helix	trans	-77.2	-39.1	-175.9	-53.1	0	0	0	0	111.9	N520 F556 L557 N558 R562 L563 F564	N520-T560 HydrophobicContact CB-CG2 3.76Å; F556-T560 WeakPolarHBondContact CD1-OG1 3.33Å; F556-T560 HydrophobicContact CE1-CG2 4.21Å; F556-T560 WeakPolarHBondContact CE1-OG1 2.84Å; F556-T560 HydrophobicContact CZ-CG2 4.37Å; F556-T560 WeakPolarHBondContact CZ-OG1 3.39Å; F556-T560 WeakPolarHBondContact O-CB 3.42Å; F556-T560 PolarHBondContact O-N 3Å; F556-T560 PolarHBondContact O-OG1 2.85Å; L557-T560 PolarHBondContact O-N 3.49Å; L557-T560 VanDerWaalsContact O-N 3.11Å; N558-T560 VanDerWaalsContact C-N 3.32Å; N558-T560 PolarHBondContact O-N 3.03Å; T560-R562 VanDerWaalsContact C-N 3.26Å; T560-R562 PolarHBondContact O-N 3.39Å; T560-L563 WeakPolarHBondContact O-CA 3.09Å; T560-L563 WeakPolarHBondContact O-CB 3.43Å; T560-L563 PolarHBondContact O-N 3.14Å; T560-F564 HydrophobicContact CG2-CD2 4.31Å; T560-F564 HydrophobicContact CG2-CE2 3.89Å; T560-F564 VanDerWaalsContact O-CD2 3.26Å; T560-F564 WeakPolarHBondContact O-CD2 3.09Å; T560-F564 PolarHBondContact O-N 3.07Å
561	I	72.3	Confident	70.5	Confident	44 Å²	44	65.6 Å²	65.6	23%	0.226	33%	0.332	C	S	.	.	H	α-helix	trans	-53.6	-45.1	171.8	-71.5	165.1	0	0	0	110.3	L557 L563 F564 L1110 F1113	L557-I561 HydrophobicContact CB-CD1 4.46Å; L557-I561 WeakPolarHBondContact O-CB 3.13Å; L557-I561 WeakPolarHBondContact O-CD1 3.18Å; L557-I561 WeakPolarHBondContact O-CG1 3.46Å; L557-I561 PolarHBondContact O-N 3.48Å; I561-L563 PolarHBondContact O-N 3.05Å; I561-L563 VanDerWaalsContact O-N 3.15Å; I561-F564 PolarHBondContact O-N 2.89Å; I561-F564 VanDerWaalsContact O-N 3.15Å; I561-L1110 HydrophobicContact CD1-CD2 3.83Å; I561-L1110 HydrophobicContact CG1-CD2 3.44Å; I561-L1110 VanDerWaalsContact CG1-CD2 3.44Å; I561-F1113 HydrophobicContact CD1-CB 4.28Å; I561-F1113 HydrophobicContact CD1-CD1 3.36Å; I561-F1113 HydrophobicContact CD1-CD2 4.13Å; I561-F1113 HydrophobicContact CD1-CE1 3.6Å; I561-F1113 HydrophobicContact CD1-CE2 4.33Å; I561-F1113 HydrophobicContact CD1-CG 3.64Å; I561-F1113 HydrophobicContact CD1-CZ 4.08Å
562	R	71	Confident	71.9	Confident	214 Å²	214	62.4 Å²	62.4	81%	0.808	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.2	175.8	-67.8	171	-179	-157.6	-2.7	114.5	N558 T560	N558-R562 WeakPolarHBondContact O-CG 3.4Å; N558-R562 PolarHBondContact O-N 3.31Å; T560-R562 VanDerWaalsContact C-N 3.26Å; T560-R562 PolarHBondContact O-N 3.39Å
563	L	71.5	Confident	73.1	Confident	71 Å²	71	60.6 Å²	60.6	37%	0.372	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-17.5	176.6	-62.9	172.2	0	0	0	113.1	A516 L519 S559 T560 I561 K565	A516-L563 VanDerWaalsContact CB-C 3.49Å; A516-L563 HydrophobicContact CB-CB 3.65Å; A516-L563 VanDerWaalsContact CB-O 3.25Å; A516-L563 WeakPolarHBondContact CB-O 3.43Å; L519-L563 HydrophobicContact CD1-CD1 3.65Å; S559-L563 WeakPolarHBondContact O-CG 3.49Å; T560-L563 WeakPolarHBondContact O-CA 3.09Å; T560-L563 WeakPolarHBondContact O-CB 3.43Å; T560-L563 PolarHBondContact O-N 3.14Å; I561-L563 PolarHBondContact O-N 3.05Å; I561-L563 VanDerWaalsContact O-N 3.15Å; L563-K565 PolarHBondContact O-N 2.96Å
564	F	74.5	Confident	74.1	Confident	24 Å²	24	62.9 Å²	62.9	11%	0.105	31%	0.312	C	S	.	.			trans	-65.3	100	179.8	-90.7	-91.7	0	0	0	111.5	T560 I561 H566 C572 H575 I576 L1110	T560-F564 HydrophobicContact CG2-CD2 4.31Å; T560-F564 HydrophobicContact CG2-CE2 3.89Å; T560-F564 VanDerWaalsContact O-CD2 3.26Å; T560-F564 WeakPolarHBondContact O-CD2 3.09Å; T560-F564 PolarHBondContact O-N 3.07Å; I561-F564 PolarHBondContact O-N 2.89Å; I561-F564 VanDerWaalsContact O-N 3.15Å; F564-H566 PolarHBondContact O-N 3.29Å; F564-C572 HydrophobicContact CD1-CB 3.7Å; F564-C572 WeakPolarHBondContact CD1-SG 3.33Å; F564-C572 HydrophobicContact CE1-CB 4.41Å; F564-H575 HydrophobicContact CE1-CB 4.17Å; F564-I576 HydrophobicContact CB-CD1 4.28Å; F564-I576 HydrophobicContact CD1-CD1 4.42Å; F564-I576 HydrophobicContact CD1-CG1 4.42Å; F564-L1110 HydrophobicContact CE2-CD1 4.41Å; F564-L1110 HydrophobicContact CZ-CD1 4.22Å
565	K	69	Low	74.9	Confident	134 Å²	134	61.7 Å²	61.7	58%	0.583	31%	0.305	S	S	*	.			trans	-88.8	98.7	174.1	-64.6	-175.5	-179.1	-174.2	0	110.4	L563 D567 S568 C569 C572	L563-K565 PolarHBondContact O-N 2.96Å; K565-D567 PolarHBondContact O-N 3.24Å; K565-S568 VanDerWaalsContact CB-OG 3.25Å; K565-S568 WeakPolarHBondContact CB-OG 3.34Å; K565-S568 PolarHBondContact O-N 3.24Å; K565-C569 PolarHBondContact O-N 3.42Å; K565-C572 WeakPolarHBondContact O-CB 3.36Å
566	H	70.7	Confident	76	Confident	31 Å²	31	58.9 Å²	58.9	14%	0.144	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-38.1	-178.5	69.6	-65.7	0	0	0	113.5	F564 R573 I576 H598 N599	F564-H566 PolarHBondContact O-N 3.29Å; H566-R573 WeakPolarHBondContact O-CB 3.25Å; H566-I576 HydrophobicContact CB-CD1 3.64Å; H566-H598 PolarHBondContact CD2-O 3.46Å; H566-N599 PolarHBondContact NE2-ND2 3.49Å
567	D	70.7	Confident	77.2	Confident	130 Å²	130	59.8 Å²	59.8	70%	0.695	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-41.4	178.4	-52	-63.3	0	0	0	113.2	K565	K565-D567 PolarHBondContact O-N 3.24Å
568	S	75.3	Confident	78.2	Confident	82 Å²	82	60.1 Å²	60.1	57%	0.573	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	4.5	-166.9	88.3	0	0	0	0	114.7	K565	K565-S568 VanDerWaalsContact CB-OG 3.25Å; K565-S568 WeakPolarHBondContact CB-OG 3.34Å; K565-S568 PolarHBondContact O-N 3.24Å
569	C	81.7	Confident	79.2	Confident	8 Å²	8	57.3 Å²	57.3	5%	0.054	28%	0.277	C	S	.	.			trans	-149.1	118.3	176.1	-172.7	0	0	0	0	112.1	C514 K565 N571 C572 R573	C514-C569 HydrophobicContact CB-CB 3.89Å; C514-C569 VanDerWaalsContact SG-SG 3.61Å; K565-C569 PolarHBondContact O-N 3.42Å; C569-N571 VanDerWaalsContact C-N 3.26Å; C569-N571 PolarHBondContact O-N 2.91Å; C569-C572 HydrophobicContact CB-CB 3.97Å; C569-C572 WeakPolarHBondContact O-CB 3.39Å; C569-C572 PolarHBondContact O-N 3.16Å; C569-R573 PolarHBondContact O-N 3.26Å
570	F	82.2	Confident	80.5	Confident	105 Å²	105	54 Å²	54	46%	0.461	25%	0.254	S	S	.	.	H	α-helix	trans	-53.8	-41	177.6	178.8	-106.5	0	0	0	112.9	R573 K574 Y962	F570-R573 PolarHBondContact O-N 3.48Å; F570-K574 PolarHBondContact O-N 2.98Å; F570-Y962 HydrophobicContact CD2-CE1 4.22Å; F570-Y962 AromaticContact CE2-CD1 3.75Å; F570-Y962 HydrophobicContact CE2-CD1 3.75Å; F570-Y962 AromaticContact CE2-CE1 3.59Å; F570-Y962 HydrophobicContact CE2-CE1 3.59Å; F570-Y962 HydrophobicContact CZ-CD1 4.44Å; F570-Y962 HydrophobicContact CZ-CE1 4.48Å
571	N	80.1	Confident	81.9	Confident	64 Å²	64	54.2 Å²	54.2	34%	0.342	26%	0.256	S	S	.	.	H	α-helix	trans	-67.9	-38.8	178	-72.3	-21.4	0	0	0	112.1	C569 H575	C569-N571 VanDerWaalsContact C-N 3.26Å; C569-N571 PolarHBondContact O-N 2.91Å; N571-H575 PolarHBondContact O-N 3.19Å; N571-H575 VanDerWaalsContact O-N 3.14Å; N571-H575 PolarHBondContact O-ND1 3.36Å
572	C	83.3	Confident	83	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-48.7	171.6	-70.2	0	0	0	0	110.9	C514 C517 F564 K565 C569 K574 H575 I576	C514-C572 PolarHBondContact SG-SG 3.33Å; C517-C572 VanDerWaalsContact SG-SG 3.63Å; F564-C572 HydrophobicContact CD1-CB 3.7Å; F564-C572 WeakPolarHBondContact CD1-SG 3.33Å; F564-C572 HydrophobicContact CE1-CB 4.41Å; K565-C572 WeakPolarHBondContact O-CB 3.36Å; C569-C572 HydrophobicContact CB-CB 3.97Å; C569-C572 WeakPolarHBondContact O-CB 3.39Å; C569-C572 PolarHBondContact O-N 3.16Å; C572-K574 VanDerWaalsContact C-N 3.34Å; C572-K574 PolarHBondContact O-N 2.8Å; C572-H575 PolarHBondContact O-N 2.89Å; C572-I576 WeakPolarHBondContact O-CG1 3.2Å; C572-I576 PolarHBondContact O-N 3.49Å
573	R	87.8	Confident	84.2	Confident	94 Å²	94	42.1 Å²	42.1	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-55.9	-46.4	178.6	-158.2	175.7	-179.3	-152.2	-0.4	111.9	H566 C569 F570 Y577 F600	H566-R573 WeakPolarHBondContact O-CB 3.25Å; C569-R573 PolarHBondContact O-N 3.26Å; F570-R573 PolarHBondContact O-N 3.48Å; R573-Y577 WeakPolarHBondContact O-CB 3.38Å; R573-Y577 PolarHBondContact O-N 2.86Å; R573-F600 HydrophobicContact CG-CE1 3.67Å; R573-F600 HydrophobicContact CG-CZ 3.51Å; R573-F600 WeakPolarHBondContact O-CZ 3.41Å
574	K	86.7	Confident	85.4	Confident	60 Å²	60	38.8 Å²	38.8	26%	0.261	19%	0.19	S	C	.	.	H	α-helix	trans	-62.9	-43	178	-179.7	170.1	170.9	170.6	0	113.1	F570 C572 A578 F965 L966	F570-K574 PolarHBondContact O-N 2.98Å; C572-K574 VanDerWaalsContact C-N 3.34Å; C572-K574 PolarHBondContact O-N 2.8Å; K574-A578 PolarHBondContact O-N 2.99Å; K574-A578 VanDerWaalsContact O-N 3.11Å; K574-F965 PolarHBondContact NZ-O 2.94Å; K574-L966 HydrophobicContact CG-CD2 4.22Å
575	H	85.1	Confident	86.4	Confident	20 Å²	20	37.9 Å²	37.9	9%	0.093	19%	0.186	C	C	.	.	H	α-helix	trans	-66.6	-47.2	178.5	-74.3	93.2	0	0	0	112	F564 N571 C572 Y577 A578 V579 Y1102 C1106	F564-H575 HydrophobicContact CE1-CB 4.17Å; N571-H575 PolarHBondContact O-N 3.19Å; N571-H575 VanDerWaalsContact O-N 3.14Å; N571-H575 PolarHBondContact O-ND1 3.36Å; C572-H575 PolarHBondContact O-N 2.89Å; H575-Y577 VanDerWaalsContact C-N 3.29Å; H575-Y577 PolarHBondContact O-N 3.03Å; H575-A578 PolarHBondContact O-N 2.79Å; H575-V579 WeakPolarHBondContact O-CG2 3.38Å; H575-V579 PolarHBondContact O-N 2.8Å; H575-Y1102 AromaticContact NE2-CE1 3.86Å; H575-C1106 PolarHBondContact CD2-SG 2.96Å
576	I	89.6	Confident	87.6	Confident	4 Å²	4	33.9 Å²	33.9	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-44	178.1	-66	166.3	0	0	0	110	F564 H566 C572 A578 V579 G580 Y594 H598 F600	F564-I576 HydrophobicContact CB-CD1 4.28Å; F564-I576 HydrophobicContact CD1-CD1 4.42Å; F564-I576 HydrophobicContact CD1-CG1 4.42Å; H566-I576 HydrophobicContact CB-CD1 3.64Å; C572-I576 WeakPolarHBondContact O-CG1 3.2Å; C572-I576 PolarHBondContact O-N 3.49Å; I576-A578 PolarHBondContact O-N 3.45Å; I576-V579 WeakPolarHBondContact O-CB 3.38Å; I576-V579 PolarHBondContact O-N 3.28Å; I576-G580 PolarHBondContact O-N 3.13Å; I576-Y594 HydrophobicContact CG2-CE1 3.78Å; I576-Y594 WeakPolarHBondContact O-CE1 3.42Å; I576-H598 HydrophobicContact CG2-CB 3.76Å; I576-H598 VanDerWaalsContact CG2-CD2 3.46Å; I576-H598 WeakPolarHBondContact CG2-CD2 3.22Å; I576-F600 HydrophobicContact CB-CE2 4.29Å; I576-F600 HydrophobicContact CG2-CE2 3.68Å; I576-F600 HydrophobicContact CG2-CZ 4.43Å
577	Y	92.7	Very high	88.8	Confident	34 Å²	34	36.1 Å²	36.1	13%	0.133	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-43.9	177.3	-164.6	-106	0	0	0	113	R573 H575 V579 G580 V581 L595 F600 F612 N616 L966	R573-Y577 WeakPolarHBondContact O-CB 3.38Å; R573-Y577 PolarHBondContact O-N 2.86Å; H575-Y577 VanDerWaalsContact C-N 3.29Å; H575-Y577 PolarHBondContact O-N 3.03Å; Y577-V579 VanDerWaalsContact C-N 3.35Å; Y577-V579 PolarHBondContact O-N 3.16Å; Y577-G580 PolarHBondContact O-N 3.43Å; Y577-V581 HydrophobicContact CD1-CG2 4.31Å; Y577-V581 HydrophobicContact CE1-CG2 4.11Å; Y577-V581 WeakPolarHBondContact O-CG2 3.35Å; Y577-V581 PolarHBondContact O-N 3.25Å; Y577-L595 HydrophobicContact CD2-CD2 3.77Å; Y577-L595 HydrophobicContact CE2-CD2 4.09Å; Y577-F600 AromaticContact CD2-CD1 3.36Å; Y577-F600 HydrophobicContact CD2-CD1 3.36Å; Y577-F600 HydrophobicContact CD2-CD2 4.49Å; Y577-F600 AromaticContact CD2-CE1 3.48Å; Y577-F600 HydrophobicContact CD2-CE1 3.48Å; Y577-F600 VanDerWaalsContact CD2-CE1 3.48Å; Y577-F600 AromaticContact CD2-CG 3.9Å; Y577-F600 HydrophobicContact CD2-CG 3.9Å; Y577-F600 HydrophobicContact CD2-CZ 4.13Å; Y577-F600 AromaticContact CE2-CD1 3.82Å; Y577-F600 HydrophobicContact CE2-CD1 3.82Å; Y577-F600 HydrophobicContact CE2-CE1 4.32Å; Y577-F600 HydrophobicContact CE2-CG 4.34Å; Y577-F600 HydrophobicContact CG-CD1 4.4Å; Y577-F600 HydrophobicContact CG-CE1 4.1Å; Y577-F612 HydrophobicContact CE2-CE2 4.25Å; Y577-N616 WeakPolarHBondContact CE1-OD1 3.5Å; Y577-N616 PolarHBondContact OH-ND2 3.26Å; Y577-N616 PolarHBondContact OH-OD1 2.96Å; Y577-L966 HydrophobicContact CD1-CD1 3.89Å; Y577-L966 HydrophobicContact CE1-CD1 3.99Å
578	A	92.1	Very high	89.9	Confident	10 Å²	10	30.5 Å²	30.5	8%	0.083	15%	0.151	C	C	.	.	H	α-helix	trans	-64	-37.4	176.4	0	0	0	0	0	112.7	K574 H575 I576 V581 N582	K574-A578 PolarHBondContact O-N 2.99Å; K574-A578 VanDerWaalsContact O-N 3.11Å; H575-A578 PolarHBondContact O-N 2.79Å; I576-A578 PolarHBondContact O-N 3.45Å; A578-V581 PolarHBondContact O-N 3.06Å; A578-N582 WeakPolarHBondContact O-CB 3.25Å; A578-N582 PolarHBondContact O-N 3.29Å
579	V	92.4	Very high	90.9	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-45.9	171.5	171.4	0	0	0	0	110.6	H575 I576 Y577 V581 N582 L583 Y594 E1107 L1110 V1111 E1114	H575-V579 WeakPolarHBondContact O-CG2 3.38Å; H575-V579 PolarHBondContact O-N 2.8Å; I576-V579 WeakPolarHBondContact O-CB 3.38Å; I576-V579 PolarHBondContact O-N 3.28Å; Y577-V579 VanDerWaalsContact C-N 3.35Å; Y577-V579 PolarHBondContact O-N 3.16Å; V579-V581 PolarHBondContact O-N 3.15Å; V579-N582 PolarHBondContact O-N 3.07Å; V579-L583 HydrophobicContact CG1-CD1 3.86Å; V579-L583 HydrophobicContact CG1-CG 4.35Å; V579-L583 WeakPolarHBondContact O-CB 3.44Å; V579-L583 VanDerWaalsContact O-CG 3.3Å; V579-L583 WeakPolarHBondContact O-CG 3.28Å; V579-L583 PolarHBondContact O-N 3.08Å; V579-Y594 HydrophobicContact CB-CE1 4.04Å; V579-Y594 HydrophobicContact CG1-CD1 4.48Å; V579-Y594 HydrophobicContact CG1-CE1 3.74Å; V579-Y594 HydrophobicContact CG1-CE2 4.3Å; V579-E1107 HydrophobicContact CG2-CG 4.19Å; V579-L1110 HydrophobicContact CG1-CB 4.43Å; V579-L1110 HydrophobicContact CG2-CB 3.65Å; V579-L1110 HydrophobicContact CG2-CD1 3.92Å; V579-L1110 HydrophobicContact CG2-CG 4.46Å; V579-V1111 HydrophobicContact CB-CG2 4.26Å; V579-V1111 HydrophobicContact CG1-CG2 3.87Å; V579-V1111 HydrophobicContact CG2-CG2 4.21Å; V579-E1114 HydrophobicContact CG1-CG 4.48Å
580	G	95.3	Very high	91.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-40.6	176.6	0	0	0	0	0	113.9	I576 Y577 L583 F584	I576-G580 PolarHBondContact O-N 3.13Å; Y577-G580 PolarHBondContact O-N 3.43Å; G580-L583 PolarHBondContact O-N 2.86Å; G580-F584 WeakPolarHBondContact O-CB 3.25Å; G580-F584 PolarHBondContact O-N 3.06Å
581	V	95.9	Very high	92.1	Very high	10 Å²	10	28.3 Å²	28.3	6%	0.061	13%	0.129	C	C	.	.	H	α-helix	trans	-66.8	-40.2	173.9	168.6	0	0	0	0	111.9	Y577 A578 V579 F584 N585 F612 L619	Y577-V581 HydrophobicContact CD1-CG2 4.31Å; Y577-V581 HydrophobicContact CE1-CG2 4.11Å; Y577-V581 WeakPolarHBondContact O-CG2 3.35Å; Y577-V581 PolarHBondContact O-N 3.25Å; A578-V581 PolarHBondContact O-N 3.06Å; V579-V581 PolarHBondContact O-N 3.15Å; V581-F584 PolarHBondContact O-N 3.07Å; V581-N585 WeakPolarHBondContact O-CB 3.36Å; V581-N585 VanDerWaalsContact O-CG 3.31Å; V581-N585 PolarHBondContact O-N 2.96Å; V581-N585 PolarHBondContact O-ND2 3.17Å; V581-F612 HydrophobicContact CG2-CZ 4.43Å; V581-L619 HydrophobicContact CG1-CD2 4.22Å; V581-L619 HydrophobicContact CG2-CD2 4.45Å
582	N	95.5	Very high	92.9	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.011	11%	0.113	C	C	.	.	H	α-helix	trans	-63.2	-46.5	173.7	-171.7	-37.6	0	0	0	111.1	A578 V579 F584 N585 R586 N921 E1107 V1111	A578-N582 WeakPolarHBondContact O-CB 3.25Å; A578-N582 PolarHBondContact O-N 3.29Å; V579-N582 PolarHBondContact O-N 3.07Å; N582-F584 PolarHBondContact O-N 3.49Å; N582-N585 CarbonylContact O-C 3.6Å; N582-N585 PolarHBondContact O-N 2.96Å; N582-R586 WeakPolarHBondContact O-CG 3.08Å; N582-R586 PolarHBondContact O-N 3.49Å; N582-R586 PolarHBondContact OD1-NE 3.32Å; N582-N921 PolarHBondContact ND2-ND2 2.91Å; N582-N921 VanDerWaalsContact ND2-ND2 3.1Å; N582-E1107 PolarHBondContact ND2-OE1 2.99Å; N582-V1111 HydrophobicContact CB-CG2 3.8Å
583	L	95.8	Very high	93.5	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-60.1	-44.2	175.6	-71.7	170.1	0	0	0	111.8	V579 G580 N585 R586 N587 Y594 V1111 E1114 L1115	V579-L583 HydrophobicContact CG1-CD1 3.86Å; V579-L583 HydrophobicContact CG1-CG 4.35Å; V579-L583 WeakPolarHBondContact O-CB 3.44Å; V579-L583 VanDerWaalsContact O-CG 3.3Å; V579-L583 WeakPolarHBondContact O-CG 3.28Å; V579-L583 PolarHBondContact O-N 3.08Å; G580-L583 PolarHBondContact O-N 2.86Å; L583-N585 VanDerWaalsContact C-N 3.34Å; L583-N585 PolarHBondContact O-N 3.16Å; L583-R586 WeakPolarHBondContact O-CB 3.17Å; L583-R586 PolarHBondContact O-N 3.26Å; L583-N587 CarbonylContact O-C 3.36Å; L583-N587 PolarHBondContact O-N 3.37Å; L583-Y594 HydrophobicContact CD1-CD1 3.95Å; L583-Y594 HydrophobicContact CD1-CD2 3.81Å; L583-Y594 HydrophobicContact CD1-CE1 4.46Å; L583-Y594 HydrophobicContact CD1-CE2 4.37Å; L583-Y594 HydrophobicContact CD1-CG 3.58Å; L583-V1111 HydrophobicContact CD2-CG1 4.29Å; L583-E1114 HydrophobicContact CD1-CB 3.86Å; L583-E1114 HydrophobicContact CD1-CG 4.31Å; L583-E1114 HydrophobicContact CD2-CB 4.15Å; L583-L1115 HydrophobicContact CD2-CD2 4.06Å; L583-L1115 HydrophobicContact CD2-CG 4.15Å
584	F	97	Very high	93.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.9	-47.1	174.5	-179	-79.9	0	0	0	111.3	G580 V581 N582 R586 N587 P588 L592 F612 L619 K623 I624 F627	G580-F584 WeakPolarHBondContact O-CB 3.25Å; G580-F584 PolarHBondContact O-N 3.06Å; V581-F584 PolarHBondContact O-N 3.07Å; N582-F584 PolarHBondContact O-N 3.49Å; F584-R586 PolarHBondContact O-N 2.99Å; F584-N587 CarbonylContact O-C 3.6Å; F584-N587 VanDerWaalsContact O-C 3.23Å; F584-N587 PolarHBondContact O-N 3.45Å; F584-P588 HydrophobicContact CD2-CB 3.97Å; F584-P588 HydrophobicContact CE1-CB 4.38Å; F584-P588 HydrophobicContact CE1-CG 4.41Å; F584-P588 HydrophobicContact CE2-CB 3.73Å; F584-P588 HydrophobicContact CG-CB 4.41Å; F584-P588 HydrophobicContact CZ-CB 3.95Å; F584-P588 HydrophobicContact CZ-CG 4.36Å; F584-P588 WeakPolarHBondContact O-CA 3.3Å; F584-P588 WeakPolarHBondContact O-CD 3.36Å; F584-P588 VanDerWaalsContact O-N 3.13Å; F584-L592 HydrophobicContact CD2-CD2 4.13Å; F584-L592 HydrophobicContact CD2-CG 3.98Å; F584-L592 HydrophobicContact CE2-CD1 4.32Å; F584-L592 HydrophobicContact CE2-CD2 4.18Å; F584-L592 HydrophobicContact CE2-CG 4.06Å; F584-F612 HydrophobicContact CD2-CE1 4.01Å; F584-F612 HydrophobicContact CE2-CE1 4.18Å; F584-L619 HydrophobicContact CB-CD2 4.42Å; F584-L619 HydrophobicContact CD1-CD2 3.64Å; F584-L619 HydrophobicContact CE1-CB 4.44Å; F584-L619 HydrophobicContact CE1-CD1 4.42Å; F584-L619 HydrophobicContact CE1-CD2 4.05Å; F584-L619 HydrophobicContact CG-CD2 4.03Å; F584-K623 HydrophobicContact CE1-CB 4.22Å; F584-I624 HydrophobicContact CE1-CG1 4.35Å; F584-F627 HydrophobicContact CZ-CB 4.34Å
585	N	96.2	Very high	94.2	Very high	5 Å²	5	21.6 Å²	21.6	3%	0.027	10%	0.1	C	C	.	.	H	α-helix	trans	-66.7	-16.3	178.7	-72.3	-32	0	0	0	113.1	V581 N582 L583 D618 C620 K623 Q847 P888 H889	V581-N585 WeakPolarHBondContact O-CB 3.36Å; V581-N585 VanDerWaalsContact O-CG 3.31Å; V581-N585 PolarHBondContact O-N 2.96Å; V581-N585 PolarHBondContact O-ND2 3.17Å; N582-N585 CarbonylContact O-C 3.6Å; N582-N585 PolarHBondContact O-N 2.96Å; L583-N585 VanDerWaalsContact C-N 3.34Å; L583-N585 PolarHBondContact O-N 3.16Å; N585-D618 PolarHBondContact ND2-O 2.76Å; N585-C620 PolarHBondContact OD1-N 3.31Å; N585-K623 WeakPolarHBondContact O-CD 3.25Å; N585-K623 VanDerWaalsContact O-CE 3.27Å; N585-K623 WeakPolarHBondContact O-CE 3.34Å; N585-K623 WeakPolarHBondContact O-CG 3.44Å; N585-Q847 PolarHBondContact ND2-NE2 2.87Å; N585-P888 WeakPolarHBondContact O-CB 3.39Å; N585-H889 VanDerWaalsContact CB-CA 3.48Å; N585-H889 HydrophobicContact CB-CB 3.66Å
586	R	94.1	Very high	94.7	Very high	50 Å²	50	21.9 Å²	21.9	19%	0.189	11%	0.105	C	C	.	.	H	α-helix	trans	-85.1	-60.8	166.5	-66.4	175.3	-174.6	-96.3	2.1	110.8	N582 L583 F584 K623 H889	N582-R586 WeakPolarHBondContact O-CG 3.08Å; N582-R586 PolarHBondContact O-N 3.49Å; N582-R586 PolarHBondContact OD1-NE 3.32Å; L583-R586 WeakPolarHBondContact O-CB 3.17Å; L583-R586 PolarHBondContact O-N 3.26Å; F584-R586 PolarHBondContact O-N 2.99Å; R586-K623 WeakPolarHBondContact O-CE 3.36Å; R586-K623 PolarHBondContact O-NZ 2.92Å; R586-H889 HydrophobicContact CG-CB 3.84Å; R586-H889 VanDerWaalsContact CZ-CE1 3.45Å; R586-H889 VanDerWaalsContact CZ-NE2 3.29Å; R586-H889 PolarHBondContact NH1-CE1 2.91Å; R586-H889 PolarHBondContact NH2-CD2 3.46Å; R586-H889 PolarHBondContact NH2-NE2 3.3Å
587	N	94.7	Very high	94.8	Very high	79 Å²	79	30.1 Å²	30.1	42%	0.422	14%	0.136	S	C	.	.			trans	-137.8	113.8	177.3	177.9	-58	0	0	0	108.8	L583 F584 L589 R590 G591	L583-N587 CarbonylContact O-C 3.36Å; L583-N587 PolarHBondContact O-N 3.37Å; F584-N587 CarbonylContact O-C 3.6Å; F584-N587 VanDerWaalsContact O-C 3.23Å; F584-N587 PolarHBondContact O-N 3.45Å; N587-L589 VanDerWaalsContact C-N 3.33Å; N587-L589 PolarHBondContact O-N 3.21Å; N587-L589 PolarHBondContact OD1-N 2.92Å; N587-L589 VanDerWaalsContact OD1-N 3.12Å; N587-R590 HydrophobicContact CB-CB 4Å; N587-R590 PolarHBondContact O-N 2.99Å; N587-R590 VanDerWaalsContact O-N 3.14Å; N587-R590 PolarHBondContact OD1-N 2.83Å; N587-G591 PolarHBondContact O-N 3.23Å
588	P	95.5	Very high	94.7	Very high	11 Å²	11	30.7 Å²	30.7	7%	0.071	14%	0.14	C	C	.	.	H	α-helix	trans	-55.4	-42.7	-174.6	-31.5	37.6	0	0	0	114.5	F584 G591 L592 K623 F627	F584-P588 HydrophobicContact CD2-CB 3.97Å; F584-P588 HydrophobicContact CE1-CB 4.38Å; F584-P588 HydrophobicContact CE1-CG 4.41Å; F584-P588 HydrophobicContact CE2-CB 3.73Å; F584-P588 HydrophobicContact CG-CB 4.41Å; F584-P588 HydrophobicContact CZ-CB 3.95Å; F584-P588 HydrophobicContact CZ-CG 4.36Å; F584-P588 WeakPolarHBondContact O-CA 3.3Å; F584-P588 WeakPolarHBondContact O-CD 3.36Å; F584-P588 VanDerWaalsContact O-N 3.13Å; P588-G591 PolarHBondContact O-N 3.31Å; P588-L592 WeakPolarHBondContact O-CG 3.39Å; P588-L592 PolarHBondContact O-N 3.44Å; P588-K623 HydrophobicContact CG-CB 4.36Å; P588-K623 HydrophobicContact CG-CD 4.39Å; P588-K623 WeakPolarHBondContact CG-O 3.41Å; P588-F627 HydrophobicContact CB-CB 3.69Å; P588-F627 HydrophobicContact CB-CD2 4.01Å; P588-F627 HydrophobicContact CB-CG 4.16Å; P588-F627 HydrophobicContact CG-CB 3.98Å
589	L	94.6	Very high	94.7	Very high	51 Å²	51	35.9 Å²	35.9	27%	0.267	17%	0.166	S	C	.	.	H	α-helix	trans	-66	-42.1	179.1	-61.3	-178.6	0	0	0	111.7	N587 G591 L592 K593 F627 L630 I636	N587-L589 VanDerWaalsContact C-N 3.33Å; N587-L589 PolarHBondContact O-N 3.21Å; N587-L589 PolarHBondContact OD1-N 2.92Å; N587-L589 VanDerWaalsContact OD1-N 3.12Å; L589-G591 VanDerWaalsContact C-N 3.29Å; L589-G591 PolarHBondContact O-N 3Å; L589-L592 PolarHBondContact O-N 2.93Å; L589-K593 WeakPolarHBondContact O-CB 3.4Å; L589-K593 VanDerWaalsContact O-CG 3.32Å; L589-K593 WeakPolarHBondContact O-CG 3.15Å; L589-K593 PolarHBondContact O-N 2.8Å; L589-F627 HydrophobicContact CD2-CD2 4.29Å; L589-F627 HydrophobicContact CD2-CE2 4.14Å; L589-L630 HydrophobicContact CD1-CD1 3.97Å; L589-L630 HydrophobicContact CD2-CD1 3.89Å; L589-L630 HydrophobicContact CG-CD1 3.78Å; L589-I636 HydrophobicContact CD2-CG2 4.07Å
590	R	94.7	Very high	94.7	Very high	99 Å²	99	38 Å²	38	37%	0.374	18%	0.176	S	C	.	.	H	α-helix	trans	-61.4	-39.8	176.1	-161.5	171.7	-172	151.4	10.7	110.9	N587 Y594 E1114 L1115 K1116	N587-R590 HydrophobicContact CB-CB 4Å; N587-R590 PolarHBondContact O-N 2.99Å; N587-R590 VanDerWaalsContact O-N 3.14Å; N587-R590 PolarHBondContact OD1-N 2.83Å; R590-Y594 WeakPolarHBondContact O-CB 3.43Å; R590-Y594 PolarHBondContact O-N 3.07Å; R590-E1114 PolarHBondContact NE-O 3.27Å; R590-E1114 PolarHBondContact NH2-O 3.2Å; R590-L1115 PolarHBondContact NH1-O 3.41Å; R590-L1115 VanDerWaalsContact NH2-C 3.34Å; R590-L1115 PolarHBondContact NH2-O 2.97Å; R590-K1116 PolarHBondContact NH2-OXT 3.29Å
591	G	95.9	Very high	94.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-48.4	174.1	0	0	0	0	0	114.3	N587 P588 L589 Y594 L595	N587-G591 PolarHBondContact O-N 3.23Å; P588-G591 PolarHBondContact O-N 3.31Å; L589-G591 VanDerWaalsContact C-N 3.29Å; L589-G591 PolarHBondContact O-N 3Å; G591-Y594 PolarHBondContact O-N 3.16Å; G591-L595 WeakPolarHBondContact O-CG 3.48Å; G591-L595 PolarHBondContact O-N 3.41Å
592	L	96.6	Very high	94.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.5	-42.9	178.5	-68.5	177	0	0	0	111.9	F584 P588 L589 Y594 L595 A596 L601 L603 V609 F612 F627 I636	F584-L592 HydrophobicContact CD2-CD2 4.13Å; F584-L592 HydrophobicContact CD2-CG 3.98Å; F584-L592 HydrophobicContact CE2-CD1 4.32Å; F584-L592 HydrophobicContact CE2-CD2 4.18Å; F584-L592 HydrophobicContact CE2-CG 4.06Å; P588-L592 WeakPolarHBondContact O-CG 3.39Å; P588-L592 PolarHBondContact O-N 3.44Å; L589-L592 PolarHBondContact O-N 2.93Å; L592-Y594 VanDerWaalsContact C-N 3.32Å; L592-Y594 PolarHBondContact O-N 3.38Å; L592-L595 PolarHBondContact O-N 3.05Å; L592-A596 WeakPolarHBondContact O-CB 3.35Å; L592-A596 PolarHBondContact O-N 2.98Å; L592-L601 HydrophobicContact CD2-CD2 3.92Å; L592-L603 HydrophobicContact CB-CD1 3.65Å; L592-V609 HydrophobicContact CD1-CG1 3.93Å; L592-V609 HydrophobicContact CD2-CG1 4.22Å; L592-F612 HydrophobicContact CD2-CD1 3.88Å; L592-F612 HydrophobicContact CD2-CE1 3.89Å; L592-F627 HydrophobicContact CD1-CD2 4.05Å; L592-F627 HydrophobicContact CD1-CE2 3.52Å; L592-F627 HydrophobicContact CD1-CZ 3.84Å; L592-I636 HydrophobicContact CD1-CD1 3.71Å
593	K	95.3	Very high	94.3	Very high	67 Å²	67	43.1 Å²	43.1	29%	0.291	20%	0.202	S	C	.	.	H	α-helix	trans	-61.7	-38.5	174.6	-68.9	-171.5	-167.7	-146.2	0	112.1	L589 R597 L603 E635	L589-K593 WeakPolarHBondContact O-CB 3.4Å; L589-K593 VanDerWaalsContact O-CG 3.32Å; L589-K593 WeakPolarHBondContact O-CG 3.15Å; L589-K593 PolarHBondContact O-N 2.8Å; K593-R597 VanDerWaalsContact O-CG 3.25Å; K593-R597 WeakPolarHBondContact O-CG 3.36Å; K593-R597 PolarHBondContact O-N 3.46Å; K593-R597 VanDerWaalsContact O-N 3.08Å; K593-L603 HydrophobicContact CG-CD2 3.98Å; K593-E635 WeakPolarHBondContact CE-OE2 3.36Å; K593-E635 IonicContact NZ-OE1 3.79Å; K593-E635 PolarHBondContact NZ-OE1 2.71Å; K593-E635 IonicContact NZ-OE2 3.3Å; K593-E635 PolarHBondContact NZ-OE2 2.7Å
594	Y	94.9	Very high	94.1	Very high	10 Å²	10	47.1 Å²	47.1	4%	0.039	23%	0.23	C	C	.	.	H	α-helix	trans	-66	-45.8	175.1	-179.5	-92.8	0	0	0	112.4	I576 V579 L583 R590 G591 L592 A596 R597 H598 E1114	I576-Y594 HydrophobicContact CG2-CE1 3.78Å; I576-Y594 WeakPolarHBondContact O-CE1 3.42Å; V579-Y594 HydrophobicContact CB-CE1 4.04Å; V579-Y594 HydrophobicContact CG1-CD1 4.48Å; V579-Y594 HydrophobicContact CG1-CE1 3.74Å; V579-Y594 HydrophobicContact CG1-CE2 4.3Å; L583-Y594 HydrophobicContact CD1-CD1 3.95Å; L583-Y594 HydrophobicContact CD1-CD2 3.81Å; L583-Y594 HydrophobicContact CD1-CE1 4.46Å; L583-Y594 HydrophobicContact CD1-CE2 4.37Å; L583-Y594 HydrophobicContact CD1-CG 3.58Å; R590-Y594 WeakPolarHBondContact O-CB 3.43Å; R590-Y594 PolarHBondContact O-N 3.07Å; G591-Y594 PolarHBondContact O-N 3.16Å; L592-Y594 VanDerWaalsContact C-N 3.32Å; L592-Y594 PolarHBondContact O-N 3.38Å; Y594-A596 VanDerWaalsContact C-N 3.32Å; Y594-A596 PolarHBondContact O-N 3.36Å; Y594-R597 PolarHBondContact O-N 2.61Å; Y594-H598 AromaticContact CE1-CD2 3.68Å; Y594-H598 AromaticContact CE2-CD2 3.66Å; Y594-H598 AromaticContact CE2-NE2 3.45Å; Y594-H598 WeakPolarHBondContact CE2-NE2 3.34Å; Y594-H598 AromaticContact CZ-CD2 3.45Å; Y594-H598 VanDerWaalsContact CZ-CD2 3.45Å; Y594-H598 AromaticContact CZ-NE2 3.44Å; Y594-H598 PolarHBondContact O-CD2 2.86Å; Y594-H598 PolarHBondContact O-N 3.02Å; Y594-H598 PolarHBondContact OH-NE2 2.9Å; Y594-E1114 HydrophobicContact CD2-CG 3.99Å; Y594-E1114 WeakPolarHBondContact CD2-OE2 3.32Å; Y594-E1114 HydrophobicContact CE2-CG 3.57Å
595	L	94.8	Very high	94	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-37.3	176.8	-72.7	166	0	0	0	112.3	Y577 G591 L592 H598 N599 F600 L601 F612	Y577-L595 HydrophobicContact CD2-CD2 3.77Å; Y577-L595 HydrophobicContact CE2-CD2 4.09Å; G591-L595 WeakPolarHBondContact O-CG 3.48Å; G591-L595 PolarHBondContact O-N 3.41Å; L592-L595 PolarHBondContact O-N 3.05Å; L595-H598 CarbonylContact O-C 3.54Å; L595-H598 PolarHBondContact O-N 3.08Å; L595-N599 PolarHBondContact O-N 2.67Å; L595-F600 HydrophobicContact CB-CB 4.24Å; L595-F600 HydrophobicContact CD2-CB 4.06Å; L595-F600 HydrophobicContact CD2-CD2 4.12Å; L595-F600 HydrophobicContact CD2-CG 4.13Å; L595-F600 PolarHBondContact O-N 3.2Å; L595-L601 HydrophobicContact CB-CD2 4.01Å; L595-L601 HydrophobicContact CB-CG 4.18Å; L595-L601 HydrophobicContact CD1-CD2 4.2Å; L595-F612 HydrophobicContact CD1-CD2 4.32Å; L595-F612 HydrophobicContact CD1-CE1 4.14Å; L595-F612 HydrophobicContact CD1-CE2 3.49Å; L595-F612 VanDerWaalsContact CD1-CE2 3.49Å; L595-F612 HydrophobicContact CD1-CZ 3.38Å
596	A	94.5	Very high	94	Very high	25 Å²	25	48.4 Å²	48.4	21%	0.207	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-43.7	175.2	0	0	0	0	0	112.6	L592 Y594 H598 N599 L601 L603	L592-A596 WeakPolarHBondContact O-CB 3.35Å; L592-A596 PolarHBondContact O-N 2.98Å; Y594-A596 VanDerWaalsContact C-N 3.32Å; Y594-A596 PolarHBondContact O-N 3.36Å; A596-H598 PolarHBondContact O-N 2.98Å; A596-H598 VanDerWaalsContact O-N 3.13Å; A596-N599 PolarHBondContact O-N 3.17Å; A596-L601 WeakPolarHBondContact CA-O 3.44Å; A596-L601 HydrophobicContact CB-CD1 4.25Å; A596-L603 HydrophobicContact CB-CB 4.07Å
597	R	93.1	Very high	94	Very high	178 Å²	178	52.7 Å²	52.7	67%	0.672	26%	0.26	S	S	*	.	H	α-helix	trans	-59	-23.4	174.1	-72.5	166	-176.6	173.1	-1.1	113.8	K593 Y594	K593-R597 VanDerWaalsContact O-CG 3.25Å; K593-R597 WeakPolarHBondContact O-CG 3.36Å; K593-R597 PolarHBondContact O-N 3.46Å; K593-R597 VanDerWaalsContact O-N 3.08Å; Y594-R597 PolarHBondContact O-N 2.61Å
598	H	90.5	Very high	94	Very high	45 Å²	45	52.5 Å²	52.5	21%	0.208	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	23.6	176.8	-69.7	-65.2	0	0	0	113.3	H566 I576 Y594 L595 A596 F600	H566-H598 PolarHBondContact CD2-O 3.46Å; I576-H598 HydrophobicContact CG2-CB 3.76Å; I576-H598 VanDerWaalsContact CG2-CD2 3.46Å; I576-H598 WeakPolarHBondContact CG2-CD2 3.22Å; Y594-H598 AromaticContact CE1-CD2 3.68Å; Y594-H598 AromaticContact CE2-CD2 3.66Å; Y594-H598 AromaticContact CE2-NE2 3.45Å; Y594-H598 WeakPolarHBondContact CE2-NE2 3.34Å; Y594-H598 AromaticContact CZ-CD2 3.45Å; Y594-H598 VanDerWaalsContact CZ-CD2 3.45Å; Y594-H598 AromaticContact CZ-NE2 3.44Å; Y594-H598 PolarHBondContact O-CD2 2.86Å; Y594-H598 PolarHBondContact O-N 3.02Å; Y594-H598 PolarHBondContact OH-NE2 2.9Å; L595-H598 CarbonylContact O-C 3.54Å; L595-H598 PolarHBondContact O-N 3.08Å; A596-H598 PolarHBondContact O-N 2.98Å; A596-H598 VanDerWaalsContact O-N 3.13Å; H598-F600 HydrophobicContact CB-CD2 3.74Å; H598-F600 HydrophobicContact CB-CE2 3.81Å; H598-F600 WeakPolarHBondContact O-CD2 3.44Å; H598-F600 PolarHBondContact O-N 3.02Å; H598-F600 VanDerWaalsContact O-N 3.12Å
599	N	91.3	Very high	94.1	Very high	119 Å²	119	52 Å²	52	64%	0.636	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	27.7	172.2	-54.9	-48.8	0	0	0	115.3	H566 L595 A596	H566-N599 PolarHBondContact NE2-ND2 3.49Å; L595-N599 PolarHBondContact O-N 2.67Å; A596-N599 PolarHBondContact O-N 3.17Å
600	F	92.1	Very high	94.1	Very high	46 Å²	46	49.7 Å²	49.7	20%	0.202	24%	0.241	C	C	.	.	S	Bend	trans	-85	-23.1	176.2	-75.4	-85	0	0	0	113.8	R573 I576 Y577 L595 H598	R573-F600 HydrophobicContact CG-CE1 3.67Å; R573-F600 HydrophobicContact CG-CZ 3.51Å; R573-F600 WeakPolarHBondContact O-CZ 3.41Å; I576-F600 HydrophobicContact CB-CE2 4.29Å; I576-F600 HydrophobicContact CG2-CE2 3.68Å; I576-F600 HydrophobicContact CG2-CZ 4.43Å; Y577-F600 AromaticContact CD2-CD1 3.36Å; Y577-F600 HydrophobicContact CD2-CD1 3.36Å; Y577-F600 HydrophobicContact CD2-CD2 4.49Å; Y577-F600 AromaticContact CD2-CE1 3.48Å; Y577-F600 HydrophobicContact CD2-CE1 3.48Å; Y577-F600 VanDerWaalsContact CD2-CE1 3.48Å; Y577-F600 AromaticContact CD2-CG 3.9Å; Y577-F600 HydrophobicContact CD2-CG 3.9Å; Y577-F600 HydrophobicContact CD2-CZ 4.13Å; Y577-F600 AromaticContact CE2-CD1 3.82Å; Y577-F600 HydrophobicContact CE2-CD1 3.82Å; Y577-F600 HydrophobicContact CE2-CE1 4.32Å; Y577-F600 HydrophobicContact CE2-CG 4.34Å; Y577-F600 HydrophobicContact CG-CD1 4.4Å; Y577-F600 HydrophobicContact CG-CE1 4.1Å; L595-F600 HydrophobicContact CB-CB 4.24Å; L595-F600 HydrophobicContact CD2-CB 4.06Å; L595-F600 HydrophobicContact CD2-CD2 4.12Å; L595-F600 HydrophobicContact CD2-CG 4.13Å; L595-F600 PolarHBondContact O-N 3.2Å; H598-F600 HydrophobicContact CB-CD2 3.74Å; H598-F600 HydrophobicContact CB-CE2 3.81Å; H598-F600 WeakPolarHBondContact O-CD2 3.44Å; H598-F600 PolarHBondContact O-N 3.02Å; H598-F600 VanDerWaalsContact O-N 3.12Å
601	L	93.7	Very high	94.2	Very high	14 Å²	14	51 Å²	51	7%	0.073	25%	0.25	C	C	.	.	S	Bend	trans	-160.2	151.8	176.9	57.8	89.2	0	0	0	109.9	L592 L595 A596 E608 V609 F612	L592-L601 HydrophobicContact CD2-CD2 3.92Å; L595-L601 HydrophobicContact CB-CD2 4.01Å; L595-L601 HydrophobicContact CB-CG 4.18Å; L595-L601 HydrophobicContact CD1-CD2 4.2Å; A596-L601 WeakPolarHBondContact CA-O 3.44Å; A596-L601 HydrophobicContact CB-CD1 4.25Å; L601-E608 HydrophobicContact CB-CB 4.46Å; L601-V609 HydrophobicContact CD1-CG2 4.36Å; L601-F612 HydrophobicContact CD2-CB 4.11Å; L601-F612 HydrophobicContact CD2-CD1 4.3Å; L601-F612 HydrophobicContact CD2-CD2 4.09Å; L601-F612 HydrophobicContact CD2-CG 3.9Å
602	N	93.2	Very high	94.1	Very high	85 Å²	85	51.8 Å²	51.8	46%	0.455	25%	0.253	S	S	.	.			trans	-84.1	122.7	165.2	-178.3	-7.6	0	0	0	110	S604 S605 E608	N602-S604 VanDerWaalsContact C-N 3.33Å; N602-S604 PolarHBondContact O-N 3.13Å; N602-S604 PolarHBondContact OD1-N 3.3Å; N602-S604 VanDerWaalsContact OD1-N 3.1Å; N602-S605 WeakPolarHBondContact O-CB 3.36Å; N602-S605 PolarHBondContact O-N 3.33Å; N602-S605 VanDerWaalsContact O-N 3.14Å; N602-E608 WeakPolarHBondContact CB-OE2 3.38Å; N602-E608 PolarHBondContact N-OE2 3.32Å
603	L	92.6	Very high	94.1	Very high	20 Å²	20	52 Å²	52	11%	0.105	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-36.2	-176.6	-169.8	68	0	0	0	112.8	L592 K593 A596 S605 E635 I636	L592-L603 HydrophobicContact CB-CD1 3.65Å; K593-L603 HydrophobicContact CG-CD2 3.98Å; A596-L603 HydrophobicContact CB-CB 4.07Å; L603-S605 PolarHBondContact O-N 3.08Å; L603-E635 HydrophobicContact CD2-CB 4.01Å; L603-E635 WeakPolarHBondContact CD2-OE2 3.44Å; L603-I636 HydrophobicContact CD1-CB 4.49Å; L603-I636 HydrophobicContact CD1-CD1 3.85Å; L603-I636 HydrophobicContact CG-CB 4.3Å; L603-I636 HydrophobicContact CG-CD1 4.46Å
604	S	91.5	Very high	93.9	Very high	86 Å²	86	51.5 Å²	51.5	60%	0.601	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.2	178	-49.4	0	0	0	0	113.1	N602 S606	N602-S604 VanDerWaalsContact C-N 3.33Å; N602-S604 PolarHBondContact O-N 3.13Å; N602-S604 PolarHBondContact OD1-N 3.3Å; N602-S604 VanDerWaalsContact OD1-N 3.1Å; S604-S606 PolarHBondContact O-N 3.32Å
605	S	94.4	Very high	93.6	Very high	25 Å²	25	55.2 Å²	55.2	18%	0.175	27%	0.273	C	S	.	.			trans	-96.2	88.5	179.6	-175.2	0	0	0	0	109.9	N602 L603 K607 E608 V609	N602-S605 WeakPolarHBondContact O-CB 3.36Å; N602-S605 PolarHBondContact O-N 3.33Å; N602-S605 VanDerWaalsContact O-N 3.14Å; L603-S605 PolarHBondContact O-N 3.08Å; S605-K607 PolarHBondContact O-N 2.91Å; S605-E608 WeakPolarHBondContact CB-OE1 3.32Å; S605-E608 PolarHBondContact O-N 3.02Å; S605-E608 VanDerWaalsContact OG-CD 3.28Å; S605-E608 WeakPolarHBondContact OG-CG 3.38Å; S605-E608 PolarHBondContact OG-OE1 3.37Å; S605-V609 PolarHBondContact O-N 2.99Å; S605-V609 VanDerWaalsContact O-N 3.07Å
606	S	95.2	Very high	93.4	Very high	7 Å²	7	56 Å²	56	5%	0.049	28%	0.278	C	S	.	.	H	α-helix	trans	-52.3	-29.3	178.2	-55.9	0	0	0	0	113.1	S604 S610 E640	S604-S606 PolarHBondContact O-N 3.32Å; S606-S610 WeakPolarHBondContact O-CB 3.45Å; S606-S610 PolarHBondContact O-N 3.12Å; S606-S610 PolarHBondContact O-OG 3.32Å; S606-E640 VanDerWaalsContact CB-CD 3.42Å; S606-E640 WeakPolarHBondContact CB-OE2 3.31Å; S606-E640 VanDerWaalsContact OG-CD 3.31Å; S606-E640 PolarHBondContact OG-OE2 3.19Å
607	K	95.2	Very high	92.9	Very high	139 Å²	139	57.5 Å²	57.5	60%	0.604	29%	0.29	S	S	*	.	H	α-helix	trans	-73	-27.5	175.1	-66.4	173.3	-176.9	168.6	0	114.2	S605 S610 K611 I644	S605-K607 PolarHBondContact O-N 2.91Å; K607-S610 WeakPolarHBondContact CA-OG 3.37Å; K607-S610 PolarHBondContact O-OG 3.43Å; K607-S610 VanDerWaalsContact O-OG 3.05Å; K607-K611 WeakPolarHBondContact O-CD 3.25Å; K607-K611 VanDerWaalsContact O-CG 3.24Å; K607-K611 WeakPolarHBondContact O-CG 3.22Å; K607-K611 PolarHBondContact O-N 2.94Å; K607-I644 HydrophobicContact CG-CD1 3.97Å
608	E	95.3	Very high	92.6	Very high	75 Å²	75	50.1 Å²	50.1	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-82.6	-41.5	173.5	-75.9	163.5	-117.4	0	0	111	L601 N602 S605 S610 K611 F612	L601-E608 HydrophobicContact CB-CB 4.46Å; N602-E608 WeakPolarHBondContact CB-OE2 3.38Å; N602-E608 PolarHBondContact N-OE2 3.32Å; S605-E608 WeakPolarHBondContact CB-OE1 3.32Å; S605-E608 PolarHBondContact O-N 3.02Å; S605-E608 VanDerWaalsContact OG-CD 3.28Å; S605-E608 WeakPolarHBondContact OG-CG 3.38Å; S605-E608 PolarHBondContact OG-OE1 3.37Å; E608-S610 VanDerWaalsContact C-N 3.3Å; E608-S610 PolarHBondContact O-N 3.38Å; E608-K611 PolarHBondContact O-N 3.43Å; E608-K611 VanDerWaalsContact O-N 3.16Å; E608-F612 PolarHBondContact O-N 2.92Å
609	V	96.5	Very high	92.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-40.5	173.3	-176.4	0	0	0	0	110.7	L592 L601 S605 F612 I613 F627 I636 V641	L592-V609 HydrophobicContact CD1-CG1 3.93Å; L592-V609 HydrophobicContact CD2-CG1 4.22Å; L601-V609 HydrophobicContact CD1-CG2 4.36Å; S605-V609 PolarHBondContact O-N 2.99Å; S605-V609 VanDerWaalsContact O-N 3.07Å; V609-F612 PolarHBondContact O-N 3.14Å; V609-I613 HydrophobicContact CG1-CD1 4.09Å; V609-I613 WeakPolarHBondContact O-CG1 3.24Å; V609-I613 PolarHBondContact O-N 3.27Å; V609-F627 HydrophobicContact CG1-CE1 4.04Å; V609-F627 HydrophobicContact CG1-CZ 3.94Å; V609-I636 HydrophobicContact CG1-CD1 4.25Å; V609-I636 HydrophobicContact CG2-CD1 4.02Å; V609-V641 HydrophobicContact CB-CG1 4.48Å; V609-V641 HydrophobicContact CB-CG2 4.06Å; V609-V641 HydrophobicContact CG1-CG1 4.14Å; V609-V641 HydrophobicContact CG1-CG2 4.14Å
610	S	95.7	Very high	92.9	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.028	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-40.1	174.6	71.9	0	0	0	0	112.6	S606 K607 E608 I613 Q614 I644	S606-S610 WeakPolarHBondContact O-CB 3.45Å; S606-S610 PolarHBondContact O-N 3.12Å; S606-S610 PolarHBondContact O-OG 3.32Å; K607-S610 WeakPolarHBondContact CA-OG 3.37Å; K607-S610 PolarHBondContact O-OG 3.43Å; K607-S610 VanDerWaalsContact O-OG 3.05Å; E608-S610 VanDerWaalsContact C-N 3.3Å; E608-S610 PolarHBondContact O-N 3.38Å; S610-I613 PolarHBondContact O-N 3.11Å; S610-Q614 WeakPolarHBondContact O-CB 3.24Å; S610-Q614 WeakPolarHBondContact O-CG 3.41Å; S610-Q614 PolarHBondContact O-N 3.41Å; S610-I644 WeakPolarHBondContact OG-CG2 3.44Å
611	K	95.2	Very high	93	Very high	126 Å²	126	41.2 Å²	41.2	55%	0.548	22%	0.219	S	C	.	.	H	α-helix	trans	-64.7	-43.3	174.9	-76.3	170	-177.7	178.3	0	111.8	K607 E608 I613 Q614 N615	K607-K611 WeakPolarHBondContact O-CD 3.25Å; K607-K611 VanDerWaalsContact O-CG 3.24Å; K607-K611 WeakPolarHBondContact O-CG 3.22Å; K607-K611 PolarHBondContact O-N 2.94Å; E608-K611 PolarHBondContact O-N 3.43Å; E608-K611 VanDerWaalsContact O-N 3.16Å; K611-I613 VanDerWaalsContact C-N 3.32Å; K611-I613 PolarHBondContact O-N 3.29Å; K611-Q614 PolarHBondContact O-N 3.07Å; K611-Q614 VanDerWaalsContact O-N 3.16Å; K611-N615 PolarHBondContact O-N 2.92Å; K611-N615 PolarHBondContact O-OD1 3.43Å
612	F	95.2	Very high	92.9	Very high	16 Å²	16	42.9 Å²	42.9	7%	0.07	23%	0.232	C	C	.	.	H	α-helix	trans	-56	-46.8	173.8	171.3	-100.6	0	0	0	110.9	Y577 V581 F584 L592 L595 L601 E608 V609 Q614 N616 L619	Y577-F612 HydrophobicContact CE2-CE2 4.25Å; V581-F612 HydrophobicContact CG2-CZ 4.43Å; F584-F612 HydrophobicContact CD2-CE1 4.01Å; F584-F612 HydrophobicContact CE2-CE1 4.18Å; L592-F612 HydrophobicContact CD2-CD1 3.88Å; L592-F612 HydrophobicContact CD2-CE1 3.89Å; L595-F612 HydrophobicContact CD1-CD2 4.32Å; L595-F612 HydrophobicContact CD1-CE1 4.14Å; L595-F612 HydrophobicContact CD1-CE2 3.49Å; L595-F612 VanDerWaalsContact CD1-CE2 3.49Å; L595-F612 HydrophobicContact CD1-CZ 3.38Å; L601-F612 HydrophobicContact CD2-CB 4.11Å; L601-F612 HydrophobicContact CD2-CD1 4.3Å; L601-F612 HydrophobicContact CD2-CD2 4.09Å; L601-F612 HydrophobicContact CD2-CG 3.9Å; E608-F612 PolarHBondContact O-N 2.92Å; V609-F612 PolarHBondContact O-N 3.14Å; F612-Q614 PolarHBondContact O-N 3.37Å; F612-N616 WeakPolarHBondContact CD2-ND2 3.43Å; F612-N616 WeakPolarHBondContact O-CB 3.5Å; F612-N616 PolarHBondContact O-N 2.91Å; F612-N616 PolarHBondContact O-ND2 3.5Å; F612-L619 HydrophobicContact CD1-CD1 4.24Å; F612-L619 HydrophobicContact CE1-CD1 3.8Å; F612-L619 HydrophobicContact CE1-CD2 3.99Å; F612-L619 HydrophobicContact CZ-CD1 4.24Å; F612-L619 HydrophobicContact CZ-CD2 3.82Å
613	I	95.3	Very high	92.9	Very high	6 Å²	6	41.3 Å²	41.3	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-68	-32.4	177.4	-66.7	168.9	0	0	0	112.6	V609 S610 K611 L619 I624 F627 L628 V641 L645 Y667	V609-I613 HydrophobicContact CG1-CD1 4.09Å; V609-I613 WeakPolarHBondContact O-CG1 3.24Å; V609-I613 PolarHBondContact O-N 3.27Å; S610-I613 PolarHBondContact O-N 3.11Å; K611-I613 VanDerWaalsContact C-N 3.32Å; K611-I613 PolarHBondContact O-N 3.29Å; I613-L619 HydrophobicContact CG1-CD1 4.4Å; I613-I624 HydrophobicContact CG2-CD1 4.31Å; I613-I624 HydrophobicContact CG2-CG1 4.45Å; I613-I624 HydrophobicContact CG2-CG2 3.64Å; I613-F627 HydrophobicContact CD1-CD1 3.66Å; I613-F627 HydrophobicContact CD1-CE1 3.64Å; I613-L628 HydrophobicContact CD1-CD2 4.31Å; I613-V641 HydrophobicContact CD1-CG1 4.08Å; I613-L645 HydrophobicContact CB-CD1 4.27Å; I613-L645 HydrophobicContact CB-CD2 4.4Å; I613-L645 HydrophobicContact CD1-CD1 4.17Å; I613-L645 HydrophobicContact CG2-CD1 3.78Å; I613-L645 HydrophobicContact CG2-CD2 4.22Å; I613-Y667 HydrophobicContact CG2-CD1 4.35Å; I613-Y667 HydrophobicContact CG2-CE1 4.31Å
614	Q	91.6	Very high	93.1	Very high	55 Å²	55	40.8 Å²	40.8	26%	0.257	22%	0.218	S	C	.	.	H	α-helix	trans	-72.3	-42.1	178	-78.4	172.4	1.1	0	0	113.2	S610 K611 F612 L645 S648 R666	S610-Q614 WeakPolarHBondContact O-CB 3.24Å; S610-Q614 WeakPolarHBondContact O-CG 3.41Å; S610-Q614 PolarHBondContact O-N 3.41Å; K611-Q614 PolarHBondContact O-N 3.07Å; K611-Q614 VanDerWaalsContact O-N 3.16Å; F612-Q614 PolarHBondContact O-N 3.37Å; Q614-L645 HydrophobicContact CG-CD2 3.63Å; Q614-S648 VanDerWaalsContact NE2-CB 3.28Å; Q614-S648 PolarHBondContact NE2-OG 3.06Å; Q614-R666 PolarHBondContact O-NH2 3.02Å
615	N	89.5	Confident	93.3	Very high	88 Å²	88	36.7 Å²	36.7	47%	0.471	19%	0.189	S	C	.	.	H	α-helix	trans	-82.3	-36.4	-173	-70.8	24.7	0	0	0	113.1	K611 A617 D963	K611-N615 PolarHBondContact O-N 2.92Å; K611-N615 PolarHBondContact O-OD1 3.43Å; N615-A617 PolarHBondContact O-N 2.68Å; N615-A617 VanDerWaalsContact O-N 3.08Å; N615-D963 PolarHBondContact ND2-OD2 3.16Å
616	N	89.2	Confident	93.4	Very high	17 Å²	17	36.1 Å²	36.1	9%	0.091	19%	0.187	C	C	.	.			trans	-81.5	97.3	-169	-74.1	-85.4	0	0	0	113.3	Y577 F612 D618 L619	Y577-N616 WeakPolarHBondContact CE1-OD1 3.5Å; Y577-N616 PolarHBondContact OH-ND2 3.26Å; Y577-N616 PolarHBondContact OH-OD1 2.96Å; F612-N616 WeakPolarHBondContact CD2-ND2 3.43Å; F612-N616 WeakPolarHBondContact O-CB 3.5Å; F612-N616 PolarHBondContact O-N 2.91Å; F612-N616 PolarHBondContact O-ND2 3.5Å; N616-D618 PolarHBondContact O-N 3.09Å; N616-D618 VanDerWaalsContact O-N 3.15Å; N616-L619 HydrophobicContact CB-CD1 3.78Å; N616-L619 HydrophobicContact CB-CD2 4.41Å; N616-L619 HydrophobicContact CB-CG 3.68Å; N616-L619 PolarHBondContact O-N 2.85Å
617	A	85.4	Confident	93.5	Very high	56 Å²	56	35.8 Å²	35.8	46%	0.463	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-1.6	178.2	0	0	0	0	0	115.3	N615 R967	N615-A617 PolarHBondContact O-N 2.68Å; N615-A617 VanDerWaalsContact O-N 3.08Å; A617-R967 VanDerWaalsContact CB-NH2 3.3Å; A617-R967 PolarHBondContact O-NH2 2.81Å
618	D	86.9	Confident	93.5	Very high	24 Å²	24	29.3 Å²	29.3	13%	0.128	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	13.1	-179.7	-63.7	-2.7	0	0	0	112.5	N585 N616 Q847 R967	N585-D618 PolarHBondContact ND2-O 2.76Å; N616-D618 PolarHBondContact O-N 3.09Å; N616-D618 VanDerWaalsContact O-N 3.15Å; D618-Q847 VanDerWaalsContact C-OE1 3.25Å; D618-Q847 VanDerWaalsContact O-CD 3.29Å; D618-Q847 PolarHBondContact O-NE2 3.5Å; D618-Q847 PolarHBondContact O-OE1 2.79Å; D618-R967 IonicContact OD1-CZ 3.24Å; D618-R967 IonicContact OD1-NE 3.46Å; D618-R967 PolarHBondContact OD1-NE 3.07Å; D618-R967 IonicContact OD1-NH2 2.75Å; D618-R967 PolarHBondContact OD1-NH2 2.93Å
619	L	93.9	Very high	93.5	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.016	14%	0.139	C	C	.	.	S	Bend	trans	-83.1	131	166	-59.6	177.5	0	0	0	109.9	V581 F584 F612 I613 N616 R621 I624	V581-L619 HydrophobicContact CG1-CD2 4.22Å; V581-L619 HydrophobicContact CG2-CD2 4.45Å; F584-L619 HydrophobicContact CB-CD2 4.42Å; F584-L619 HydrophobicContact CD1-CD2 3.64Å; F584-L619 HydrophobicContact CE1-CB 4.44Å; F584-L619 HydrophobicContact CE1-CD1 4.42Å; F584-L619 HydrophobicContact CE1-CD2 4.05Å; F584-L619 HydrophobicContact CG-CD2 4.03Å; F612-L619 HydrophobicContact CD1-CD1 4.24Å; F612-L619 HydrophobicContact CE1-CD1 3.8Å; F612-L619 HydrophobicContact CE1-CD2 3.99Å; F612-L619 HydrophobicContact CZ-CD1 4.24Å; F612-L619 HydrophobicContact CZ-CD2 3.82Å; I613-L619 HydrophobicContact CG1-CD1 4.4Å; N616-L619 HydrophobicContact CB-CD1 3.78Å; N616-L619 HydrophobicContact CB-CD2 4.41Å; N616-L619 HydrophobicContact CB-CG 3.68Å; N616-L619 PolarHBondContact O-N 2.85Å; L619-R621 PolarHBondContact O-N 3.41Å; L619-I624 HydrophobicContact CB-CD1 3.92Å; L619-I624 HydrophobicContact CB-CG1 4.01Å
620	C	93.4	Very high	93.4	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.034	15%	0.149	C	C	.	.			trans	-70	128.8	176	179.9	0	0	0	0	110.1	N585 S622 K623 I624 D846 Q847 T848 P888	N585-C620 PolarHBondContact OD1-N 3.31Å; C620-S622 VanDerWaalsContact C-N 3.34Å; C620-S622 PolarHBondContact O-N 3.27Å; C620-K623 HydrophobicContact CB-CB 4.3Å; C620-K623 HydrophobicContact CB-CG 4.26Å; C620-K623 WeakPolarHBondContact O-CA 3.36Å; C620-K623 WeakPolarHBondContact O-CB 3.39Å; C620-K623 PolarHBondContact O-N 3.12Å; C620-I624 PolarHBondContact O-N 3.43Å; C620-D846 WeakPolarHBondContact CA-OD2 3.31Å; C620-D846 PolarHBondContact SG-OD2 2.94Å; C620-D846 VanDerWaalsContact SG-OD2 3.39Å; C620-Q847 VanDerWaalsContact N-NE2 3.18Å; C620-T848 HydrophobicContact CB-CG2 4.11Å; C620-T848 VanDerWaalsContact SG-CG2 3.59Å; C620-P888 HydrophobicContact CB-CB 3.94Å; C620-P888 WeakPolarHBondContact CB-O 3.5Å
621	R	93.2	Very high	93.3	Very high	15 Å²	15	30.1 Å²	30.1	6%	0.057	17%	0.166	C	C	.	.	H	α-helix	trans	-62.1	-40.4	-174.6	-66.7	148	176.2	-89.6	21.3	112	L619 K623 I624 G625 H665 R666 Y667 P843 G844 S845 D846	L619-R621 PolarHBondContact O-N 3.41Å; R621-K623 PolarHBondContact O-N 3.45Å; R621-K623 VanDerWaalsContact O-N 3.16Å; R621-I624 PolarHBondContact O-N 2.92Å; R621-I624 VanDerWaalsContact O-N 3.12Å; R621-G625 PolarHBondContact O-N 3.09Å; R621-H665 PolarHBondContact NH1-O 2.75Å; R621-R666 PolarHBondContact NH1-O 3.23Å; R621-Y667 CarbonylContact C-O 3.44Å; R621-P843 HydrophobicContact CB-CB 4.47Å; R621-G844 WeakPolarHBondContact CD-O 3.32Å; R621-G844 PolarHBondContact NE-O 3.06Å; R621-G844 VanDerWaalsContact NE-O 3.07Å; R621-G844 VanDerWaalsContact NH2-C 3.33Å; R621-S845 VanDerWaalsContact CZ-O 3.28Å; R621-S845 VanDerWaalsContact NE-C 3.31Å; R621-S845 PolarHBondContact NE-O 3.14Å; R621-S845 PolarHBondContact NH2-O 2.99Å; R621-D846 HydrophobicContact CG-CB 4.19Å; R621-D846 PolarHBondContact N-OD2 3.36Å
622	S	91.7	Very high	93.1	Very high	48 Å²	48	27.9 Å²	27.9	34%	0.336	16%	0.164	S	C	.	.	H	α-helix	trans	-57.6	-30.9	173.1	172.5	0	0	0	0	113.2	C620 A626	C620-S622 VanDerWaalsContact C-N 3.34Å; C620-S622 PolarHBondContact O-N 3.27Å; S622-A626 WeakPolarHBondContact O-CB 3.38Å; S622-A626 PolarHBondContact O-N 3.34Å
623	K	95	Very high	92.9	Very high	52 Å²	52	30.4 Å²	30.4	23%	0.226	18%	0.181	C	C	.	.	H	α-helix	trans	-84.1	-28.7	177.9	-68.2	-78.2	170.7	-179.2	0	113.1	F584 N585 R586 P588 C620 R621 F627 P888	F584-K623 HydrophobicContact CE1-CB 4.22Å; N585-K623 WeakPolarHBondContact O-CD 3.25Å; N585-K623 VanDerWaalsContact O-CE 3.27Å; N585-K623 WeakPolarHBondContact O-CE 3.34Å; N585-K623 WeakPolarHBondContact O-CG 3.44Å; R586-K623 WeakPolarHBondContact O-CE 3.36Å; R586-K623 PolarHBondContact O-NZ 2.92Å; P588-K623 HydrophobicContact CG-CB 4.36Å; P588-K623 HydrophobicContact CG-CD 4.39Å; P588-K623 WeakPolarHBondContact CG-O 3.41Å; C620-K623 HydrophobicContact CB-CB 4.3Å; C620-K623 HydrophobicContact CB-CG 4.26Å; C620-K623 WeakPolarHBondContact O-CA 3.36Å; C620-K623 WeakPolarHBondContact O-CB 3.39Å; C620-K623 PolarHBondContact O-N 3.12Å; R621-K623 PolarHBondContact O-N 3.45Å; R621-K623 VanDerWaalsContact O-N 3.16Å; K623-F627 WeakPolarHBondContact O-CB 3.42Å; K623-F627 PolarHBondContact O-N 2.88Å; K623-F627 VanDerWaalsContact O-N 3.09Å; K623-P888 HydrophobicContact CG-CB 3.84Å; K623-P888 HydrophobicContact CG-CG 4.47Å
624	I	96.6	Very high	92.6	Very high	9 Å²	9	38.6 Å²	38.6	5%	0.046	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-53.4	165.6	-56.4	170	0	0	0	109.2	F584 I613 L619 C620 R621 A626 F627 L628 Y667	F584-I624 HydrophobicContact CE1-CG1 4.35Å; I613-I624 HydrophobicContact CG2-CD1 4.31Å; I613-I624 HydrophobicContact CG2-CG1 4.45Å; I613-I624 HydrophobicContact CG2-CG2 3.64Å; L619-I624 HydrophobicContact CB-CD1 3.92Å; L619-I624 HydrophobicContact CB-CG1 4.01Å; C620-I624 PolarHBondContact O-N 3.43Å; R621-I624 PolarHBondContact O-N 2.92Å; R621-I624 VanDerWaalsContact O-N 3.12Å; I624-A626 VanDerWaalsContact C-N 3.33Å; I624-A626 PolarHBondContact O-N 3.05Å; I624-F627 WeakPolarHBondContact O-CB 3.37Å; I624-F627 PolarHBondContact O-N 3.22Å; I624-F627 VanDerWaalsContact O-N 3.09Å; I624-L628 HydrophobicContact CG2-CD1 3.85Å; I624-L628 HydrophobicContact CG2-CG 4.13Å; I624-L628 WeakPolarHBondContact O-CG 3.48Å; I624-L628 PolarHBondContact O-N 3.07Å; I624-Y667 HydrophobicContact CG2-CD1 3.99Å; I624-Y667 HydrophobicContact CG2-CG 4.45Å
625	G	95.2	Very high	92.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-54.9	-44.4	178.2	0	0	0	0	0	113.3	R621 L628 G629 Y667	R621-G625 PolarHBondContact O-N 3.09Å; G625-L628 PolarHBondContact O-N 3.03Å; G625-G629 PolarHBondContact O-N 3.3Å; G625-Y667 PolarHBondContact N-O 3.09Å
626	A	95.4	Very high	92.6	Very high	14 Å²	14	36.4 Å²	36.4	12%	0.116	21%	0.212	C	C	.	.	H	α-helix	trans	-58.6	-49.1	173.1	0	0	0	0	0	112.3	S622 I624 L628 G629 L630	S622-A626 WeakPolarHBondContact O-CB 3.38Å; S622-A626 PolarHBondContact O-N 3.34Å; I624-A626 VanDerWaalsContact C-N 3.33Å; I624-A626 PolarHBondContact O-N 3.05Å; A626-L628 PolarHBondContact O-N 3.33Å; A626-G629 CarbonylContact O-C 3.55Å; A626-G629 PolarHBondContact O-N 2.94Å; A626-G629 VanDerWaalsContact O-N 3.16Å; A626-L630 PolarHBondContact O-N 2.66Å
627	F	97	Very high	92.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-47	177	171.1	-103.2	0	0	0	112.8	F584 P588 L589 L592 V609 I613 K623 I624 G629 L630 I636 P638 V641	F584-F627 HydrophobicContact CZ-CB 4.34Å; P588-F627 HydrophobicContact CB-CB 3.69Å; P588-F627 HydrophobicContact CB-CD2 4.01Å; P588-F627 HydrophobicContact CB-CG 4.16Å; P588-F627 HydrophobicContact CG-CB 3.98Å; L589-F627 HydrophobicContact CD2-CD2 4.29Å; L589-F627 HydrophobicContact CD2-CE2 4.14Å; L592-F627 HydrophobicContact CD1-CD2 4.05Å; L592-F627 HydrophobicContact CD1-CE2 3.52Å; L592-F627 HydrophobicContact CD1-CZ 3.84Å; V609-F627 HydrophobicContact CG1-CE1 4.04Å; V609-F627 HydrophobicContact CG1-CZ 3.94Å; I613-F627 HydrophobicContact CD1-CD1 3.66Å; I613-F627 HydrophobicContact CD1-CE1 3.64Å; K623-F627 WeakPolarHBondContact O-CB 3.42Å; K623-F627 PolarHBondContact O-N 2.88Å; K623-F627 VanDerWaalsContact O-N 3.09Å; I624-F627 WeakPolarHBondContact O-CB 3.37Å; I624-F627 PolarHBondContact O-N 3.22Å; I624-F627 VanDerWaalsContact O-N 3.09Å; F627-G629 PolarHBondContact O-N 2.88Å; F627-L630 HydrophobicContact CD2-CD1 4.11Å; F627-L630 WeakPolarHBondContact O-CB 3.48Å; F627-L630 PolarHBondContact O-N 3.1Å; F627-I636 HydrophobicContact CE2-CD1 3.86Å; F627-I636 HydrophobicContact CZ-CD1 3.74Å; F627-I636 HydrophobicContact CZ-CG1 4.4Å; F627-P638 HydrophobicContact CE1-CB 4.47Å; F627-P638 HydrophobicContact CE2-CB 4.32Å; F627-P638 HydrophobicContact CE2-CG 4.09Å; F627-P638 HydrophobicContact CZ-CB 4.12Å; F627-P638 HydrophobicContact CZ-CG 4.25Å; F627-P638 WeakPolarHBondContact O-CB 3.45Å; F627-V641 HydrophobicContact CE1-CB 4.31Å; F627-V641 HydrophobicContact CE1-CG1 4Å
628	L	96.6	Very high	93.3	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-19.5	179.9	-62.6	-176	0	0	0	113.2	I613 I624 G625 A626 V641 T642 L645 Y667 L679	I613-L628 HydrophobicContact CD1-CD2 4.31Å; I624-L628 HydrophobicContact CG2-CD1 3.85Å; I624-L628 HydrophobicContact CG2-CG 4.13Å; I624-L628 WeakPolarHBondContact O-CG 3.48Å; I624-L628 PolarHBondContact O-N 3.07Å; G625-L628 PolarHBondContact O-N 3.03Å; A626-L628 PolarHBondContact O-N 3.33Å; L628-V641 HydrophobicContact CD2-CG1 4.13Å; L628-T642 VanDerWaalsContact CB-OG1 3.3Å; L628-T642 WeakPolarHBondContact CB-OG1 3.29Å; L628-T642 WeakPolarHBondContact CD2-OG1 3.24Å; L628-T642 PolarHBondContact O-OG1 2.97Å; L628-L645 HydrophobicContact CD1-CD1 3.79Å; L628-L645 HydrophobicContact CD2-CD1 3.56Å; L628-L645 HydrophobicContact CG-CD1 4.31Å; L628-Y667 HydrophobicContact CD1-CD1 4.3Å; L628-Y667 HydrophobicContact CD1-CD2 4.39Å; L628-Y667 HydrophobicContact CD1-CG 3.97Å; L628-L679 HydrophobicContact CB-CD1 4.08Å
629	G	94.6	Very high	93.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	5.5	171.2	0	0	0	0	0	114.9	G625 A626 F627 E675 R678	G625-G629 PolarHBondContact O-N 3.3Å; A626-G629 CarbonylContact O-C 3.55Å; A626-G629 PolarHBondContact O-N 2.94Å; A626-G629 VanDerWaalsContact O-N 3.16Å; F627-G629 PolarHBondContact O-N 2.88Å; G629-E675 WeakPolarHBondContact CA-O 3.28Å; G629-E675 WeakPolarHBondContact O-CA 3.5Å; G629-R678 VanDerWaalsContact O-CZ 3.23Å; G629-R678 PolarHBondContact O-NE 2.97Å; G629-R678 PolarHBondContact O-NH2 3.46Å
630	L	95.1	Very high	93.8	Very high	37 Å²	37	40.8 Å²	40.8	19%	0.194	23%	0.227	C	C	.	.	S	Bend	trans	-76.8	151.3	174.3	-69	177.3	0	0	0	111.8	L589 A626 F627 P638	L589-L630 HydrophobicContact CD1-CD1 3.97Å; L589-L630 HydrophobicContact CD2-CD1 3.89Å; L589-L630 HydrophobicContact CG-CD1 3.78Å; A626-L630 PolarHBondContact O-N 2.66Å; F627-L630 HydrophobicContact CD2-CD1 4.11Å; F627-L630 WeakPolarHBondContact O-CB 3.48Å; F627-L630 PolarHBondContact O-N 3.1Å; L630-P638 HydrophobicContact CB-CB 4.35Å; L630-P638 HydrophobicContact CB-CG 3.9Å
631	P	93.2	Very high	93.9	Very high	60 Å²	60	40.6 Å²	40.6	39%	0.39	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-67.9	158.3	170	31.5	-35.7	0	0	0	111.5
632	P	91.6	Very high	94.1	Very high	79 Å²	79	39.9 Å²	39.9	51%	0.513	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-63.5	151.3	170.4	28.7	-35.4	0	0	0	112
633	T	90.6	Very high	94.3	Very high	69 Å²	69	38.6 Å²	38.6	42%	0.423	21%	0.211	S	C	.	.			trans	-140.7	163	177.3	63	0	0	0	0	109.5	E635 I636	T633-E635 PolarHBondContact O-N 3.17Å; T633-I636 CarbonylContact C-O 3.47Å; T633-I636 PolarHBondContact N-O 3.06Å; T633-I636 CarbonylContact O-C 3.42Å; T633-I636 PolarHBondContact O-N 3.43Å; T633-I636 WeakPolarHBondContact OG1-CG2 3.45Å; T633-I636 PolarHBondContact OG1-N 3.31Å; T633-I636 PolarHBondContact OG1-O 2.87Å
634	D	87.7	Confident	94.3	Very high	178 Å²	178	38.1 Å²	38.1	95%	0.952	21%	0.211	S	C	*	.	S	Bend	trans	-64	-26.7	-177.9	-50.5	-59.1	0	0	0	113.3
635	E	89.6	Confident	94.3	Very high	89 Å²	89	37.7 Å²	37.7	42%	0.416	21%	0.209	S	C	.	.	S	Bend	trans	-81.3	-33.7	176.9	-70.9	-178.7	-133.5	0	0	113.6	K593 L603 T633	K593-E635 WeakPolarHBondContact CE-OE2 3.36Å; K593-E635 IonicContact NZ-OE1 3.79Å; K593-E635 PolarHBondContact NZ-OE1 2.71Å; K593-E635 IonicContact NZ-OE2 3.3Å; K593-E635 PolarHBondContact NZ-OE2 2.7Å; L603-E635 HydrophobicContact CD2-CB 4.01Å; L603-E635 WeakPolarHBondContact CD2-OE2 3.44Å; T633-E635 PolarHBondContact O-N 3.17Å
636	I	92	Very high	94.3	Very high	8 Å²	8	37.8 Å²	37.8	4%	0.041	21%	0.209	C	C	.	.			trans	-156.6	140.6	-172	-173.6	163.2	0	0	0	111.9	L589 L592 L603 V609 F627 T633 P638	L589-I636 HydrophobicContact CD2-CG2 4.07Å; L592-I636 HydrophobicContact CD1-CD1 3.71Å; L603-I636 HydrophobicContact CD1-CB 4.49Å; L603-I636 HydrophobicContact CD1-CD1 3.85Å; L603-I636 HydrophobicContact CG-CB 4.3Å; L603-I636 HydrophobicContact CG-CD1 4.46Å; V609-I636 HydrophobicContact CG1-CD1 4.25Å; V609-I636 HydrophobicContact CG2-CD1 4.02Å; F627-I636 HydrophobicContact CE2-CD1 3.86Å; F627-I636 HydrophobicContact CZ-CD1 3.74Å; F627-I636 HydrophobicContact CZ-CG1 4.4Å; T633-I636 CarbonylContact C-O 3.47Å; T633-I636 PolarHBondContact N-O 3.06Å; T633-I636 CarbonylContact O-C 3.42Å; T633-I636 PolarHBondContact O-N 3.43Å; T633-I636 WeakPolarHBondContact OG1-CG2 3.45Å; T633-I636 PolarHBondContact OG1-N 3.31Å; T633-I636 PolarHBondContact OG1-O 2.87Å; I636-P638 WeakPolarHBondContact O-CD 3.38Å
637	N	94.2	Very high	94.2	Very high	57 Å²	57	43.7 Å²	43.7	31%	0.305	23%	0.232	S	C	.	.			trans	-112.9	91.9	179.1	-176.3	-9.8	0	0	0	111.3	T639 E640 V641	N637-T639 VanDerWaalsContact C-N 3.26Å; N637-T639 PolarHBondContact O-N 3.03Å; N637-T639 WeakPolarHBondContact OD1-CB 3.34Å; N637-T639 PolarHBondContact OD1-N 2.91Å; N637-E640 HydrophobicContact CB-CB 4.22Å; N637-E640 PolarHBondContact O-N 3.26Å; N637-E640 PolarHBondContact OD1-N 2.91Å; N637-E640 VanDerWaalsContact OD1-N 3.12Å; N637-V641 PolarHBondContact O-N 2.93Å
638	P	95.2	Very high	94	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-62.8	-31.4	179.5	-21.3	34.5	0	0	0	112.9	F627 L630 I636 E640 V641 T642	F627-P638 HydrophobicContact CE1-CB 4.47Å; F627-P638 HydrophobicContact CE2-CB 4.32Å; F627-P638 HydrophobicContact CE2-CG 4.09Å; F627-P638 HydrophobicContact CZ-CB 4.12Å; F627-P638 HydrophobicContact CZ-CG 4.25Å; F627-P638 WeakPolarHBondContact O-CB 3.45Å; L630-P638 HydrophobicContact CB-CB 4.35Å; L630-P638 HydrophobicContact CB-CG 3.9Å; I636-P638 WeakPolarHBondContact O-CD 3.38Å; P638-E640 PolarHBondContact O-N 3.43Å; P638-V641 PolarHBondContact O-N 3.11Å; P638-T642 WeakPolarHBondContact O-CB 3.45Å; P638-T642 PolarHBondContact O-N 2.92Å; P638-T642 PolarHBondContact O-OG1 3.27Å
639	T	95.3	Very high	93.8	Very high	48 Å²	48	47.3 Å²	47.3	29%	0.294	26%	0.257	S	S	.	.	H	α-helix	trans	-59.6	-44.6	176	-51.8	0	0	0	0	111.7	N637 T642 M643	N637-T639 VanDerWaalsContact C-N 3.26Å; N637-T639 PolarHBondContact O-N 3.03Å; N637-T639 WeakPolarHBondContact OD1-CB 3.34Å; N637-T639 PolarHBondContact OD1-N 2.91Å; T639-T642 PolarHBondContact O-N 3.42Å; T639-M643 WeakPolarHBondContact O-CG 3.41Å; T639-M643 PolarHBondContact O-N 3.39Å
640	E	95.5	Very high	93.5	Very high	86 Å²	86	52.9 Å²	52.9	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-43.7	175.1	-166.7	-162.2	168.1	0	0	111.5	S606 N637 P638 T642 M643 I644	S606-E640 VanDerWaalsContact CB-CD 3.42Å; S606-E640 WeakPolarHBondContact CB-OE2 3.31Å; S606-E640 VanDerWaalsContact OG-CD 3.31Å; S606-E640 PolarHBondContact OG-OE2 3.19Å; N637-E640 HydrophobicContact CB-CB 4.22Å; N637-E640 PolarHBondContact O-N 3.26Å; N637-E640 PolarHBondContact OD1-N 2.91Å; N637-E640 VanDerWaalsContact OD1-N 3.12Å; P638-E640 PolarHBondContact O-N 3.43Å; E640-T642 VanDerWaalsContact C-N 3.32Å; E640-T642 PolarHBondContact O-N 2.87Å; E640-M643 PolarHBondContact O-N 3.1Å; E640-M643 VanDerWaalsContact O-N 3.16Å; E640-I644 HydrophobicContact CG-CD1 4.09Å; E640-I644 WeakPolarHBondContact O-CG1 3.46Å; E640-I644 PolarHBondContact O-N 2.89Å
641	V	97.1	Very high	93.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-45.1	175.8	-179.9	0	0	0	0	110.7	V609 I613 F627 L628 N637 P638 M643 I644 L645	V609-V641 HydrophobicContact CB-CG1 4.48Å; V609-V641 HydrophobicContact CB-CG2 4.06Å; V609-V641 HydrophobicContact CG1-CG1 4.14Å; V609-V641 HydrophobicContact CG1-CG2 4.14Å; I613-V641 HydrophobicContact CD1-CG1 4.08Å; F627-V641 HydrophobicContact CE1-CB 4.31Å; F627-V641 HydrophobicContact CE1-CG1 4Å; L628-V641 HydrophobicContact CD2-CG1 4.13Å; N637-V641 PolarHBondContact O-N 2.93Å; P638-V641 PolarHBondContact O-N 3.11Å; V641-M643 PolarHBondContact O-N 3.46Å; V641-I644 PolarHBondContact O-N 2.98Å; V641-L645 HydrophobicContact CG1-CD1 3.96Å; V641-L645 HydrophobicContact CG1-CG 4.29Å; V641-L645 WeakPolarHBondContact O-CB 3.47Å; V641-L645 VanDerWaalsContact O-CG 3.25Å; V641-L645 WeakPolarHBondContact O-CG 3.37Å; V641-L645 PolarHBondContact O-N 3.27Å
642	T	96.6	Very high	92.8	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-46	174.9	-61.4	0	0	0	0	111	L628 P638 T639 E640 I644 L645 L646 L679 C682	L628-T642 VanDerWaalsContact CB-OG1 3.3Å; L628-T642 WeakPolarHBondContact CB-OG1 3.29Å; L628-T642 WeakPolarHBondContact CD2-OG1 3.24Å; L628-T642 PolarHBondContact O-OG1 2.97Å; P638-T642 WeakPolarHBondContact O-CB 3.45Å; P638-T642 PolarHBondContact O-N 2.92Å; P638-T642 PolarHBondContact O-OG1 3.27Å; T639-T642 PolarHBondContact O-N 3.42Å; E640-T642 VanDerWaalsContact C-N 3.32Å; E640-T642 PolarHBondContact O-N 2.87Å; T642-I644 PolarHBondContact O-N 3.22Å; T642-L645 PolarHBondContact O-N 2.97Å; T642-L646 HydrophobicContact CG2-CD1 3.84Å; T642-L646 HydrophobicContact CG2-CG 4.2Å; T642-L646 WeakPolarHBondContact O-CB 3.49Å; T642-L646 VanDerWaalsContact O-CG 3.25Å; T642-L646 WeakPolarHBondContact O-CG 3.29Å; T642-L646 PolarHBondContact O-N 3.29Å; T642-L679 HydrophobicContact CG2-CD1 3.75Å; T642-C682 HydrophobicContact CG2-CB 3.49Å; T642-C682 VanDerWaalsContact CG2-CB 3.49Å
643	M	95.7	Very high	92.4	Very high	20 Å²	20	51.7 Å²	51.7	10%	0.099	30%	0.297	C	S	.	.	H	α-helix	trans	-68.5	-33.2	179.1	-69.6	-62.7	-87.3	0	0	113.4	T639 E640 V641 L646 K647 C682 E685	T639-M643 WeakPolarHBondContact O-CG 3.41Å; T639-M643 PolarHBondContact O-N 3.39Å; E640-M643 PolarHBondContact O-N 3.1Å; E640-M643 VanDerWaalsContact O-N 3.16Å; V641-M643 PolarHBondContact O-N 3.46Å; M643-L646 HydrophobicContact SD-CD1 4.18Å; M643-K647 WeakPolarHBondContact O-CB 3.34Å; M643-K647 WeakPolarHBondContact O-CD 3.44Å; M643-K647 WeakPolarHBondContact O-CG 3.46Å; M643-K647 PolarHBondContact O-N 3.04Å; M643-C682 HydrophobicContact SD-CB 3.92Å; M643-E685 HydrophobicContact CE-CB 4.22Å; M643-E685 VanDerWaalsContact CE-CD 3.41Å; M643-E685 HydrophobicContact CE-CG 4Å; M643-E685 VanDerWaalsContact CE-OE1 3.24Å; M643-E685 WeakPolarHBondContact CE-OE1 3.43Å
644	I	96	Very high	92.5	Very high	43 Å²	43	50.6 Å²	50.6	22%	0.221	29%	0.288	C	S	.	.	H	α-helix	trans	-67.5	-42.2	171.6	-64.9	162.6	0	0	0	110.7	K607 S610 E640 V641 T642 K647 S648	K607-I644 HydrophobicContact CG-CD1 3.97Å; S610-I644 WeakPolarHBondContact OG-CG2 3.44Å; E640-I644 HydrophobicContact CG-CD1 4.09Å; E640-I644 WeakPolarHBondContact O-CG1 3.46Å; E640-I644 PolarHBondContact O-N 2.89Å; V641-I644 PolarHBondContact O-N 2.98Å; T642-I644 PolarHBondContact O-N 3.22Å; I644-K647 PolarHBondContact O-N 3.45Å; I644-S648 PolarHBondContact O-N 3.04Å
645	L	96.4	Very high	92.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.8	-45.6	177.4	-74.6	177.5	0	0	0	112	I613 Q614 L628 V641 T642 K647 S648 Y667	I613-L645 HydrophobicContact CB-CD1 4.27Å; I613-L645 HydrophobicContact CB-CD2 4.4Å; I613-L645 HydrophobicContact CD1-CD1 4.17Å; I613-L645 HydrophobicContact CG2-CD1 3.78Å; I613-L645 HydrophobicContact CG2-CD2 4.22Å; Q614-L645 HydrophobicContact CG-CD2 3.63Å; L628-L645 HydrophobicContact CD1-CD1 3.79Å; L628-L645 HydrophobicContact CD2-CD1 3.56Å; L628-L645 HydrophobicContact CG-CD1 4.31Å; V641-L645 HydrophobicContact CG1-CD1 3.96Å; V641-L645 HydrophobicContact CG1-CG 4.29Å; V641-L645 WeakPolarHBondContact O-CB 3.47Å; V641-L645 VanDerWaalsContact O-CG 3.25Å; V641-L645 WeakPolarHBondContact O-CG 3.37Å; V641-L645 PolarHBondContact O-N 3.27Å; T642-L645 PolarHBondContact O-N 2.97Å; L645-K647 PolarHBondContact O-N 3.2Å; L645-S648 WeakPolarHBondContact O-CB 3.36Å; L645-S648 PolarHBondContact O-N 3.37Å; L645-S648 PolarHBondContact O-OG 3.42Å; L645-Y667 HydrophobicContact CB-CE1 4.27Å; L645-Y667 HydrophobicContact CB-CE2 4.09Å; L645-Y667 HydrophobicContact CD1-CD1 4.48Å; L645-Y667 HydrophobicContact CD1-CE1 4.08Å; L645-Y667 HydrophobicContact CD2-CE1 4.01Å; L645-Y667 HydrophobicContact CG-CE1 4.36Å; L645-Y667 PolarHBondContact O-OH 3.2Å; L645-Y667 VanDerWaalsContact O-OH 3.14Å
646	L	95.3	Very high	93	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-43.1	175.8	-72.1	175.7	0	0	0	111.5	T642 M643 S648 L649 V663 C682 V683 Y686	T642-L646 HydrophobicContact CG2-CD1 3.84Å; T642-L646 HydrophobicContact CG2-CG 4.2Å; T642-L646 WeakPolarHBondContact O-CB 3.49Å; T642-L646 VanDerWaalsContact O-CG 3.25Å; T642-L646 WeakPolarHBondContact O-CG 3.29Å; T642-L646 PolarHBondContact O-N 3.29Å; M643-L646 HydrophobicContact SD-CD1 4.18Å; L646-S648 PolarHBondContact O-N 3.41Å; L646-S648 VanDerWaalsContact O-N 3.08Å; L646-L649 HydrophobicContact CD2-CD1 4.41Å; L646-L649 WeakPolarHBondContact O-CB 3.39Å; L646-L649 PolarHBondContact O-N 3.16Å; L646-V663 HydrophobicContact CD2-CG1 4.29Å; L646-V663 HydrophobicContact CD2-CG2 3.71Å; L646-C682 HydrophobicContact CD1-CB 3.84Å; L646-C682 WeakPolarHBondContact CD1-O 3.42Å; L646-V683 HydrophobicContact CD1-CG2 4.07Å; L646-V683 HydrophobicContact CD2-CG2 4Å; L646-Y686 VanDerWaalsContact C-CE1 3.45Å; L646-Y686 HydrophobicContact CB-CD1 3.62Å; L646-Y686 HydrophobicContact CB-CE1 4.17Å; L646-Y686 HydrophobicContact CB-CG 4.13Å; L646-Y686 WeakPolarHBondContact O-CE1 3.44Å
647	K	93.8	Very high	93.1	Very high	137 Å²	137	40.3 Å²	40.3	60%	0.596	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-13.8	173	-74.9	168.1	-176.6	174.2	0	114.5	M643 I644 L645 Y686	M643-K647 WeakPolarHBondContact O-CB 3.34Å; M643-K647 WeakPolarHBondContact O-CD 3.44Å; M643-K647 WeakPolarHBondContact O-CG 3.46Å; M643-K647 PolarHBondContact O-N 3.04Å; I644-K647 PolarHBondContact O-N 3.45Å; L645-K647 PolarHBondContact O-N 3.2Å; K647-Y686 HydrophobicContact CB-CE2 4.45Å; K647-Y686 HydrophobicContact CG-CD2 3.99Å; K647-Y686 HydrophobicContact CG-CE2 3.58Å
648	S	92.5	Very high	93.2	Very high	62 Å²	62	41.4 Å²	41.4	43%	0.434	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-6.7	171.5	77.1	0	0	0	0	114.3	Q614 I644 L645 L646 Y667	Q614-S648 VanDerWaalsContact NE2-CB 3.28Å; Q614-S648 PolarHBondContact NE2-OG 3.06Å; I644-S648 PolarHBondContact O-N 3.04Å; L645-S648 WeakPolarHBondContact O-CB 3.36Å; L645-S648 PolarHBondContact O-N 3.37Å; L645-S648 PolarHBondContact O-OG 3.42Å; L646-S648 PolarHBondContact O-N 3.41Å; L646-S648 VanDerWaalsContact O-N 3.08Å; S648-Y667 PolarHBondContact OG-OH 2.96Å
649	L	91.2	Very high	93.2	Very high	17 Å²	17	41.4 Å²	41.4	9%	0.089	24%	0.238	C	C	.	.	S	Bend	trans	-96.6	128.1	174	-60.7	-176.9	0	0	0	110.6	L646 I651 L662 V663 R666 Y667	L646-L649 HydrophobicContact CD2-CD1 4.41Å; L646-L649 WeakPolarHBondContact O-CB 3.39Å; L646-L649 PolarHBondContact O-N 3.16Å; L649-I651 HydrophobicContact CB-CG2 4.13Å; L649-I651 PolarHBondContact O-N 2.8Å; L649-L662 HydrophobicContact CB-CD2 4.23Å; L649-L662 HydrophobicContact CD1-CG 4.37Å; L649-L662 HydrophobicContact CD2-CG 4.49Å; L649-V663 HydrophobicContact CD1-CG2 3.96Å; L649-R666 HydrophobicContact CD2-CB 4.27Å; L649-R666 HydrophobicContact CD2-CG 4.19Å; L649-Y667 HydrophobicContact CD1-CD2 4.4Å; L649-Y667 HydrophobicContact CD1-CE2 3.72Å; L649-Y667 HydrophobicContact CD2-CE2 4.42Å; L649-Y667 HydrophobicContact CG-CE2 4.13Å
650	N	88.2	Confident	93.2	Very high	117 Å²	117	39.2 Å²	39.2	63%	0.626	22%	0.224	S	C	*	.			trans	-75.6	89.5	166.4	-174.9	15.2	0	0	0	110.3	S652	N650-S652 WeakPolarHBondContact OD1-CB 3.46Å; N650-S652 PolarHBondContact OD1-N 3.21Å; N650-S652 PolarHBondContact OD1-OG 2.81Å
651	I	89.3	Confident	93.2	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	21%	0.209	C	C	.	.			trans	-95.6	1.6	168.2	67	178.3	0	0	0	113	L649 G653 L654 A659 L662 Y686 Y687	L649-I651 HydrophobicContact CB-CG2 4.13Å; L649-I651 PolarHBondContact O-N 2.8Å; I651-G653 PolarHBondContact O-N 3.35Å; I651-L654 HydrophobicContact CB-CD1 4.43Å; I651-L654 PolarHBondContact O-N 2.87Å; I651-A659 HydrophobicContact CB-CB 4.13Å; I651-A659 HydrophobicContact CG2-CB 4.25Å; I651-L662 HydrophobicContact CG2-CD2 4.09Å; I651-Y686 HydrophobicContact CD1-CD1 3.33Å; I651-Y686 HydrophobicContact CD1-CE1 3.43Å; I651-Y686 VanDerWaalsContact CD1-CE1 3.43Å; I651-Y686 HydrophobicContact CD1-CG 4.34Å; I651-Y686 HydrophobicContact CG1-CD1 4.11Å; I651-Y686 HydrophobicContact CG1-CE1 3.67Å; I651-Y687 HydrophobicContact CD1-CD2 4.09Å
652	S	84.4	Confident	93.1	Very high	65 Å²	65	38.6 Å²	38.6	46%	0.455	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	135.3	179.8	73	0	0	0	0	110.8	N650 L654	N650-S652 WeakPolarHBondContact OD1-CB 3.46Å; N650-S652 PolarHBondContact OD1-N 3.21Å; N650-S652 PolarHBondContact OD1-OG 2.81Å; S652-L654 PolarHBondContact O-N 3.48Å
653	G	84.9	Confident	93	Very high	81 Å²	81	38.6 Å²	38.6	84%	0.835	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.5	-9.2	-176.1	0	0	0	0	0	116.3	I651	I651-G653 PolarHBondContact O-N 3.35Å
654	L	92.6	Very high	92.9	Very high	47 Å²	47	37.9 Å²	37.9	25%	0.246	22%	0.218	C	C	.	.			trans	-73.2	153.4	177.9	-60.9	-172.4	0	0	0	112.3	I651 S652 E658 A659 L662 Y687 R691	I651-L654 HydrophobicContact CB-CD1 4.43Å; I651-L654 PolarHBondContact O-N 2.87Å; S652-L654 PolarHBondContact O-N 3.48Å; L654-E658 HydrophobicContact CB-CB 4.23Å; L654-A659 HydrophobicContact CB-CB 4.18Å; L654-L662 HydrophobicContact CD1-CD2 4.22Å; L654-Y687 PolarHBondContact O-OH 3.29Å; L654-Y687 VanDerWaalsContact O-OH 3.11Å; L654-R691 PolarHBondContact O-NH1 2.89Å
655	E	92.9	Very high	92.8	Very high	55 Å²	55	38 Å²	38	26%	0.257	22%	0.218	S	C	.	.			trans	-79.4	163	167.8	-58.9	-142.7	105	0	0	111.8	D657 E658 A659 R835	E655-D657 PolarHBondContact O-N 2.83Å; E655-E658 WeakPolarHBondContact O-CA 3.49Å; E655-E658 PolarHBondContact O-N 3.15Å; E655-A659 PolarHBondContact O-N 2.94Å; E655-R835 IonicContact OE2-CZ 2.99Å; E655-R835 IonicContact OE2-NH1 3.93Å; E655-R835 PolarHBondContact OE2-NH1 3.46Å; E655-R835 IonicContact OE2-NH2 2.76Å; E655-R835 PolarHBondContact OE2-NH2 2.88Å
656	V	93.8	Very high	92.7	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-56.7	-42.3	-171.6	-73.6	0	0	0	0	113.5	E658 L660 Y687 L724 I727 F728 I731 F824 I832	V656-E658 VanDerWaalsContact C-N 3.32Å; V656-E658 PolarHBondContact O-N 3.45Å; V656-L660 VanDerWaalsContact O-CB 3.28Å; V656-L660 WeakPolarHBondContact O-CB 3.49Å; V656-L660 PolarHBondContact O-N 2.83Å; V656-Y687 HydrophobicContact CG1-CE1 3.62Å; V656-Y687 WeakPolarHBondContact CG1-OH 3.46Å; V656-Y687 PolarHBondContact N-OH 3.31Å; V656-L724 HydrophobicContact CG1-CD1 3.94Å; V656-I727 HydrophobicContact CG2-CG2 4.2Å; V656-F728 HydrophobicContact CB-CD1 4.47Å; V656-F728 HydrophobicContact CB-CE1 4.02Å; V656-F728 HydrophobicContact CG1-CE1 4.31Å; V656-F728 HydrophobicContact CG1-CZ 4.47Å; V656-F728 WeakPolarHBondContact O-CE1 3.16Å; V656-I731 HydrophobicContact CB-CD1 4.12Å; V656-I731 HydrophobicContact CG2-CD1 3.67Å; V656-F824 HydrophobicContact CG1-CE1 4.24Å; V656-F824 HydrophobicContact CG1-CZ 4.04Å; V656-F824 HydrophobicContact CG2-CE1 3.97Å; V656-I832 HydrophobicContact CG2-CD1 3.72Å; V656-I832 HydrophobicContact CG2-CG1 4.49Å
657	D	95	Very high	92.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-74.4	-24.2	177.9	77.1	-70.5	0	0	0	112.7	E655 R661 I731 I832 R835 I836	E655-D657 PolarHBondContact O-N 2.83Å; D657-R661 WeakPolarHBondContact O-CB 3.16Å; D657-R661 PolarHBondContact O-N 2.87Å; D657-R661 IonicContact OD2-CZ 2.86Å; D657-R661 IonicContact OD2-NH2 4Å; D657-R661 PolarHBondContact OD2-NH2 3.35Å; D657-I731 HydrophobicContact CB-CD1 4.27Å; D657-I731 HydrophobicContact CB-CG2 4.27Å; D657-I832 HydrophobicContact CB-CG2 4.24Å; D657-R835 IonicContact OD1-CZ 3.23Å; D657-R835 VanDerWaalsContact OD1-CZ 3.24Å; D657-R835 IonicContact OD1-NE 2.95Å; D657-R835 PolarHBondContact OD1-NE 3.04Å; D657-R835 IonicContact OD1-NH2 2.69Å; D657-R835 PolarHBondContact OD1-NH2 3.18Å; D657-R835 WeakPolarHBondContact OD2-CB 3.32Å; D657-R835 IonicContact OD2-NE 2.64Å; D657-R835 PolarHBondContact OD2-NE 2.91Å; D657-I836 HydrophobicContact CB-CD1 4.04Å; D657-I836 HydrophobicContact CB-CG1 4.36Å
658	E	94.9	Very high	92.6	Very high	80 Å²	80	35.1 Å²	35.1	37%	0.374	20%	0.204	S	C	.	.	H	α-helix	trans	-80.9	-40.5	177.9	-60.7	-161	136.1	0	0	112.2	L654 E655 V656 R661 L662	L654-E658 HydrophobicContact CB-CB 4.23Å; E655-E658 WeakPolarHBondContact O-CA 3.49Å; E655-E658 PolarHBondContact O-N 3.15Å; V656-E658 VanDerWaalsContact C-N 3.32Å; V656-E658 PolarHBondContact O-N 3.45Å; E658-R661 PolarHBondContact O-N 3.18Å; E658-L662 PolarHBondContact O-N 2.9Å
659	A	95.3	Very high	92.5	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-48.9	170.6	0	0	0	0	0	111	I651 L654 E655 R661 L662 V663 Y687	I651-A659 HydrophobicContact CB-CB 4.13Å; I651-A659 HydrophobicContact CG2-CB 4.25Å; L654-A659 HydrophobicContact CB-CB 4.18Å; E655-A659 PolarHBondContact O-N 2.94Å; A659-R661 VanDerWaalsContact C-N 3.33Å; A659-R661 PolarHBondContact O-N 3.37Å; A659-L662 PolarHBondContact O-N 3.45Å; A659-L662 VanDerWaalsContact O-N 3.16Å; A659-V663 WeakPolarHBondContact O-CG2 3.21Å; A659-V663 PolarHBondContact O-N 3.4Å; A659-V663 VanDerWaalsContact O-N 3.09Å; A659-Y687 HydrophobicContact CB-CD2 3.62Å; A659-Y687 HydrophobicContact CB-CE2 3.56Å
660	L	95.9	Very high	92.6	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-59.3	-44.5	174.4	-177.5	63.8	0	0	0	111.1	V656 L662 V663 V664 L680 F728 I731 L732 L841	V656-L660 VanDerWaalsContact O-CB 3.28Å; V656-L660 WeakPolarHBondContact O-CB 3.49Å; V656-L660 PolarHBondContact O-N 2.83Å; L660-L662 VanDerWaalsContact C-N 3.3Å; L660-L662 PolarHBondContact O-N 3.35Å; L660-V663 PolarHBondContact O-N 2.94Å; L660-V664 HydrophobicContact CD1-CG2 4.32Å; L660-V664 HydrophobicContact CG-CG2 4.37Å; L660-V664 WeakPolarHBondContact O-CG2 3.47Å; L660-V664 PolarHBondContact O-N 2.69Å; L660-L680 HydrophobicContact CD1-CD1 4.15Å; L660-F728 HydrophobicContact CB-CD1 4.07Å; L660-F728 HydrophobicContact CB-CE1 4.14Å; L660-F728 HydrophobicContact CD1-CD1 4.46Å; L660-F728 HydrophobicContact CD2-CD1 4.24Å; L660-F728 HydrophobicContact CG-CD1 4.49Å; L660-I731 HydrophobicContact CD2-CB 4.27Å; L660-I731 HydrophobicContact CD2-CG2 3.8Å; L660-L732 HydrophobicContact CD2-CD2 4.04Å; L660-L732 HydrophobicContact CD2-CG 4.11Å; L660-L841 HydrophobicContact CD2-CD1 3.89Å; L660-L841 HydrophobicContact CG-CD1 4.36Å
661	R	95.8	Very high	92.5	Very high	21 Å²	21	30.9 Å²	30.9	8%	0.079	18%	0.178	C	C	.	.	H	α-helix	trans	-59.7	-35.7	175.7	-176.5	-171.4	-49.4	-79.6	3.7	113	D657 E658 A659 H665 R839 P840 L841	D657-R661 WeakPolarHBondContact O-CB 3.16Å; D657-R661 PolarHBondContact O-N 2.87Å; D657-R661 IonicContact OD2-CZ 2.86Å; D657-R661 IonicContact OD2-NH2 4Å; D657-R661 PolarHBondContact OD2-NH2 3.35Å; E658-R661 PolarHBondContact O-N 3.18Å; A659-R661 VanDerWaalsContact C-N 3.33Å; A659-R661 PolarHBondContact O-N 3.37Å; R661-H665 WeakPolarHBondContact O-CB 3.45Å; R661-H665 PolarHBondContact O-N 2.98Å; R661-R839 PolarHBondContact NH1-O 2.83Å; R661-P840 PolarHBondContact NH1-O 2.76Å; R661-L841 HydrophobicContact CB-CD2 3.63Å; R661-L841 HydrophobicContact CG-CD2 4.08Å
662	L	94.7	Very high	92.6	Very high	53 Å²	53	36.4 Å²	36.4	28%	0.277	20%	0.204	S	C	.	.	H	α-helix	trans	-68.7	-42	175	-175.2	60.2	0	0	0	111.7	L649 I651 L654 E658 A659 L660 H665 R666	L649-L662 HydrophobicContact CB-CD2 4.23Å; L649-L662 HydrophobicContact CD1-CG 4.37Å; L649-L662 HydrophobicContact CD2-CG 4.49Å; I651-L662 HydrophobicContact CG2-CD2 4.09Å; L654-L662 HydrophobicContact CD1-CD2 4.22Å; E658-L662 PolarHBondContact O-N 2.9Å; A659-L662 PolarHBondContact O-N 3.45Å; A659-L662 VanDerWaalsContact O-N 3.16Å; L660-L662 VanDerWaalsContact C-N 3.3Å; L660-L662 PolarHBondContact O-N 3.35Å; L662-H665 PolarHBondContact O-N 3.31Å; L662-R666 PolarHBondContact O-N 2.75Å
663	V	94.6	Very high	92.9	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-51	175.1	176.2	0	0	0	0	110.7	L646 L649 A659 L660 H665 R666 Y667 V683	L646-V663 HydrophobicContact CD2-CG1 4.29Å; L646-V663 HydrophobicContact CD2-CG2 3.71Å; L649-V663 HydrophobicContact CD1-CG2 3.96Å; A659-V663 WeakPolarHBondContact O-CG2 3.21Å; A659-V663 PolarHBondContact O-N 3.4Å; A659-V663 VanDerWaalsContact O-N 3.09Å; L660-V663 PolarHBondContact O-N 2.94Å; V663-H665 PolarHBondContact O-N 3.24Å; V663-R666 PolarHBondContact O-N 3.43Å; V663-Y667 HydrophobicContact CG1-CD2 4.43Å; V663-Y667 PolarHBondContact O-N 3.37Å; V663-V683 HydrophobicContact CG1-CG2 3.96Å; V663-V683 HydrophobicContact CG2-CG2 4.21Å
664	V	94.5	Very high	93.3	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.024	20%	0.197	C	C	.	.	H	α-helix	trans	-61.1	-42.9	176.4	178.5	0	0	0	0	111.3	L660 R666 G668 M669 L841 P843	L660-V664 HydrophobicContact CD1-CG2 4.32Å; L660-V664 HydrophobicContact CG-CG2 4.37Å; L660-V664 WeakPolarHBondContact O-CG2 3.47Å; L660-V664 PolarHBondContact O-N 2.69Å; V664-R666 VanDerWaalsContact C-N 3.29Å; V664-R666 PolarHBondContact O-N 3.44Å; V664-G668 VanDerWaalsContact O-CA 3.26Å; V664-G668 WeakPolarHBondContact O-CA 3.34Å; V664-G668 PolarHBondContact O-N 3.49Å; V664-M669 HydrophobicContact CG1-CG 4.36Å; V664-M669 HydrophobicContact CG2-CG 3.69Å; V664-M669 HydrophobicContact CG2-SD 3.68Å; V664-L841 HydrophobicContact CG1-CB 4.46Å; V664-P843 WeakPolarHBondContact O-CA 3.4Å
665	H	93.9	Very high	93.3	Very high	46 Å²	46	38.8 Å²	38.8	21%	0.213	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-29.4	177.8	178.7	81.7	0	0	0	112.7	R621 R661 L662 V663 G844 Q995	R621-H665 PolarHBondContact NH1-O 2.75Å; R661-H665 WeakPolarHBondContact O-CB 3.45Å; R661-H665 PolarHBondContact O-N 2.98Å; L662-H665 PolarHBondContact O-N 3.31Å; V663-H665 PolarHBondContact O-N 3.24Å; H665-G844 PolarHBondContact O-N 2.74Å; H665-Q995 PolarHBondContact NE2-OE1 3.15Å
666	R	92.9	Very high	93.4	Very high	74 Å²	74	37.9 Å²	37.9	28%	0.279	19%	0.19	S	C	.	.	H	α-helix	trans	-87.1	-57.2	176.7	-171.3	71.6	-166.3	-166.4	3.9	112.5	Q614 R621 L649 L662 V663 V664	Q614-R666 PolarHBondContact O-NH2 3.02Å; R621-R666 PolarHBondContact NH1-O 3.23Å; L649-R666 HydrophobicContact CD2-CB 4.27Å; L649-R666 HydrophobicContact CD2-CG 4.19Å; L662-R666 PolarHBondContact O-N 2.75Å; V663-R666 PolarHBondContact O-N 3.43Å; V664-R666 VanDerWaalsContact C-N 3.29Å; V664-R666 PolarHBondContact O-N 3.44Å
667	Y	94	Very high	93.5	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-106.1	-8.8	-167.2	-54	-58.1	0	0	0	114.4	I613 R621 I624 G625 L628 L645 S648 L649 V663	I613-Y667 HydrophobicContact CG2-CD1 4.35Å; I613-Y667 HydrophobicContact CG2-CE1 4.31Å; R621-Y667 CarbonylContact C-O 3.44Å; I624-Y667 HydrophobicContact CG2-CD1 3.99Å; I624-Y667 HydrophobicContact CG2-CG 4.45Å; G625-Y667 PolarHBondContact N-O 3.09Å; L628-Y667 HydrophobicContact CD1-CD1 4.3Å; L628-Y667 HydrophobicContact CD1-CD2 4.39Å; L628-Y667 HydrophobicContact CD1-CG 3.97Å; L645-Y667 HydrophobicContact CB-CE1 4.27Å; L645-Y667 HydrophobicContact CB-CE2 4.09Å; L645-Y667 HydrophobicContact CD1-CD1 4.48Å; L645-Y667 HydrophobicContact CD1-CE1 4.08Å; L645-Y667 HydrophobicContact CD2-CE1 4.01Å; L645-Y667 HydrophobicContact CG-CE1 4.36Å; L645-Y667 PolarHBondContact O-OH 3.2Å; L645-Y667 VanDerWaalsContact O-OH 3.14Å; S648-Y667 PolarHBondContact OG-OH 2.96Å; L649-Y667 HydrophobicContact CD1-CD2 4.4Å; L649-Y667 HydrophobicContact CD1-CE2 3.72Å; L649-Y667 HydrophobicContact CD2-CE2 4.42Å; L649-Y667 HydrophobicContact CG-CE2 4.13Å; V663-Y667 HydrophobicContact CG1-CD2 4.43Å; V663-Y667 PolarHBondContact O-N 3.37Å
668	G	92.6	Very high	93.5	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.01	21%	0.212	C	C	.	.			trans	73.2	175.4	-172.4	0	0	0	0	0	113.2	V664	V664-G668 VanDerWaalsContact O-CA 3.26Å; V664-G668 WeakPolarHBondContact O-CA 3.34Å; V664-G668 PolarHBondContact O-N 3.49Å
669	M	91.3	Very high	93.5	Very high	41 Å²	41	39.2 Å²	39.2	20%	0.202	20%	0.195	C	C	.	.			trans	-101	145.5	165.3	-69.8	-58	-68	0	0	110.2	V664 I676 L679 L732	V664-M669 HydrophobicContact CG1-CG 4.36Å; V664-M669 HydrophobicContact CG2-CG 3.69Å; V664-M669 HydrophobicContact CG2-SD 3.68Å; M669-I676 HydrophobicContact CE-CB 4.44Å; M669-I676 HydrophobicContact CE-CG1 4.19Å; M669-I676 HydrophobicContact CE-CG2 3.88Å; M669-L679 HydrophobicContact SD-CD2 4.35Å; M669-L732 HydrophobicContact CE-CD1 3.81Å; M669-L732 HydrophobicContact CE-CD2 4.1Å; M669-L732 HydrophobicContact CG-CD2 4.39Å; M669-L732 HydrophobicContact SD-CD2 4.36Å
670	P	92.2	Very high	93.5	Very high	7 Å²	7	39.2 Å²	39.2	5%	0.045	20%	0.195	C	C	.	.			trans	-64.2	173.3	159.4	25.3	-30.9	0	0	0	112.3	E675 I676 L679	P670-E675 HydrophobicContact CB-CB 3.42Å; P670-E675 VanDerWaalsContact CB-CB 3.42Å; P670-E675 HydrophobicContact CB-CG 4.39Å; P670-E675 VanDerWaalsContact CB-OE2 3.24Å; P670-E675 WeakPolarHBondContact CB-OE2 3.46Å; P670-E675 HydrophobicContact CG-CB 3.78Å; P670-I676 HydrophobicContact CG-CB 4.43Å; P670-I676 HydrophobicContact CG-CG1 3.84Å; P670-L679 VanDerWaalsContact CD-CD2 3.49Å; P670-L679 HydrophobicContact CG-CD2 4.16Å
671	V	86.7	Confident	93.4	Very high	58 Å²	58	43.6 Å²	43.6	35%	0.352	22%	0.215	S	C	.	.	S	Bend	trans	-105.9	-38.8	-178.8	176.5	0	0	0	0	111.8	Y70	Y70-V671 HydrophobicContact CD1-CG1 4.31Å; Y70-V671 HydrophobicContact CD2-CG1 3.79Å; Y70-V671 HydrophobicContact CE1-CG1 4.09Å; Y70-V671 HydrophobicContact CE2-CG1 3.54Å; Y70-V671 HydrophobicContact CE2-CG2 4.44Å; Y70-V671 HydrophobicContact CG-CG1 4.18Å
672	E	90.9	Very high	93.4	Very high	121 Å²	121	42.9 Å²	42.9	57%	0.565	21%	0.214	S	C	*	.	S	Bend	trans	-75.6	138	-178.4	-66.5	-60	151.6	0	0	111.3	Q674 E675 I676	E672-Q674 PolarHBondContact O-N 3.45Å; E672-E675 HydrophobicContact CB-CB 4.27Å; E672-E675 HydrophobicContact CB-CG 3.95Å; E672-E675 WeakPolarHBondContact O-CB 3.45Å; E672-E675 PolarHBondContact O-N 2.81Å; E672-I676 WeakPolarHBondContact O-CG1 3.41Å; E672-I676 PolarHBondContact O-N 3.05Å
673	S	90.7	Very high	93.4	Very high	80 Å²	80	40.5 Å²	40.5	56%	0.559	20%	0.201	S	C	*	.	H	α-helix	trans	-59.3	-35.5	-176.1	56.4	0	0	0	0	113.2	I676 D677	S673-I676 PolarHBondContact O-N 2.84Å; S673-D677 WeakPolarHBondContact O-CB 3.34Å; S673-D677 PolarHBondContact O-N 3.12Å
674	Q	93.3	Very high	93.5	Very high	129 Å²	129	40.7 Å²	40.7	60%	0.603	20%	0.202	S	C	*	.	H	α-helix	trans	-70.9	-28.8	175.9	-58.6	-174.7	2	0	0	113.4	E672 R678	E672-Q674 PolarHBondContact O-N 3.45Å; Q674-R678 PolarHBondContact O-N 2.95Å; Q674-R678 PolarHBondContact O-NE 2.93Å; Q674-R678 PolarHBondContact O-NH2 3.02Å
675	E	94.1	Very high	93.4	Very high	33 Å²	33	45.7 Å²	45.7	15%	0.154	23%	0.226	C	C	.	.	H	α-helix	trans	-75.8	-40	174.2	-67.5	177.2	164	0	0	110.7	G629 P670 E672 D677 L679	G629-E675 WeakPolarHBondContact CA-O 3.28Å; G629-E675 WeakPolarHBondContact O-CA 3.5Å; P670-E675 HydrophobicContact CB-CB 3.42Å; P670-E675 VanDerWaalsContact CB-CB 3.42Å; P670-E675 HydrophobicContact CB-CG 4.39Å; P670-E675 VanDerWaalsContact CB-OE2 3.24Å; P670-E675 WeakPolarHBondContact CB-OE2 3.46Å; P670-E675 HydrophobicContact CG-CB 3.78Å; E672-E675 HydrophobicContact CB-CB 4.27Å; E672-E675 HydrophobicContact CB-CG 3.95Å; E672-E675 WeakPolarHBondContact O-CB 3.45Å; E672-E675 PolarHBondContact O-N 2.81Å; E675-D677 VanDerWaalsContact C-N 3.32Å; E675-D677 PolarHBondContact O-N 3.02Å; E675-L679 WeakPolarHBondContact O-CB 3.08Å; E675-L679 PolarHBondContact O-N 3.2Å; E675-L679 VanDerWaalsContact O-N 3.13Å
676	I	94.7	Very high	93.4	Very high	36 Å²	36	45 Å²	45	19%	0.185	22%	0.221	C	C	.	.	H	α-helix	trans	-56.5	-49	172.3	-66.4	170.3	0	0	0	109.5	M669 P670 E672 S673 L679 L680 Y729 L732	M669-I676 HydrophobicContact CE-CB 4.44Å; M669-I676 HydrophobicContact CE-CG1 4.19Å; M669-I676 HydrophobicContact CE-CG2 3.88Å; P670-I676 HydrophobicContact CG-CB 4.43Å; P670-I676 HydrophobicContact CG-CG1 3.84Å; E672-I676 WeakPolarHBondContact O-CG1 3.41Å; E672-I676 PolarHBondContact O-N 3.05Å; S673-I676 PolarHBondContact O-N 2.84Å; I676-L679 PolarHBondContact O-N 3.26Å; I676-L680 WeakPolarHBondContact O-CB 3Å; I676-L680 PolarHBondContact O-N 3.39Å; I676-Y729 HydrophobicContact CG2-CE1 4.02Å; I676-L732 HydrophobicContact CG2-CD1 4.1Å
677	D	94.7	Very high	93.5	Very high	53 Å²	53	41.6 Å²	41.6	28%	0.283	21%	0.208	S	C	.	.	H	α-helix	trans	-56.6	-54.6	-179.4	-173.8	43.9	0	0	0	113.3	S673 E675 L679 L680 Q681 Y729	S673-D677 WeakPolarHBondContact O-CB 3.34Å; S673-D677 PolarHBondContact O-N 3.12Å; E675-D677 VanDerWaalsContact C-N 3.32Å; E675-D677 PolarHBondContact O-N 3.02Å; D677-L679 PolarHBondContact O-N 3.16Å; D677-L680 PolarHBondContact O-N 2.91Å; D677-L680 VanDerWaalsContact O-N 3.11Å; D677-Q681 VanDerWaalsContact O-CG 3.3Å; D677-Q681 WeakPolarHBondContact O-CG 3.31Å; D677-Q681 PolarHBondContact O-N 2.91Å; D677-Q681 PolarHBondContact OD1-NE2 2.94Å; D677-Q681 PolarHBondContact OD2-NE2 3.33Å; D677-Y729 WeakPolarHBondContact CA-OH 3.47Å; D677-Y729 WeakPolarHBondContact CB-OH 3.47Å; D677-Y729 PolarHBondContact OD1-OH 3.38Å
678	R	95	Very high	93.4	Very high	57 Å²	57	42 Å²	42	22%	0.215	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-37	-178.5	-69.8	-179	-65.1	-100.8	-3.7	112.9	G629 Q674 C682	G629-R678 VanDerWaalsContact O-CZ 3.23Å; G629-R678 PolarHBondContact O-NE 2.97Å; G629-R678 PolarHBondContact O-NH2 3.46Å; Q674-R678 PolarHBondContact O-N 2.95Å; Q674-R678 PolarHBondContact O-NE 2.93Å; Q674-R678 PolarHBondContact O-NH2 3.02Å; R678-C682 PolarHBondContact O-N 3.2Å; R678-C682 PolarHBondContact O-SG 3.49Å
679	L	95.1	Very high	93.3	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-43.2	172.2	176.7	60.2	0	0	0	111.2	L628 T642 M669 P670 E675 I676 D677 C682 V683	L628-L679 HydrophobicContact CB-CD1 4.08Å; T642-L679 HydrophobicContact CG2-CD1 3.75Å; M669-L679 HydrophobicContact SD-CD2 4.35Å; P670-L679 VanDerWaalsContact CD-CD2 3.49Å; P670-L679 HydrophobicContact CG-CD2 4.16Å; E675-L679 WeakPolarHBondContact O-CB 3.08Å; E675-L679 PolarHBondContact O-N 3.2Å; E675-L679 VanDerWaalsContact O-N 3.13Å; I676-L679 PolarHBondContact O-N 3.26Å; D677-L679 PolarHBondContact O-N 3.16Å; L679-C682 WeakPolarHBondContact O-CB 3.47Å; L679-C682 PolarHBondContact O-N 3.23Å; L679-V683 HydrophobicContact CD1-CG2 4.47Å; L679-V683 WeakPolarHBondContact O-CG2 3.47Å; L679-V683 PolarHBondContact O-N 3.3Å
680	L	95	Very high	93.2	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-70.2	-32.4	-176.9	-154.8	63.5	0	0	0	112.5	L660 I676 D677 V683 T684 F728 Y729 L732	L660-L680 HydrophobicContact CD1-CD1 4.15Å; I676-L680 WeakPolarHBondContact O-CB 3Å; I676-L680 PolarHBondContact O-N 3.39Å; D677-L680 PolarHBondContact O-N 2.91Å; D677-L680 VanDerWaalsContact O-N 3.11Å; L680-V683 PolarHBondContact O-N 3.27Å; L680-T684 WeakPolarHBondContact O-CB 3.44Å; L680-T684 PolarHBondContact O-N 2.92Å; L680-T684 PolarHBondContact O-OG1 3.18Å; L680-F728 HydrophobicContact CD1-CB 3.7Å; L680-F728 HydrophobicContact CD1-CD2 4.49Å; L680-F728 HydrophobicContact CD1-CG 4.18Å; L680-F728 HydrophobicContact CD2-CB 3.81Å; L680-F728 HydrophobicContact CG-CB 3.93Å; L680-Y729 HydrophobicContact CD2-CD1 4.08Å; L680-Y729 HydrophobicContact CD2-CD2 3.62Å; L680-Y729 HydrophobicContact CD2-CE1 4.17Å; L680-Y729 HydrophobicContact CD2-CE2 3.73Å; L680-Y729 HydrophobicContact CD2-CG 3.81Å; L680-L732 HydrophobicContact CD1-CD1 4.37Å; L680-L732 HydrophobicContact CD2-CD1 4.21Å
681	Q	94.7	Very high	93	Very high	94 Å²	94	48.7 Å²	48.7	44%	0.439	24%	0.242	S	C	.	.	H	α-helix	trans	-59.2	-47.1	170	-73.1	164.6	16	0	0	111.1	D677 V683 T684 E685	D677-Q681 VanDerWaalsContact O-CG 3.3Å; D677-Q681 WeakPolarHBondContact O-CG 3.31Å; D677-Q681 PolarHBondContact O-N 2.91Å; D677-Q681 PolarHBondContact OD1-NE2 2.94Å; D677-Q681 PolarHBondContact OD2-NE2 3.33Å; Q681-V683 PolarHBondContact O-N 3.28Å; Q681-T684 WeakPolarHBondContact O-CB 3.33Å; Q681-T684 PolarHBondContact O-N 3.18Å; Q681-E685 PolarHBondContact O-N 3.11Å
682	C	95.5	Very high	92.9	Very high	6 Å²	6	48.5 Å²	48.5	4%	0.041	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-42.7	175.9	-57.8	0	0	0	0	112.2	T642 M643 L646 R678 L679 T684 Y686	T642-C682 HydrophobicContact CG2-CB 3.49Å; T642-C682 VanDerWaalsContact CG2-CB 3.49Å; M643-C682 HydrophobicContact SD-CB 3.92Å; L646-C682 HydrophobicContact CD1-CB 3.84Å; L646-C682 WeakPolarHBondContact CD1-O 3.42Å; R678-C682 PolarHBondContact O-N 3.2Å; R678-C682 PolarHBondContact O-SG 3.49Å; L679-C682 WeakPolarHBondContact O-CB 3.47Å; L679-C682 PolarHBondContact O-N 3.23Å; C682-T684 VanDerWaalsContact C-N 3.31Å; C682-T684 PolarHBondContact O-N 3.37Å; C682-Y686 WeakPolarHBondContact O-CB 3.44Å; C682-Y686 PolarHBondContact O-N 2.8Å
683	V	95.4	Very high	92.2	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-39.9	175.4	172.8	0	0	0	0	111.1	L646 V663 L679 L680 Q681 Y687 F728	L646-V683 HydrophobicContact CD1-CG2 4.07Å; L646-V683 HydrophobicContact CD2-CG2 4Å; V663-V683 HydrophobicContact CG1-CG2 3.96Å; V663-V683 HydrophobicContact CG2-CG2 4.21Å; L679-V683 HydrophobicContact CD1-CG2 4.47Å; L679-V683 WeakPolarHBondContact O-CG2 3.47Å; L679-V683 PolarHBondContact O-N 3.3Å; L680-V683 PolarHBondContact O-N 3.27Å; Q681-V683 PolarHBondContact O-N 3.28Å; V683-Y687 WeakPolarHBondContact O-CB 3.26Å; V683-Y687 PolarHBondContact O-N 3.09Å; V683-F728 HydrophobicContact CG1-CE1 4.44Å; V683-F728 HydrophobicContact CG1-CE2 4.16Å; V683-F728 HydrophobicContact CG1-CZ 4.03Å
684	T	95.3	Very high	90.7	Very high	5 Å²	5	45.5 Å²	45.5	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-65.6	-50.8	178.4	-63.4	0	0	0	0	111.1	L680 Q681 C682 Y686 Y687 H688 P721 L724	L680-T684 WeakPolarHBondContact O-CB 3.44Å; L680-T684 PolarHBondContact O-N 2.92Å; L680-T684 PolarHBondContact O-OG1 3.18Å; Q681-T684 WeakPolarHBondContact O-CB 3.33Å; Q681-T684 PolarHBondContact O-N 3.18Å; C682-T684 VanDerWaalsContact C-N 3.31Å; C682-T684 PolarHBondContact O-N 3.37Å; T684-Y686 PolarHBondContact O-N 3.09Å; T684-Y687 PolarHBondContact O-N 2.91Å; T684-H688 WeakPolarHBondContact O-CB 3.49Å; T684-H688 PolarHBondContact O-N 2.8Å; T684-P721 HydrophobicContact CG2-CB 4.03Å; T684-P721 WeakPolarHBondContact CG2-O 3.3Å; T684-L724 HydrophobicContact CG2-CB 4.16Å; T684-L724 HydrophobicContact CG2-CD2 3.79Å; T684-L724 HydrophobicContact CG2-CG 4.03Å
685	E	93.3	Very high	88.4	Confident	109 Å²	109	44.1 Å²	44.1	51%	0.509	23%	0.228	S	C	.	.	H	α-helix	trans	-57.8	-49.3	177.3	-171.5	-166.8	145.6	0	0	111.3	M643 Q681 T689	M643-E685 HydrophobicContact CE-CB 4.22Å; M643-E685 VanDerWaalsContact CE-CD 3.41Å; M643-E685 HydrophobicContact CE-CG 4Å; M643-E685 VanDerWaalsContact CE-OE1 3.24Å; M643-E685 WeakPolarHBondContact CE-OE1 3.43Å; Q681-E685 PolarHBondContact O-N 3.11Å; E685-T689 WeakPolarHBondContact O-CB 3.45Å; E685-T689 WeakPolarHBondContact O-CG2 3.49Å; E685-T689 PolarHBondContact O-N 3.25Å; E685-T689 PolarHBondContact O-OG1 3Å
686	Y	94.2	Very high	85.9	Confident	31 Å²	31	47 Å²	47	12%	0.122	25%	0.252	C	S	.	.	H	α-helix	trans	-70.3	-40.6	-178.3	-177.6	-121.4	0	0	0	113.1	L646 K647 I651 C682 T684 T689 V690	L646-Y686 VanDerWaalsContact C-CE1 3.45Å; L646-Y686 HydrophobicContact CB-CD1 3.62Å; L646-Y686 HydrophobicContact CB-CE1 4.17Å; L646-Y686 HydrophobicContact CB-CG 4.13Å; L646-Y686 WeakPolarHBondContact O-CE1 3.44Å; K647-Y686 HydrophobicContact CB-CE2 4.45Å; K647-Y686 HydrophobicContact CG-CD2 3.99Å; K647-Y686 HydrophobicContact CG-CE2 3.58Å; I651-Y686 HydrophobicContact CD1-CD1 3.33Å; I651-Y686 HydrophobicContact CD1-CE1 3.43Å; I651-Y686 VanDerWaalsContact CD1-CE1 3.43Å; I651-Y686 HydrophobicContact CD1-CG 4.34Å; I651-Y686 HydrophobicContact CG1-CD1 4.11Å; I651-Y686 HydrophobicContact CG1-CE1 3.67Å; C682-Y686 WeakPolarHBondContact O-CB 3.44Å; C682-Y686 PolarHBondContact O-N 2.8Å; T684-Y686 PolarHBondContact O-N 3.09Å; Y686-T689 WeakPolarHBondContact CA-OG1 3.46Å; Y686-T689 PolarHBondContact O-OG1 3.41Å; Y686-T689 VanDerWaalsContact O-OG1 3.08Å; Y686-V690 HydrophobicContact CD2-CG2 3.89Å; Y686-V690 HydrophobicContact CE1-CG2 4.32Å; Y686-V690 HydrophobicContact CE2-CG2 3.37Å; Y686-V690 WeakPolarHBondContact O-CB 3.47Å; Y686-V690 VanDerWaalsContact O-CG2 3.25Å; Y686-V690 WeakPolarHBondContact O-CG2 3.47Å; Y686-V690 PolarHBondContact O-N 3.29Å
687	Y	94.3	Very high	83.3	Confident	3 Å²	3	50.1 Å²	50.1	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-68.6	-38	176.3	-177.9	-93.9	0	0	0	111.8	I651 L654 V656 A659 V683 T684 R691 W692 L724 F728	I651-Y687 HydrophobicContact CD1-CD2 4.09Å; L654-Y687 PolarHBondContact O-OH 3.29Å; L654-Y687 VanDerWaalsContact O-OH 3.11Å; V656-Y687 HydrophobicContact CG1-CE1 3.62Å; V656-Y687 WeakPolarHBondContact CG1-OH 3.46Å; V656-Y687 PolarHBondContact N-OH 3.31Å; A659-Y687 HydrophobicContact CB-CD2 3.62Å; A659-Y687 HydrophobicContact CB-CE2 3.56Å; V683-Y687 WeakPolarHBondContact O-CB 3.26Å; V683-Y687 PolarHBondContact O-N 3.09Å; T684-Y687 PolarHBondContact O-N 2.91Å; Y687-R691 HydrophobicContact CE1-CB 4.45Å; Y687-R691 VanDerWaalsContact CZ-CD 3.43Å; Y687-R691 WeakPolarHBondContact O-CB 3.49Å; Y687-R691 PolarHBondContact O-N 2.94Å; Y687-R691 VanDerWaalsContact OH-CD 3.28Å; Y687-R691 WeakPolarHBondContact OH-CD 3.29Å; Y687-R691 PolarHBondContact OH-NH1 3.29Å; Y687-W692 HydrophobicContact CD1-CZ3 4.22Å; Y687-W692 HydrophobicContact CE1-CH2 4.16Å; Y687-W692 HydrophobicContact CE1-CZ3 4.05Å; Y687-L724 HydrophobicContact CD1-CD1 3.88Å; Y687-L724 HydrophobicContact CD1-CD2 3.81Å; Y687-L724 HydrophobicContact CD1-CG 4.45Å; Y687-L724 HydrophobicContact CE1-CD1 3.93Å; Y687-F728 HydrophobicContact CD1-CE2 4.46Å; Y687-F728 AromaticContact CD1-CZ 3.96Å; Y687-F728 HydrophobicContact CD1-CZ 3.96Å; Y687-F728 HydrophobicContact CE1-CZ 4.44Å; Y687-F728 AromaticContact CG-CZ 3.99Å; Y687-F728 HydrophobicContact CG-CZ 3.99Å
688	H	92.9	Very high	80.5	Confident	13 Å²	13	52.9 Å²	52.9	6%	0.06	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-48.2	177	-169.4	-86.6	0	0	0	111.6	T684 V690 R691 W692 I719 L724	T684-H688 WeakPolarHBondContact O-CB 3.49Å; T684-H688 PolarHBondContact O-N 2.8Å; H688-V690 PolarHBondContact O-N 3.15Å; H688-R691 PolarHBondContact O-N 2.69Å; H688-W692 AromaticContact CD2-CE3 3.75Å; H688-W692 PolarHBondContact O-N 3.45Å; H688-I719 PolarHBondContact NE2-O 2.71Å; H688-L724 HydrophobicContact CB-CD2 3.83Å
689	T	90.5	Very high	77.8	Confident	54 Å²	54	55.6 Å²	55.6	33%	0.331	31%	0.314	S	S	.	.	I	π-helix	trans	-63.2	-41.4	178.4	48.4	0	0	0	0	112.8	E685 Y686 C693 S694	E685-T689 WeakPolarHBondContact O-CB 3.45Å; E685-T689 WeakPolarHBondContact O-CG2 3.49Å; E685-T689 PolarHBondContact O-N 3.25Å; E685-T689 PolarHBondContact O-OG1 3Å; Y686-T689 WeakPolarHBondContact CA-OG1 3.46Å; Y686-T689 PolarHBondContact O-OG1 3.41Å; Y686-T689 VanDerWaalsContact O-OG1 3.08Å; T689-C693 HydrophobicContact CG2-CB 4.44Å; T689-C693 PolarHBondContact O-N 2.9Å; T689-S694 PolarHBondContact O-N 3.24Å; T689-S694 PolarHBondContact O-OG 3.44Å
690	V	88.9	Confident	75.4	Confident	35 Å²	35	59.5 Å²	59.5	21%	0.212	34%	0.342	C	S	.	.	I	π-helix	trans	-68.2	-38.9	175.9	170.4	0	0	0	0	112.5	Y686 H688	Y686-V690 HydrophobicContact CD2-CG2 3.89Å; Y686-V690 HydrophobicContact CE1-CG2 4.32Å; Y686-V690 HydrophobicContact CE2-CG2 3.37Å; Y686-V690 WeakPolarHBondContact O-CB 3.47Å; Y686-V690 VanDerWaalsContact O-CG2 3.25Å; Y686-V690 WeakPolarHBondContact O-CG2 3.47Å; Y686-V690 PolarHBondContact O-N 3.29Å; H688-V690 PolarHBondContact O-N 3.15Å
691	R	87.6	Confident	72.9	Confident	100 Å²	100	64.9 Å²	64.9	38%	0.377	37%	0.371	S	S	.	.	I	π-helix	trans	-87.8	-27.4	-172.8	-171.6	166.9	173	121.6	3	114.5	L654 Y687 H688	L654-R691 PolarHBondContact O-NH1 2.89Å; Y687-R691 HydrophobicContact CE1-CB 4.45Å; Y687-R691 VanDerWaalsContact CZ-CD 3.43Å; Y687-R691 WeakPolarHBondContact O-CB 3.49Å; Y687-R691 PolarHBondContact O-N 2.94Å; Y687-R691 VanDerWaalsContact OH-CD 3.28Å; Y687-R691 WeakPolarHBondContact OH-CD 3.29Å; Y687-R691 PolarHBondContact OH-NH1 3.29Å; H688-R691 PolarHBondContact O-N 2.69Å
692	W	84.7	Confident	70.5	Confident	53 Å²	53	65.3 Å²	65.3	20%	0.201	38%	0.375	C	S	.	.	I	π-helix	trans	-132.6	-22.5	-175.2	-65.7	-73.5	0	0	0	116.3	Y687 H688 P717 I719 L724 V823	Y687-W692 HydrophobicContact CD1-CZ3 4.22Å; Y687-W692 HydrophobicContact CE1-CH2 4.16Å; Y687-W692 HydrophobicContact CE1-CZ3 4.05Å; H688-W692 AromaticContact CD2-CE3 3.75Å; H688-W692 PolarHBondContact O-N 3.45Å; W692-P717 HydrophobicContact CB-CB 3.91Å; W692-P717 HydrophobicContact CG-CB 4.29Å; W692-I719 HydrophobicContact CD2-CG2 4.44Å; W692-I719 HydrophobicContact CE3-CG2 4.18Å; W692-I719 HydrophobicContact CH2-CG2 3.52Å; W692-I719 HydrophobicContact CZ2-CG2 3.79Å; W692-I719 HydrophobicContact CZ3-CG2 3.74Å; W692-L724 HydrophobicContact CZ3-CD1 4.45Å; W692-L724 HydrophobicContact CZ3-CD2 4.27Å; W692-V823 HydrophobicContact CZ2-CG1 4.27Å
693	C	76.1	Confident	67.8	Low	52 Å²	52	74.1 Å²	74.1	35%	0.351	41%	0.413	S	S	.	.	I	π-helix	trans	-95.8	-10.6	-178.3	-53.8	0	0	0	0	114.7	T689 T695	T689-C693 HydrophobicContact CG2-CB 4.44Å; T689-C693 PolarHBondContact O-N 2.9Å; C693-T695 PolarHBondContact O-N 2.98Å
694	S	60	Low	65.1	Low	87 Å²	87	79.5 Å²	79.5	61%	0.608	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	35.8	-169	-66.7	0	0	0	0	115.1	T689	T689-S694 PolarHBondContact O-N 3.24Å; T689-S694 PolarHBondContact O-OG 3.44Å
695	T	45.2	Very low	62.5	Low	100 Å²	100	85 Å²	85	61%	0.613	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.7	6.5	179.7	43.2	0	0	0	0	114.1	C693 L714	C693-T695 PolarHBondContact O-N 2.98Å; T695-L714 VanDerWaalsContact OG1-CD2 3.32Å; T695-L714 WeakPolarHBondContact OG1-CD2 3.49Å
696	S	40.8	Very low	59.8	Low	94 Å²	94	86.1 Å²	86.1	66%	0.657	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-78	135.2	168.6	52	0	0	0	0	111.7
697	V	40.1	Very low	57.1	Low	101 Å²	101	92.3 Å²	92.3	61%	0.612	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-70.3	148.1	-175.2	-177.1	0	0	0	0	111.5	S699 I702	V697-S699 PolarHBondContact O-N 3.37Å; V697-S699 VanDerWaalsContact O-N 3.1Å; V697-I702 HydrophobicContact CB-CD1 4.43Å; V697-I702 HydrophobicContact CG1-CD1 4.24Å
698	N	35.6	Very low	54.2	Low	111 Å²	111	99.1 Å²	99.1	59%	0.594	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-47.4	116.2	171.8	-68.7	-18.9	0	0	0	111.1	S700 D701	N698-S700 PolarHBondContact O-N 2.98Å; N698-D701 PolarHBondContact O-N 3.29Å
699	S	39.6	Very low	51.8	Low	113 Å²	113	107.2 Å²	107.2	79%	0.79	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	12.9	-174.1	-41.7	0	0	0	0	114.3	V697	V697-S699 PolarHBondContact O-N 3.37Å; V697-S699 VanDerWaalsContact O-N 3.1Å
700	S	45	Very low	49.3	Very low	85 Å²	85	113 Å²	113	59%	0.594	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-27.1	174.1	47.6	0	0	0	0	113.4	N698	N698-S700 PolarHBondContact O-N 2.98Å
701	D	41	Very low	46.7	Very low	114 Å²	114	119.2 Å²	119.2	61%	0.61	67%	0.667	S	S	*	*	S	Bend	trans	-99.8	4.2	-159.9	-52.9	-15.6	0	0	0	112.7	N698	N698-D701 PolarHBondContact O-N 3.29Å
702	I	45.1	Very low	44.3	Very low	103 Å²	103	123.2 Å²	123.2	53%	0.528	69%	0.687	S	S	.	*			trans	-115.8	48.8	-172.1	-39.5	-178.5	0	0	0	111.3	V697	V697-I702 HydrophobicContact CB-CD1 4.43Å; V697-I702 HydrophobicContact CG1-CD1 4.24Å
703	F	39.2	Very low	42.3	Very low	191 Å²	191	126 Å²	126	84%	0.838	72%	0.715	S	S	*	*	S	Bend	trans	-131.7	27.5	174	-91.4	-75	0	0	0	113.2
704	S	38.8	Very low	40.8	Very low	115 Å²	115	128.1 Å²	128.1	80%	0.804	72%	0.722	S	S	*	*	S	Bend	trans	-149.5	55.9	179.4	-71.4	0	0	0	0	114.3
705	S	39.8	Very low	40.8	Very low	122 Å²	122	129.8 Å²	129.8	85%	0.853	73%	0.731	S	S	*	*			trans	-175.7	136.6	147.8	31.1	0	0	0	0	111.5
706	T	36.1	Very low	41.7	Very low	132 Å²	132	129 Å²	129	81%	0.81	74%	0.735	S	S	*	*			trans	-85.5	116.7	173	48.1	0	0	0	0	110.3
707	N	37.8	Very low	43.3	Very low	161 Å²	161	127.4 Å²	127.4	86%	0.861	72%	0.722	S	S	*	*			trans	-165.6	112.6	155.6	-94.1	-37.3	0	0	0	109
708	D	33.6	Very low	45.2	Very low	145 Å²	145	124.4 Å²	124.4	78%	0.775	71%	0.705	S	S	*	*			trans	-73.3	168.6	179.2	-71.8	-69.5	0	0	0	113.2
709	H	42.6	Very low	47.5	Very low	183 Å²	183	119.2 Å²	119.2	85%	0.847	68%	0.677	S	S	*	*	S	Bend	trans	65.2	46.3	168.1	-55	-70.3	0	0	0	118.4
710	Q	38.3	Very low	49.8	Very low	176 Å²	176	115.7 Å²	115.7	82%	0.822	65%	0.653	S	S	*	*			trans	-153.1	17.9	151.2	-124.4	167.3	118.3	0	0	119.3	K712	Q710-K712 PolarHBondContact O-N 2.72Å
711	L	33.8	Very low	52	Low	165 Å²	165	114.3 Å²	114.3	86%	0.864	64%	0.642	S	S	*	*			trans	-72.3	89.3	173.6	-134.8	79.4	0	0	0	111	S713	L711-S713 PolarHBondContact O-N 2.93Å
712	K	37	Very low	54.3	Low	184 Å²	184	114.3 Å²	114.3	80%	0.8	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-60.4	119.3	173.1	-80.7	179	175.8	171.8	0	109.7	Q710	Q710-K712 PolarHBondContact O-N 2.72Å
713	S	42.8	Very low	56.5	Low	112 Å²	112	110.9 Å²	110.9	78%	0.783	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-58.5	138.1	170.6	42.4	0	0	0	0	110.6	L711	L711-S713 PolarHBondContact O-N 2.93Å
714	L	45.8	Very low	59	Low	96 Å²	96	101.8 Å²	101.8	50%	0.503	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-61.5	143.6	165	-88.6	67.7	0	0	0	108.8	T695 A716	T695-L714 VanDerWaalsContact OG1-CD2 3.32Å; T695-L714 WeakPolarHBondContact OG1-CD2 3.49Å; L714-A716 PolarHBondContact O-N 3.44Å
715	P	58.9	Low	61.6	Low	122 Å²	122	97.1 Å²	97.1	79%	0.792	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-59.1	136.5	169.4	26.9	-33.7	0	0	0	109.4
716	A	63.3	Low	64.2	Low	84 Å²	84	93.2 Å²	93.2	69%	0.694	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-59.8	149.3	177.1	0	0	0	0	0	110.7	L714	L714-A716 PolarHBondContact O-N 3.44Å
717	P	75.1	Confident	66.9	Low	60 Å²	60	87.1 Å²	87.1	39%	0.39	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-58.7	129	175.9	24.7	-34.3	0	0	0	109.9	W692 I719	W692-P717 HydrophobicContact CB-CB 3.91Å; W692-P717 HydrophobicContact CG-CB 4.29Å; P717-I719 PolarHBondContact O-N 3.2Å
718	P	79.4	Confident	69.6	Low	38 Å²	38	79.4 Å²	79.4	25%	0.247	44%	0.441	C	S	.	.	S	Bend	trans	-72.5	5.9	-173.8	31.1	-38.2	0	0	0	114.1	D819 V823	P718-D819 HydrophobicContact CB-CB 4.1Å; P718-V823 HydrophobicContact CB-CG2 3.83Å; P718-V823 HydrophobicContact CG-CG2 3.69Å
719	I	85.5	Confident	72.5	Confident	3 Å²	3	75.7 Å²	75.7	2%	0.015	42%	0.417	C	S	.	.	S	Bend	trans	-150	140	174.9	-168.7	167.3	0	0	0	109.5	H688 W692 P717 Q723 L724 I727 F824	H688-I719 PolarHBondContact NE2-O 2.71Å; W692-I719 HydrophobicContact CD2-CG2 4.44Å; W692-I719 HydrophobicContact CE3-CG2 4.18Å; W692-I719 HydrophobicContact CH2-CG2 3.52Å; W692-I719 HydrophobicContact CZ2-CG2 3.79Å; W692-I719 HydrophobicContact CZ3-CG2 3.74Å; P717-I719 PolarHBondContact O-N 3.2Å; I719-Q723 HydrophobicContact CD1-CB 3.86Å; I719-Q723 HydrophobicContact CG1-CB 3.43Å; I719-Q723 VanDerWaalsContact CG1-CB 3.43Å; I719-L724 HydrophobicContact CD1-CB 4.34Å; I719-I727 HydrophobicContact CD1-CD1 3.47Å; I719-I727 VanDerWaalsContact CD1-CD1 3.47Å; I719-F824 HydrophobicContact CD1-CD2 3.98Å; I719-F824 HydrophobicContact CD1-CE2 3.51Å; I719-F824 HydrophobicContact CD1-CZ 4.46Å
720	S	87.6	Confident	75	Confident	39 Å²	39	67.7 Å²	67.7	27%	0.273	38%	0.382	S	S	.	.			trans	-76	159.3	172.8	78.1	0	0	0	0	111.8	D722 Q723 L724	S720-D722 VanDerWaalsContact C-N 3.26Å; S720-D722 PolarHBondContact O-N 2.97Å; S720-D722 PolarHBondContact OG-N 3.25Å; S720-Q723 PolarHBondContact O-N 3.33Å; S720-Q723 WeakPolarHBondContact OG-CG 3.38Å; S720-Q723 PolarHBondContact OG-N 3.31Å; S720-Q723 VanDerWaalsContact OG-N 3.11Å; S720-Q723 PolarHBondContact OG-OE1 2.77Å; S720-L724 WeakPolarHBondContact O-CB 3.16Å; S720-L724 PolarHBondContact O-N 3.05Å
721	P	90.2	Very high	77.7	Confident	56 Å²	56	59.3 Å²	59.3	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-54.4	-41.7	169.8	-27	36.6	0	0	0	112.4	T684 Q723 L724 S725	T684-P721 HydrophobicContact CG2-CB 4.03Å; T684-P721 WeakPolarHBondContact CG2-O 3.3Å; P721-Q723 PolarHBondContact O-N 2.77Å; P721-L724 WeakPolarHBondContact O-CB 3.37Å; P721-L724 PolarHBondContact O-N 2.88Å; P721-S725 PolarHBondContact O-N 2.96Å
722	D	90	Very high	80.5	Confident	114 Å²	114	52.7 Å²	52.7	61%	0.61	31%	0.309	S	S	*	.	H	α-helix	trans	-63.7	-44.8	-179.3	-46.8	-61.7	0	0	0	111.7	S720 L724 S725 L726	S720-D722 VanDerWaalsContact C-N 3.26Å; S720-D722 PolarHBondContact O-N 2.97Å; S720-D722 PolarHBondContact OG-N 3.25Å; D722-L724 VanDerWaalsContact C-N 3.33Å; D722-L724 PolarHBondContact O-N 2.71Å; D722-S725 WeakPolarHBondContact O-CB 3.44Å; D722-S725 PolarHBondContact O-N 3.22Å; D722-L726 WeakPolarHBondContact O-CG 3.49Å; D722-L726 PolarHBondContact O-N 2.96Å
723	Q	91.1	Very high	83	Confident	30 Å²	30	49.6 Å²	49.6	14%	0.14	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-38.5	174.7	-75.1	171.8	-31.1	0	0	112.3	I719 S720 P721 L726 I727 L764 Q767 I820	I719-Q723 HydrophobicContact CD1-CB 3.86Å; I719-Q723 HydrophobicContact CG1-CB 3.43Å; I719-Q723 VanDerWaalsContact CG1-CB 3.43Å; S720-Q723 PolarHBondContact O-N 3.33Å; S720-Q723 WeakPolarHBondContact OG-CG 3.38Å; S720-Q723 PolarHBondContact OG-N 3.31Å; S720-Q723 VanDerWaalsContact OG-N 3.11Å; S720-Q723 PolarHBondContact OG-OE1 2.77Å; P721-Q723 PolarHBondContact O-N 2.77Å; Q723-L726 PolarHBondContact O-N 3.32Å; Q723-I727 WeakPolarHBondContact O-CG1 3.27Å; Q723-I727 PolarHBondContact O-N 3.48Å; Q723-L764 HydrophobicContact CB-CD2 3.7Å; Q723-L764 HydrophobicContact CG-CD2 4.01Å; Q723-Q767 HydrophobicContact CG-CG 4.49Å; Q723-I820 VanDerWaalsContact NE2-CD1 3.3Å
724	L	92.6	Very high	85.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-41.5	174.1	172.4	68.7	0	0	0	111.8	V656 T684 Y687 H688 W692 I719 S720 P721 D722 L726 I727 F728	V656-L724 HydrophobicContact CG1-CD1 3.94Å; T684-L724 HydrophobicContact CG2-CB 4.16Å; T684-L724 HydrophobicContact CG2-CD2 3.79Å; T684-L724 HydrophobicContact CG2-CG 4.03Å; Y687-L724 HydrophobicContact CD1-CD1 3.88Å; Y687-L724 HydrophobicContact CD1-CD2 3.81Å; Y687-L724 HydrophobicContact CD1-CG 4.45Å; Y687-L724 HydrophobicContact CE1-CD1 3.93Å; H688-L724 HydrophobicContact CB-CD2 3.83Å; W692-L724 HydrophobicContact CZ3-CD1 4.45Å; W692-L724 HydrophobicContact CZ3-CD2 4.27Å; I719-L724 HydrophobicContact CD1-CB 4.34Å; S720-L724 WeakPolarHBondContact O-CB 3.16Å; S720-L724 PolarHBondContact O-N 3.05Å; P721-L724 WeakPolarHBondContact O-CB 3.37Å; P721-L724 PolarHBondContact O-N 2.88Å; D722-L724 VanDerWaalsContact C-N 3.33Å; D722-L724 PolarHBondContact O-N 2.71Å; L724-L726 VanDerWaalsContact C-N 3.35Å; L724-L726 PolarHBondContact O-N 3.24Å; L724-I727 PolarHBondContact O-N 3.05Å; L724-F728 HydrophobicContact CD1-CD2 4.21Å; L724-F728 HydrophobicContact CD1-CE2 3.68Å; L724-F728 HydrophobicContact CD1-CZ 4.06Å; L724-F728 HydrophobicContact CD2-CE2 4.01Å; L724-F728 HydrophobicContact CG-CD2 4.03Å; L724-F728 HydrophobicContact CG-CE2 3.59Å; L724-F728 HydrophobicContact CG-CZ 4.42Å; L724-F728 WeakPolarHBondContact O-CD2 3.2Å; L724-F728 PolarHBondContact O-N 3.4Å
725	S	93	Very high	87.7	Confident	17 Å²	17	41.1 Å²	41.1	12%	0.119	25%	0.246	C	C	.	.	H	α-helix	trans	-59.3	-45.1	174.8	-176	0	0	0	0	111.3	P721 D722 I727 F728 Y729	P721-S725 PolarHBondContact O-N 2.96Å; D722-S725 WeakPolarHBondContact O-CB 3.44Å; D722-S725 PolarHBondContact O-N 3.22Å; S725-I727 VanDerWaalsContact C-N 3.28Å; S725-I727 PolarHBondContact O-N 3.15Å; S725-F728 PolarHBondContact O-N 3.01Å; S725-F728 VanDerWaalsContact O-N 3.15Å; S725-Y729 WeakPolarHBondContact O-CD2 3.42Å; S725-Y729 PolarHBondContact O-N 3.38Å
726	L	92.9	Very high	89.1	Confident	41 Å²	41	38 Å²	38	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-35.4	175.3	-67.8	172.9	0	0	0	112.9	D722 Q723 L724 A730 L763 Q767	D722-L726 WeakPolarHBondContact O-CG 3.49Å; D722-L726 PolarHBondContact O-N 2.96Å; Q723-L726 PolarHBondContact O-N 3.32Å; L724-L726 VanDerWaalsContact C-N 3.35Å; L724-L726 PolarHBondContact O-N 3.24Å; L726-A730 WeakPolarHBondContact O-CB 3.33Å; L726-A730 PolarHBondContact O-N 3.15Å; L726-L763 HydrophobicContact CB-CD2 3.95Å; L726-L763 HydrophobicContact CB-CG 4.19Å; L726-L763 HydrophobicContact CD1-CD1 4.32Å; L726-L763 HydrophobicContact CD1-CG 4.2Å; L726-L763 HydrophobicContact CD2-CD1 4.19Å; L726-L763 HydrophobicContact CD2-CD2 4.27Å; L726-L763 HydrophobicContact CD2-CG 4.37Å; L726-L763 HydrophobicContact CG-CG 4.49Å; L726-Q767 HydrophobicContact CD1-CG 4.3Å; L726-Q767 VanDerWaalsContact CD1-NE2 3.34Å
727	I	93.6	Very high	90.4	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-69.8	-43.5	175	-67.2	170.9	0	0	0	111.4	V656 I719 Q723 L724 S725 Y729 A730 I731 V760 L764 F824	V656-I727 HydrophobicContact CG2-CG2 4.2Å; I719-I727 HydrophobicContact CD1-CD1 3.47Å; I719-I727 VanDerWaalsContact CD1-CD1 3.47Å; Q723-I727 WeakPolarHBondContact O-CG1 3.27Å; Q723-I727 PolarHBondContact O-N 3.48Å; L724-I727 PolarHBondContact O-N 3.05Å; S725-I727 VanDerWaalsContact C-N 3.28Å; S725-I727 PolarHBondContact O-N 3.15Å; I727-Y729 VanDerWaalsContact C-N 3.32Å; I727-Y729 PolarHBondContact O-N 3.02Å; I727-A730 PolarHBondContact O-N 2.92Å; I727-I731 HydrophobicContact CG2-CD1 4.01Å; I727-I731 WeakPolarHBondContact O-CG1 3.46Å; I727-I731 PolarHBondContact O-N 2.97Å; I727-V760 HydrophobicContact CG1-CG1 4.48Å; I727-L764 HydrophobicContact CD1-CD1 3.86Å; I727-L764 HydrophobicContact CD1-CD2 4.03Å; I727-L764 HydrophobicContact CG1-CD1 4.06Å; I727-L764 HydrophobicContact CG1-CD2 4.01Å; I727-L764 HydrophobicContact CG1-CG 4.39Å; I727-F824 HydrophobicContact CD1-CD1 3.89Å; I727-F824 HydrophobicContact CD1-CD2 3.45Å; I727-F824 VanDerWaalsContact CD1-CD2 3.45Å; I727-F824 HydrophobicContact CD1-CE1 3.79Å; I727-F824 HydrophobicContact CD1-CE2 3.33Å; I727-F824 HydrophobicContact CD1-CG 3.74Å; I727-F824 HydrophobicContact CD1-CZ 3.5Å; I727-F824 HydrophobicContact CG2-CE1 4.03Å; I727-F824 HydrophobicContact CG2-CZ 4.39Å
728	F	94.9	Very high	91.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-41	174.5	-71.5	-59.3	0	0	0	111.7	V656 L660 L680 V683 Y687 L724 S725 I731 L732	V656-F728 HydrophobicContact CB-CD1 4.47Å; V656-F728 HydrophobicContact CB-CE1 4.02Å; V656-F728 HydrophobicContact CG1-CE1 4.31Å; V656-F728 HydrophobicContact CG1-CZ 4.47Å; V656-F728 WeakPolarHBondContact O-CE1 3.16Å; L660-F728 HydrophobicContact CB-CD1 4.07Å; L660-F728 HydrophobicContact CB-CE1 4.14Å; L660-F728 HydrophobicContact CD1-CD1 4.46Å; L660-F728 HydrophobicContact CD2-CD1 4.24Å; L660-F728 HydrophobicContact CG-CD1 4.49Å; L680-F728 HydrophobicContact CD1-CB 3.7Å; L680-F728 HydrophobicContact CD1-CD2 4.49Å; L680-F728 HydrophobicContact CD1-CG 4.18Å; L680-F728 HydrophobicContact CD2-CB 3.81Å; L680-F728 HydrophobicContact CG-CB 3.93Å; V683-F728 HydrophobicContact CG1-CE1 4.44Å; V683-F728 HydrophobicContact CG1-CE2 4.16Å; V683-F728 HydrophobicContact CG1-CZ 4.03Å; Y687-F728 HydrophobicContact CD1-CE2 4.46Å; Y687-F728 AromaticContact CD1-CZ 3.96Å; Y687-F728 HydrophobicContact CD1-CZ 3.96Å; Y687-F728 HydrophobicContact CE1-CZ 4.44Å; Y687-F728 AromaticContact CG-CZ 3.99Å; Y687-F728 HydrophobicContact CG-CZ 3.99Å; L724-F728 HydrophobicContact CD1-CD2 4.21Å; L724-F728 HydrophobicContact CD1-CE2 3.68Å; L724-F728 HydrophobicContact CD1-CZ 4.06Å; L724-F728 HydrophobicContact CD2-CE2 4.01Å; L724-F728 HydrophobicContact CG-CD2 4.03Å; L724-F728 HydrophobicContact CG-CE2 3.59Å; L724-F728 HydrophobicContact CG-CZ 4.42Å; L724-F728 WeakPolarHBondContact O-CD2 3.2Å; L724-F728 PolarHBondContact O-N 3.4Å; S725-F728 PolarHBondContact O-N 3.01Å; S725-F728 VanDerWaalsContact O-N 3.15Å; F728-I731 PolarHBondContact O-N 3.25Å; F728-L732 WeakPolarHBondContact O-CG 3.28Å; F728-L732 PolarHBondContact O-N 2.85Å
729	Y	94.4	Very high	91.5	Very high	67 Å²	67	34.3 Å²	34.3	26%	0.263	19%	0.187	S	C	.	.	H	α-helix	trans	-59.4	-45.6	171.5	-88.1	-66	0	0	0	112.3	I676 D677 L680 S725 I727 I731 L732 L733	I676-Y729 HydrophobicContact CG2-CE1 4.02Å; D677-Y729 WeakPolarHBondContact CA-OH 3.47Å; D677-Y729 WeakPolarHBondContact CB-OH 3.47Å; D677-Y729 PolarHBondContact OD1-OH 3.38Å; L680-Y729 HydrophobicContact CD2-CD1 4.08Å; L680-Y729 HydrophobicContact CD2-CD2 3.62Å; L680-Y729 HydrophobicContact CD2-CE1 4.17Å; L680-Y729 HydrophobicContact CD2-CE2 3.73Å; L680-Y729 HydrophobicContact CD2-CG 3.81Å; S725-Y729 WeakPolarHBondContact O-CD2 3.42Å; S725-Y729 PolarHBondContact O-N 3.38Å; I727-Y729 VanDerWaalsContact C-N 3.32Å; I727-Y729 PolarHBondContact O-N 3.02Å; Y729-I731 VanDerWaalsContact C-N 3.26Å; Y729-I731 PolarHBondContact O-N 3.39Å; Y729-L732 PolarHBondContact O-N 2.64Å; Y729-L732 VanDerWaalsContact O-N 3.16Å; Y729-L733 WeakPolarHBondContact O-CG 3.48Å; Y729-L733 PolarHBondContact O-N 3.08Å
730	A	94.2	Very high	91.6	Very high	14 Å²	14	36.7 Å²	36.7	12%	0.116	20%	0.2	C	C	.	.	H	α-helix	trans	-60	-36.3	176.8	0	0	0	0	0	112.3	L726 I727 L734 F756 V760	L726-A730 WeakPolarHBondContact O-CB 3.33Å; L726-A730 PolarHBondContact O-N 3.15Å; I727-A730 PolarHBondContact O-N 2.92Å; A730-L734 VanDerWaalsContact O-CB 3.29Å; A730-L734 WeakPolarHBondContact O-CB 3.41Å; A730-L734 PolarHBondContact O-N 2.92Å; A730-F756 HydrophobicContact CB-CE2 4.29Å; A730-V760 HydrophobicContact CB-CG2 3.87Å
731	I	95	Very high	91.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-40.2	175.3	-67	164.2	0	0	0	111.6	V656 D657 L660 I727 F728 Y729 L734 Q735 I832 I836 L841	V656-I731 HydrophobicContact CB-CD1 4.12Å; V656-I731 HydrophobicContact CG2-CD1 3.67Å; D657-I731 HydrophobicContact CB-CD1 4.27Å; D657-I731 HydrophobicContact CB-CG2 4.27Å; L660-I731 HydrophobicContact CD2-CB 4.27Å; L660-I731 HydrophobicContact CD2-CG2 3.8Å; I727-I731 HydrophobicContact CG2-CD1 4.01Å; I727-I731 WeakPolarHBondContact O-CG1 3.46Å; I727-I731 PolarHBondContact O-N 2.97Å; F728-I731 PolarHBondContact O-N 3.25Å; Y729-I731 VanDerWaalsContact C-N 3.26Å; Y729-I731 PolarHBondContact O-N 3.39Å; I731-L734 PolarHBondContact O-N 2.96Å; I731-Q735 WeakPolarHBondContact O-CB 3.33Å; I731-Q735 PolarHBondContact O-N 2.91Å; I731-I832 HydrophobicContact CD1-CG2 4.28Å; I731-I832 HydrophobicContact CG1-CG2 4.11Å; I731-I836 HydrophobicContact CG2-CD1 3.77Å; I731-I836 HydrophobicContact CG2-CG1 4.17Å; I731-L841 HydrophobicContact CG2-CD1 4.09Å
732	L	92.7	Very high	90.8	Very high	27 Å²	27	40.7 Å²	40.7	14%	0.141	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-39	175.2	-69.2	170.5	0	0	0	112.3	L660 M669 I676 L680 F728 Y729 T736 L841	L660-L732 HydrophobicContact CD2-CD2 4.04Å; L660-L732 HydrophobicContact CD2-CG 4.11Å; M669-L732 HydrophobicContact CE-CD1 3.81Å; M669-L732 HydrophobicContact CE-CD2 4.1Å; M669-L732 HydrophobicContact CG-CD2 4.39Å; M669-L732 HydrophobicContact SD-CD2 4.36Å; I676-L732 HydrophobicContact CG2-CD1 4.1Å; L680-L732 HydrophobicContact CD1-CD1 4.37Å; L680-L732 HydrophobicContact CD2-CD1 4.21Å; F728-L732 WeakPolarHBondContact O-CG 3.28Å; F728-L732 PolarHBondContact O-N 2.85Å; Y729-L732 PolarHBondContact O-N 2.64Å; Y729-L732 VanDerWaalsContact O-N 3.16Å; L732-T736 PolarHBondContact O-N 2.97Å; L732-T736 VanDerWaalsContact O-N 3.1Å; L732-T736 PolarHBondContact O-OG1 3.2Å; L732-L841 HydrophobicContact CD2-CD1 4.26Å
733	L	90.5	Very high	90.1	Very high	119 Å²	119	35.8 Å²	35.8	62%	0.623	19%	0.193	S	C	*	.	H	α-helix	trans	-67.8	-41.9	174.2	-69	172	0	0	0	111.6	Y729 T736 S737	Y729-L733 WeakPolarHBondContact O-CG 3.48Å; Y729-L733 PolarHBondContact O-N 3.08Å; L733-T736 WeakPolarHBondContact O-CB 3.25Å; L733-T736 PolarHBondContact O-N 3.21Å; L733-S737 PolarHBondContact O-N 2.92Å
734	L	93.7	Very high	89.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-48.2	174.6	177.2	66.7	0	0	0	111.8	A730 I731 T736 S737 L738 Q751 F756 F833 I836	A730-L734 VanDerWaalsContact O-CB 3.29Å; A730-L734 WeakPolarHBondContact O-CB 3.41Å; A730-L734 PolarHBondContact O-N 2.92Å; I731-L734 PolarHBondContact O-N 2.96Å; L734-T736 PolarHBondContact O-N 2.93Å; L734-S737 PolarHBondContact O-N 2.96Å; L734-L738 HydrophobicContact CD1-CD1 3.71Å; L734-L738 HydrophobicContact CD1-CG 3.86Å; L734-L738 HydrophobicContact CD2-CD1 4.48Å; L734-L738 HydrophobicContact CG-CD1 3.91Å; L734-L738 HydrophobicContact CG-CG 4.34Å; L734-L738 WeakPolarHBondContact O-CB 3.25Å; L734-L738 WeakPolarHBondContact O-CG 3.43Å; L734-L738 PolarHBondContact O-N 3.2Å; L734-Q751 HydrophobicContact CD1-CB 4.3Å; L734-F756 HydrophobicContact CB-CD2 4.09Å; L734-F756 HydrophobicContact CB-CE2 4.04Å; L734-F756 HydrophobicContact CD1-CB 4.49Å; L734-F756 HydrophobicContact CD1-CD2 4.1Å; L734-F756 HydrophobicContact CD1-CG 4.39Å; L734-F756 HydrophobicContact CD2-CD1 4.39Å; L734-F756 HydrophobicContact CD2-CD2 3.84Å; L734-F756 HydrophobicContact CD2-CE1 4.32Å; L734-F756 HydrophobicContact CD2-CE2 3.76Å; L734-F756 HydrophobicContact CD2-CG 4.16Å; L734-F756 HydrophobicContact CD2-CZ 4.02Å; L734-F756 HydrophobicContact CG-CD2 4.22Å; L734-F756 HydrophobicContact CG-CE2 4.37Å; L734-F833 HydrophobicContact CD1-CD2 3.55Å; L734-F833 HydrophobicContact CD1-CE2 3.53Å; L734-F833 HydrophobicContact CD2-CB 4.31Å; L734-F833 HydrophobicContact CD2-CD2 3.8Å; L734-F833 HydrophobicContact CD2-CG 4.33Å; L734-F833 HydrophobicContact CG-CD2 4.32Å; L734-I836 HydrophobicContact CD2-CB 4.16Å; L734-I836 HydrophobicContact CD2-CG1 4.39Å; L734-I836 HydrophobicContact CD2-CG2 4.16Å; L734-I836 HydrophobicContact CG-CG2 4.18Å
735	Q	92.5	Very high	88.3	Confident	30 Å²	30	43.3 Å²	43.3	14%	0.14	23%	0.23	C	C	.	.	H	α-helix	trans	-52.1	-44.1	173.6	165.3	63.8	24.7	0	0	111	I731 H739 I836 P840 L841	I731-Q735 WeakPolarHBondContact O-CB 3.33Å; I731-Q735 PolarHBondContact O-N 2.91Å; Q735-H739 WeakPolarHBondContact O-CB 3.36Å; Q735-H739 PolarHBondContact O-N 3.47Å; Q735-H739 VanDerWaalsContact O-N 3.15Å; Q735-H739 PolarHBondContact OE1-CD2 3.22Å; Q735-H739 VanDerWaalsContact OE1-CD2 3.25Å; Q735-I836 HydrophobicContact CB-CG2 4.27Å; Q735-P840 VanDerWaalsContact OE1-CA 3.3Å; Q735-L841 HydrophobicContact CB-CD1 4.09Å; Q735-L841 HydrophobicContact CB-CG 4.45Å; Q735-L841 VanDerWaalsContact CD-N 3.34Å; Q735-L841 HydrophobicContact CG-CB 4.04Å; Q735-L841 HydrophobicContact CG-CD1 4.16Å; Q735-L841 HydrophobicContact CG-CG 4.23Å
736	T	88.9	Confident	87.4	Confident	57 Å²	57	45.1 Å²	45.1	35%	0.35	24%	0.243	S	C	.	.	H	α-helix	trans	-66.8	-49	178.7	-56.9	0	0	0	0	111.7	L69 L732 L733 L734 L738 N740 A743	L69-T736 HydrophobicContact CD1-CG2 4.03Å; L732-T736 PolarHBondContact O-N 2.97Å; L732-T736 VanDerWaalsContact O-N 3.1Å; L732-T736 PolarHBondContact O-OG1 3.2Å; L733-T736 WeakPolarHBondContact O-CB 3.25Å; L733-T736 PolarHBondContact O-N 3.21Å; L734-T736 PolarHBondContact O-N 2.93Å; T736-L738 PolarHBondContact O-N 3.45Å; T736-N740 HydrophobicContact CG2-CB 4.21Å; T736-N740 WeakPolarHBondContact O-CB 3.43Å; T736-N740 PolarHBondContact O-N 3.41Å; T736-A743 HydrophobicContact CG2-CB 4.31Å
737	S	89.9	Confident	86.1	Confident	23 Å²	23	48.8 Å²	48.8	16%	0.161	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-40.6	179	-179.4	0	0	0	0	112.9	L733 L734 G749 Q751	L733-S737 PolarHBondContact O-N 2.92Å; L734-S737 PolarHBondContact O-N 2.96Å; S737-G749 PolarHBondContact OG-O 2.91Å; S737-Q751 PolarHBondContact OG-N 3.45Å
738	L	90.5	Very high	84.8	Confident	13 Å²	13	55 Å²	55	7%	0.068	31%	0.305	C	S	.	.	H	α-helix	trans	-76.8	-39.4	-176.3	-69.2	-178.4	0	0	0	113.6	L734 T736 K750 F833 I836 K837	L734-L738 HydrophobicContact CD1-CD1 3.71Å; L734-L738 HydrophobicContact CD1-CG 3.86Å; L734-L738 HydrophobicContact CD2-CD1 4.48Å; L734-L738 HydrophobicContact CG-CD1 3.91Å; L734-L738 HydrophobicContact CG-CG 4.34Å; L734-L738 WeakPolarHBondContact O-CB 3.25Å; L734-L738 WeakPolarHBondContact O-CG 3.43Å; L734-L738 PolarHBondContact O-N 3.2Å; T736-L738 PolarHBondContact O-N 3.45Å; L738-K750 PolarHBondContact O-NZ 3.25Å; L738-F833 HydrophobicContact CD1-CE2 4.38Å; L738-F833 HydrophobicContact CD1-CZ 4.37Å; L738-F833 HydrophobicContact CD2-CE2 4.48Å; L738-F833 HydrophobicContact CD2-CZ 4.16Å; L738-I836 HydrophobicContact CD1-CG2 4.2Å; L738-K837 HydrophobicContact CD1-CB 3.89Å; L738-K837 HydrophobicContact CD1-CG 4.45Å
739	H	88.7	Confident	83.7	Confident	68 Å²	68	56 Å²	56	32%	0.315	32%	0.315	S	S	.	.	H	α-helix	trans	-111	-21.3	-167.7	-63	-72.7	0	0	0	115.2	Q735 V741 I836	Q735-H739 WeakPolarHBondContact O-CB 3.36Å; Q735-H739 PolarHBondContact O-N 3.47Å; Q735-H739 VanDerWaalsContact O-N 3.15Å; Q735-H739 PolarHBondContact OE1-CD2 3.22Å; Q735-H739 VanDerWaalsContact OE1-CD2 3.25Å; H739-V741 PolarHBondContact O-N 3.02Å; H739-I836 PolarHBondContact NE2-O 3.1Å
740	N	85.8	Confident	83.2	Confident	53 Å²	53	58.4 Å²	58.4	28%	0.283	33%	0.327	S	S	.	.			trans	-78.1	115.2	174.9	-173.1	-26.7	0	0	0	110.1	T736 N742 A743 A744	T736-N740 HydrophobicContact CG2-CB 4.21Å; T736-N740 WeakPolarHBondContact O-CB 3.43Å; T736-N740 PolarHBondContact O-N 3.41Å; N740-N742 PolarHBondContact O-N 2.64Å; N740-N742 VanDerWaalsContact O-N 3.15Å; N740-N742 WeakPolarHBondContact OD1-CB 3.45Å; N740-N742 PolarHBondContact OD1-N 3.43Å; N740-A743 HydrophobicContact CB-CB 3.83Å; N740-A743 PolarHBondContact O-N 2.77Å; N740-A744 WeakPolarHBondContact O-CB 3.25Å; N740-A744 PolarHBondContact O-N 3.07Å
741	V	81.2	Confident	82.9	Confident	95 Å²	95	59 Å²	59	58%	0.576	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.3	-178	179.5	0	0	0	0	112.8	H739 K745	H739-V741 PolarHBondContact O-N 3.02Å; V741-K745 WeakPolarHBondContact O-CD 3.33Å; V741-K745 WeakPolarHBondContact O-CG 3.35Å
742	N	80.4	Confident	82.6	Confident	84 Å²	84	64.7 Å²	64.7	45%	0.449	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-43.1	176.7	-63.3	-12.8	0	0	0	111	L69 N740 A744 K745 S746	L69-N742 HydrophobicContact CD2-CB 3.59Å; N740-N742 PolarHBondContact O-N 2.64Å; N740-N742 VanDerWaalsContact O-N 3.15Å; N740-N742 WeakPolarHBondContact OD1-CB 3.45Å; N740-N742 PolarHBondContact OD1-N 3.43Å; N742-A744 VanDerWaalsContact C-N 3.32Å; N742-A744 PolarHBondContact O-N 3.24Å; N742-K745 PolarHBondContact O-N 3.4Å; N742-K745 VanDerWaalsContact O-N 3.08Å; N742-S746 PolarHBondContact O-N 3.29Å
743	A	76.3	Confident	82.7	Confident	10 Å²	10	65.1 Å²	65.1	8%	0.083	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-58.4	-45.1	174.7	0	0	0	0	0	111.4	L69 T736 N740 K745 S746	L69-A743 HydrophobicContact CD1-CB 3.79Å; T736-A743 HydrophobicContact CG2-CB 4.31Å; N740-A743 HydrophobicContact CB-CB 3.83Å; N740-A743 PolarHBondContact O-N 2.77Å; A743-K745 PolarHBondContact O-N 2.99Å; A743-S746 VanDerWaalsContact O-CB 3.28Å; A743-S746 WeakPolarHBondContact O-CB 3.33Å; A743-S746 PolarHBondContact O-N 3.04Å; A743-S746 PolarHBondContact O-OG 3.25Å
744	A	71	Confident	82.8	Confident	27 Å²	27	64 Å²	64	22%	0.223	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-63.8	-8.7	177.3	0	0	0	0	0	115.2	N740 N742 K750	N740-A744 WeakPolarHBondContact O-CB 3.25Å; N740-A744 PolarHBondContact O-N 3.07Å; N742-A744 VanDerWaalsContact C-N 3.32Å; N742-A744 PolarHBondContact O-N 3.24Å; A744-K750 HydrophobicContact CB-CD 4.28Å; A744-K750 VanDerWaalsContact CB-CE 3.43Å; A744-K750 HydrophobicContact CB-CG 3.81Å
745	K	73.5	Confident	82.7	Confident	161 Å²	161	68.6 Å²	68.6	70%	0.7	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-107.8	-3.8	174.1	-70	174.5	-178.7	179.8	0	113.3	V741 N742 A743	V741-K745 WeakPolarHBondContact O-CD 3.33Å; V741-K745 WeakPolarHBondContact O-CG 3.35Å; N742-K745 PolarHBondContact O-N 3.4Å; N742-K745 VanDerWaalsContact O-N 3.08Å; A743-K745 PolarHBondContact O-N 2.99Å
746	S	74.9	Confident	82.8	Confident	56 Å²	56	67.3 Å²	67.3	39%	0.392	38%	0.379	S	S	.	.	S	Bend	trans	-67.6	168.4	174.2	72.3	0	0	0	0	111.1	N742 A743 L748 G749	N742-S746 PolarHBondContact O-N 3.29Å; A743-S746 VanDerWaalsContact O-CB 3.28Å; A743-S746 WeakPolarHBondContact O-CB 3.33Å; A743-S746 PolarHBondContact O-N 3.04Å; A743-S746 PolarHBondContact O-OG 3.25Å; S746-L748 PolarHBondContact O-N 3.29Å; S746-L748 PolarHBondContact OG-N 3.16Å; S746-G749 PolarHBondContact O-N 3.11Å
747	S	65	Low	83	Confident	118 Å²	118	65.6 Å²	65.6	83%	0.825	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.4	174.5	46.3	0	0	0	0	114	G749	S747-G749 VanDerWaalsContact C-N 3.32Å
748	L	66.2	Low	83	Confident	132 Å²	132	70 Å²	70	69%	0.691	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-16.6	173.5	-80.9	70.7	0	0	0	112.7	S746	S746-L748 PolarHBondContact O-N 3.29Å; S746-L748 PolarHBondContact OG-N 3.16Å
749	G	72.1	Confident	83	Confident	22 Å²	22	72.8 Å²	72.8	23%	0.227	40%	0.399	C	S	.	.			trans	59.2	-142.4	-179.3	0	0	0	0	0	113.9	S737 S746 S747	S737-G749 PolarHBondContact OG-O 2.91Å; S746-G749 PolarHBondContact O-N 3.11Å; S747-G749 VanDerWaalsContact C-N 3.32Å
750	K	83.8	Confident	83.1	Confident	117 Å²	117	69.7 Å²	69.7	51%	0.509	39%	0.385	S	S	.	.	S	Bend	trans	-99.7	130.3	171.8	-65.9	-159.5	176.9	-156	0	110.3	L738 A744 N752	L738-K750 PolarHBondContact O-NZ 3.25Å; A744-K750 HydrophobicContact CB-CD 4.28Å; A744-K750 VanDerWaalsContact CB-CE 3.43Å; A744-K750 HydrophobicContact CB-CG 3.81Å; K750-N752 PolarHBondContact O-N 3.35Å
751	Q	87.5	Confident	83.3	Confident	28 Å²	28	68.2 Å²	68.2	13%	0.131	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-63.4	127	174.1	-163.6	177	28.1	0	0	110.5	L734 S737 Q755 F756 N759 F833	L734-Q751 HydrophobicContact CD1-CB 4.3Å; S737-Q751 PolarHBondContact OG-N 3.45Å; Q751-Q755 HydrophobicContact CG-CB 3.95Å; Q751-Q755 HydrophobicContact CG-CG 4.06Å; Q751-Q755 PolarHBondContact NE2-O 2.77Å; Q751-F756 HydrophobicContact CG-CB 4.23Å; Q751-N759 PolarHBondContact NE2-ND2 3.36Å; Q751-F833 WeakPolarHBondContact O-CE2 3.43Å; Q751-F833 WeakPolarHBondContact O-CZ 3.44Å
752	N	90.8	Very high	83.6	Confident	118 Å²	118	67 Å²	67	63%	0.631	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-87.4	161.6	173.4	-76	-30	0	0	0	111.2	K750 S754 Q755 F756	K750-N752 PolarHBondContact O-N 3.35Å; N752-S754 VanDerWaalsContact C-N 3.34Å; N752-S754 PolarHBondContact O-N 3.03Å; N752-Q755 WeakPolarHBondContact O-CA 3.42Å; N752-Q755 WeakPolarHBondContact O-CB 3.42Å; N752-Q755 PolarHBondContact O-N 3Å; N752-F756 PolarHBondContact O-N 3.19Å
753	V	93.5	Very high	83.8	Confident	37 Å²	37	66.1 Å²	66.1	22%	0.224	36%	0.361	C	S	.	.	H	α-helix	trans	-48.1	-53.4	-178.8	-177.8	0	0	0	0	111.5	Q755 F756 I757 T830 F833	V753-Q755 VanDerWaalsContact C-N 3.28Å; V753-Q755 PolarHBondContact O-N 3.48Å; V753-F756 WeakPolarHBondContact O-CB 3.26Å; V753-F756 PolarHBondContact O-N 2.86Å; V753-F756 VanDerWaalsContact O-N 3.11Å; V753-I757 HydrophobicContact CG1-CD1 3.73Å; V753-I757 HydrophobicContact CG1-CG1 4.42Å; V753-I757 WeakPolarHBondContact O-CG1 3.48Å; V753-I757 PolarHBondContact O-N 2.98Å; V753-T830 HydrophobicContact CG1-CG2 4.24Å; V753-F833 HydrophobicContact CB-CD1 4.44Å; V753-F833 HydrophobicContact CB-CE1 4.45Å; V753-F833 HydrophobicContact CG2-CD1 3.53Å; V753-F833 HydrophobicContact CG2-CE1 3.43Å; V753-F833 VanDerWaalsContact CG2-CE1 3.43Å; V753-F833 HydrophobicContact CG2-CG 4.16Å; V753-F833 HydrophobicContact CG2-CZ 3.98Å
754	S	92.7	Very high	84.2	Confident	95 Å²	95	65.8 Å²	65.8	66%	0.664	36%	0.358	S	S	*	.	H	α-helix	trans	-63	-31.7	-178.9	-38	0	0	0	0	113.3	N752 K758	N752-S754 VanDerWaalsContact C-N 3.34Å; N752-S754 PolarHBondContact O-N 3.03Å; S754-K758 VanDerWaalsContact O-CB 3.25Å; S754-K758 WeakPolarHBondContact O-CB 3.47Å; S754-K758 PolarHBondContact O-N 3.1Å
755	Q	91.4	Very high	84.3	Confident	97 Å²	97	67.6 Å²	67.6	45%	0.453	36%	0.364	S	S	.	.	H	α-helix	trans	-76.3	-32.5	176.3	-167.1	68.4	59	0	0	111.7	Q751 N752 V753 N759	Q751-Q755 HydrophobicContact CG-CB 3.95Å; Q751-Q755 HydrophobicContact CG-CG 4.06Å; Q751-Q755 PolarHBondContact NE2-O 2.77Å; N752-Q755 WeakPolarHBondContact O-CA 3.42Å; N752-Q755 WeakPolarHBondContact O-CB 3.42Å; N752-Q755 PolarHBondContact O-N 3Å; V753-Q755 VanDerWaalsContact C-N 3.28Å; V753-Q755 PolarHBondContact O-N 3.48Å; Q755-N759 PolarHBondContact NE2-OD1 3.19Å; Q755-N759 VanDerWaalsContact O-CB 3.24Å; Q755-N759 WeakPolarHBondContact O-CB 3.46Å; Q755-N759 PolarHBondContact O-N 3.23Å; Q755-N759 PolarHBondContact O-OD1 2.85Å
756	F	94	Very high	83.8	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.009	36%	0.362	C	S	.	.	H	α-helix	trans	-67	-50	171.2	175.8	-108.1	0	0	0	111	A730 L734 Q751 N752 V753 K758 N759 V760 L829 I832 F833	A730-F756 HydrophobicContact CB-CE2 4.29Å; L734-F756 HydrophobicContact CB-CD2 4.09Å; L734-F756 HydrophobicContact CB-CE2 4.04Å; L734-F756 HydrophobicContact CD1-CB 4.49Å; L734-F756 HydrophobicContact CD1-CD2 4.1Å; L734-F756 HydrophobicContact CD1-CG 4.39Å; L734-F756 HydrophobicContact CD2-CD1 4.39Å; L734-F756 HydrophobicContact CD2-CD2 3.84Å; L734-F756 HydrophobicContact CD2-CE1 4.32Å; L734-F756 HydrophobicContact CD2-CE2 3.76Å; L734-F756 HydrophobicContact CD2-CG 4.16Å; L734-F756 HydrophobicContact CD2-CZ 4.02Å; L734-F756 HydrophobicContact CG-CD2 4.22Å; L734-F756 HydrophobicContact CG-CE2 4.37Å; Q751-F756 HydrophobicContact CG-CB 4.23Å; N752-F756 PolarHBondContact O-N 3.19Å; V753-F756 WeakPolarHBondContact O-CB 3.26Å; V753-F756 PolarHBondContact O-N 2.86Å; V753-F756 VanDerWaalsContact O-N 3.11Å; F756-K758 PolarHBondContact O-N 3.39Å; F756-N759 PolarHBondContact O-N 3.03Å; F756-V760 HydrophobicContact CD2-CG2 4.16Å; F756-V760 HydrophobicContact CE1-CG2 4.39Å; F756-V760 HydrophobicContact CE2-CG2 3.77Å; F756-V760 HydrophobicContact CZ-CG2 3.9Å; F756-V760 WeakPolarHBondContact O-CG2 3.21Å; F756-V760 PolarHBondContact O-N 3.08Å; F756-L829 HydrophobicContact CD1-CB 4.5Å; F756-L829 HydrophobicContact CE1-CB 4.17Å; F756-L829 HydrophobicContact CE1-CD2 4.11Å; F756-L829 WeakPolarHBondContact CE1-O 3.37Å; F756-I832 HydrophobicContact CE1-CG2 4.28Å; F756-I832 HydrophobicContact CZ-CG2 4.2Å; F756-F833 HydrophobicContact CB-CD2 3.74Å; F756-F833 HydrophobicContact CB-CE2 4.18Å; F756-F833 HydrophobicContact CD1-CB 4.02Å; F756-F833 HydrophobicContact CD1-CD2 4.09Å; F756-F833 HydrophobicContact CE1-CB 4.4Å; F756-F833 AromaticContact CG-CD2 3.98Å; F756-F833 HydrophobicContact CG-CD2 3.98Å
757	I	93.3	Very high	82.9	Confident	22 Å²	22	67.2 Å²	67.2	11%	0.113	36%	0.362	C	S	.	.	H	α-helix	trans	-57.9	-48.3	177.3	-67.1	171.4	0	0	0	111	V753 V760 H761 N826 L829 T830	V753-I757 HydrophobicContact CG1-CD1 3.73Å; V753-I757 HydrophobicContact CG1-CG1 4.42Å; V753-I757 WeakPolarHBondContact O-CG1 3.48Å; V753-I757 PolarHBondContact O-N 2.98Å; I757-V760 PolarHBondContact O-N 2.74Å; I757-H761 PolarHBondContact O-CD2 3.09Å; I757-H761 VanDerWaalsContact O-CD2 3.27Å; I757-H761 PolarHBondContact O-N 2.91Å; I757-N826 HydrophobicContact CD1-CB 4.47Å; I757-N826 HydrophobicContact CG2-CB 4.44Å; I757-N826 WeakPolarHBondContact CG2-OD1 3.41Å; I757-L829 HydrophobicContact CG1-CB 3.86Å; I757-L829 HydrophobicContact CG2-CD1 4.43Å; I757-T830 WeakPolarHBondContact CD1-OG1 3.35Å
758	K	90.8	Very high	81.8	Confident	116 Å²	116	67 Å²	67	50%	0.504	36%	0.358	S	S	.	.	H	α-helix	trans	-59.2	-53.4	176.4	177.7	169.1	177.8	175	0	111.3	S754 F756 V760 H761 D762	S754-K758 VanDerWaalsContact O-CB 3.25Å; S754-K758 WeakPolarHBondContact O-CB 3.47Å; S754-K758 PolarHBondContact O-N 3.1Å; F756-K758 PolarHBondContact O-N 3.39Å; K758-V760 PolarHBondContact O-N 3.43Å; K758-H761 PolarHBondContact O-N 3.39Å; K758-D762 WeakPolarHBondContact CE-OD2 3.35Å; K758-D762 VanDerWaalsContact CG-OD2 3.22Å; K758-D762 WeakPolarHBondContact CG-OD2 3.28Å; K758-D762 IonicContact NZ-OD2 2.69Å; K758-D762 WeakPolarHBondContact O-CB 3.41Å; K758-D762 PolarHBondContact O-N 2.73Å
759	N	90.4	Very high	80.2	Confident	71 Å²	71	65.7 Å²	65.7	38%	0.38	36%	0.36	S	S	.	.	H	α-helix	trans	-58.7	-36.2	-178	-73	19.6	0	0	0	112.5	Q751 Q755 F756 L763	Q751-N759 PolarHBondContact NE2-ND2 3.36Å; Q755-N759 PolarHBondContact NE2-OD1 3.19Å; Q755-N759 VanDerWaalsContact O-CB 3.24Å; Q755-N759 WeakPolarHBondContact O-CB 3.46Å; Q755-N759 PolarHBondContact O-N 3.23Å; Q755-N759 PolarHBondContact O-OD1 2.85Å; F756-N759 PolarHBondContact O-N 3.03Å; N759-L763 WeakPolarHBondContact O-CB 3.25Å; N759-L763 PolarHBondContact O-N 2.88Å
760	V	91.4	Very high	78.3	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.012	39%	0.389	C	S	.	.	H	α-helix	trans	-71.6	-45	178.4	172.7	0	0	0	0	111.7	I727 A730 F756 I757 K758 L763 L764 L829	I727-V760 HydrophobicContact CG1-CG1 4.48Å; A730-V760 HydrophobicContact CB-CG2 3.87Å; F756-V760 HydrophobicContact CD2-CG2 4.16Å; F756-V760 HydrophobicContact CE1-CG2 4.39Å; F756-V760 HydrophobicContact CE2-CG2 3.77Å; F756-V760 HydrophobicContact CZ-CG2 3.9Å; F756-V760 WeakPolarHBondContact O-CG2 3.21Å; F756-V760 PolarHBondContact O-N 3.08Å; I757-V760 PolarHBondContact O-N 2.74Å; K758-V760 PolarHBondContact O-N 3.43Å; V760-L763 PolarHBondContact O-N 2.79Å; V760-L764 HydrophobicContact CG1-CD1 3.63Å; V760-L764 HydrophobicContact CG1-CG 4.35Å; V760-L764 WeakPolarHBondContact O-CB 3.46Å; V760-L764 VanDerWaalsContact O-CG 3.26Å; V760-L764 WeakPolarHBondContact O-CG 3.35Å; V760-L764 PolarHBondContact O-N 2.95Å; V760-L829 HydrophobicContact CB-CD1 4.15Å; V760-L829 HydrophobicContact CB-CD2 4.4Å; V760-L829 HydrophobicContact CG1-CD1 3.93Å; V760-L829 HydrophobicContact CG1-CD2 3.86Å
761	H	89.2	Confident	75.7	Confident	23 Å²	23	70.1 Å²	70.1	11%	0.106	40%	0.402	C	S	.	.	H	α-helix	trans	-66	-44.8	176.1	-74.9	-57.8	0	0	0	112.3	I757 K758 L763 L764 L765 F824 N826	I757-H761 PolarHBondContact O-CD2 3.09Å; I757-H761 VanDerWaalsContact O-CD2 3.27Å; I757-H761 PolarHBondContact O-N 2.91Å; K758-H761 PolarHBondContact O-N 3.39Å; H761-L763 PolarHBondContact O-N 3.48Å; H761-L764 PolarHBondContact O-N 3.34Å; H761-L765 HydrophobicContact CB-CD1 4.22Å; H761-L765 VanDerWaalsContact O-CB 3.31Å; H761-L765 WeakPolarHBondContact O-CB 3.21Å; H761-L765 WeakPolarHBondContact O-CD1 3.43Å; H761-L765 WeakPolarHBondContact O-CG 3.47Å; H761-L765 PolarHBondContact O-N 2.95Å; H761-F824 PolarHBondContact CE1-O 3.35Å; H761-F824 VanDerWaalsContact CE1-O 3.26Å; H761-N826 PolarHBondContact NE2-OD1 3.18Å
762	D	86.7	Confident	72.9	Confident	69 Å²	69	73.2 Å²	73.2	37%	0.369	43%	0.425	S	S	.	.	H	α-helix	trans	-58.8	-37.2	176	-68.4	-3.7	0	0	0	110.9	K758 N766	K758-D762 WeakPolarHBondContact CE-OD2 3.35Å; K758-D762 VanDerWaalsContact CG-OD2 3.22Å; K758-D762 WeakPolarHBondContact CG-OD2 3.28Å; K758-D762 IonicContact NZ-OD2 2.69Å; K758-D762 WeakPolarHBondContact O-CB 3.41Å; K758-D762 PolarHBondContact O-N 2.73Å; D762-N766 WeakPolarHBondContact O-CB 3.37Å; D762-N766 PolarHBondContact O-N 3.19Å; D762-N766 PolarHBondContact O-ND2 2.91Å
763	L	85.3	Confident	69.9	Low	65 Å²	65	70.9 Å²	70.9	34%	0.34	42%	0.418	S	S	.	.	H	α-helix	trans	-74.5	-35.4	178.7	-176.8	60.8	0	0	0	113.4	L726 N759 V760 H761 Q767	L726-L763 HydrophobicContact CB-CD2 3.95Å; L726-L763 HydrophobicContact CB-CG 4.19Å; L726-L763 HydrophobicContact CD1-CD1 4.32Å; L726-L763 HydrophobicContact CD1-CG 4.2Å; L726-L763 HydrophobicContact CD2-CD1 4.19Å; L726-L763 HydrophobicContact CD2-CD2 4.27Å; L726-L763 HydrophobicContact CD2-CG 4.37Å; L726-L763 HydrophobicContact CG-CG 4.49Å; N759-L763 WeakPolarHBondContact O-CB 3.25Å; N759-L763 PolarHBondContact O-N 2.88Å; V760-L763 PolarHBondContact O-N 2.79Å; H761-L763 PolarHBondContact O-N 3.48Å; L763-Q767 PolarHBondContact O-NE2 3.24Å
764	L	84.3	Confident	66.9	Low	3 Å²	3	75.2 Å²	75.2	2%	0.016	45%	0.447	C	S	.	.	H	α-helix	trans	-80.5	-32.6	-178.4	-73.9	170.6	0	0	0	113.7	Q723 I727 V760 H761 I820	Q723-L764 HydrophobicContact CB-CD2 3.7Å; Q723-L764 HydrophobicContact CG-CD2 4.01Å; I727-L764 HydrophobicContact CD1-CD1 3.86Å; I727-L764 HydrophobicContact CD1-CD2 4.03Å; I727-L764 HydrophobicContact CG1-CD1 4.06Å; I727-L764 HydrophobicContact CG1-CD2 4.01Å; I727-L764 HydrophobicContact CG1-CG 4.39Å; V760-L764 HydrophobicContact CG1-CD1 3.63Å; V760-L764 HydrophobicContact CG1-CG 4.35Å; V760-L764 WeakPolarHBondContact O-CB 3.46Å; V760-L764 VanDerWaalsContact O-CG 3.26Å; V760-L764 WeakPolarHBondContact O-CG 3.35Å; V760-L764 PolarHBondContact O-N 2.95Å; H761-L764 PolarHBondContact O-N 3.34Å; L764-I820 HydrophobicContact CB-CG2 4.11Å; L764-I820 HydrophobicContact CD1-CG2 3.93Å; L764-I820 HydrophobicContact CG-CG2 4.49Å
765	L	72.9	Confident	64	Low	66 Å²	66	75.3 Å²	75.3	35%	0.346	45%	0.447	S	S	.	.	H	α-helix	trans	-86.7	-30.7	-175.5	-64.2	169.1	0	0	0	113	H761 Q767 S817	H761-L765 HydrophobicContact CB-CD1 4.22Å; H761-L765 VanDerWaalsContact O-CB 3.31Å; H761-L765 WeakPolarHBondContact O-CB 3.21Å; H761-L765 WeakPolarHBondContact O-CD1 3.43Å; H761-L765 WeakPolarHBondContact O-CG 3.47Å; H761-L765 PolarHBondContact O-N 2.95Å; L765-Q767 PolarHBondContact O-N 2.99Å; L765-S817 WeakPolarHBondContact CD2-OG 3.44Å
766	N	64.4	Low	61.2	Low	124 Å²	124	79.4 Å²	79.4	66%	0.663	46%	0.464	S	S	*	.	S	Bend	trans	-85.9	25.9	-179.5	-65.7	-51.2	0	0	0	113.5	D762 P768	D762-N766 WeakPolarHBondContact O-CB 3.37Å; D762-N766 PolarHBondContact O-N 3.19Å; D762-N766 PolarHBondContact O-ND2 2.91Å; N766-P768 VanDerWaalsContact O-CD 3.31Å; N766-P768 WeakPolarHBondContact O-CD 3.1Å
767	Q	55.3	Low	58.1	Low	84 Å²	84	83.9 Å²	83.9	39%	0.393	49%	0.486	S	S	.	.			trans	-84.3	111.6	175.1	-65.7	-57.2	-48.2	0	0	110.1	Q723 L726 L763 L765 S769	Q723-Q767 HydrophobicContact CG-CG 4.49Å; L726-Q767 HydrophobicContact CD1-CG 4.3Å; L726-Q767 VanDerWaalsContact CD1-NE2 3.34Å; L763-Q767 PolarHBondContact O-NE2 3.24Å; L765-Q767 PolarHBondContact O-N 2.99Å; Q767-S769 PolarHBondContact O-N 3.01Å
768	P	41.2	Very low	55.2	Low	113 Å²	113	87.4 Å²	87.4	73%	0.734	52%	0.518	S	S	*	.			trans	-65.7	135.3	174.2	28.2	-33.8	0	0	0	109.9	N766 S770	N766-P768 VanDerWaalsContact O-CD 3.31Å; N766-P768 WeakPolarHBondContact O-CD 3.1Å; P768-S770 PolarHBondContact O-N 3.42Å
769	S	33.3	Very low	52.5	Low	105 Å²	105	91.5 Å²	91.5	73%	0.734	54%	0.536	S	S	*	.	S	Bend	trans	-65.8	127.1	176.9	40.6	0	0	0	0	111.4	Q767	Q767-S769 PolarHBondContact O-N 3.01Å
770	S	31.8	Very low	49.8	Very low	119 Å²	119	92.3 Å²	92.3	83%	0.832	55%	0.548	S	S	*	.			trans	70.5	107.5	173.9	72.2	0	0	0	0	118.1	P768	P768-S770 PolarHBondContact O-N 3.42Å
771	S	28.9	Very low	46.9	Very low	113 Å²	113	100.6 Å²	100.6	79%	0.79	58%	0.583	S	S	*	*				-145.3	136.4	122.9	61.7	0	0	0	0	108.7
772	P	29.7	Very low	44.2	Very low	93 Å²	93	104.6 Å²	104.6	60%	0.604	61%	0.614	S	S	*	*			trans	-75.2	142.4	-178.1	30	-34.1	0	0	0	111.1	M777	P772-M777 HydrophobicContact CG-CE 4.24Å; P772-M777 HydrophobicContact CG-SD 4.33Å
773	S	27.7	Very low	41.7	Very low	70 Å²	70	110 Å²	110	49%	0.49	63%	0.634	S	S	.	*			trans	-61.4	139.8	179.7	50.8	0	0	0	0	111.9	S775	S773-S775 PolarHBondContact O-N 2.95Å
774	P	29.3	Very low	39.3	Very low	128 Å²	128	115.2 Å²	115.2	83%	0.831	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-13.4	-169.8	-26.8	35.9	0	0	0	116.4
775	S	32.2	Very low	36.8	Very low	96 Å²	96	119.5 Å²	119.5	67%	0.671	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-20	-172	48.9	0	0	0	0	115.1	S773	S773-S775 PolarHBondContact O-N 2.95Å
776	F	32.8	Very low	34.9	Very low	184 Å²	184	123.7 Å²	123.7	81%	0.807	72%	0.719	S	S	*	*	S	Bend	trans	-103	-9.5	-175.5	-96.1	-89.3	0	0	0	115.6	A778	F776-A778 PolarHBondContact O-N 3.26Å
777	M	30.1	Very low	33.6	Very low	96 Å²	96	125.6 Å²	125.6	47%	0.473	72%	0.724	S	S	.	*			trans	-91.9	5.4	-168.4	-124.7	-171.5	-169.4	0	0	116.1	P772 K779	P772-M777 HydrophobicContact CG-CE 4.24Å; P772-M777 HydrophobicContact CG-SD 4.33Å; M777-K779 VanDerWaalsContact C-N 3.35Å; M777-K779 PolarHBondContact O-N 3.37Å
778	A	32.1	Very low	32.6	Very low	96 Å²	96	128 Å²	128	79%	0.793	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-1	-171.3	0	0	0	0	0	116.1	F776	F776-A778 PolarHBondContact O-N 3.26Å
779	K	34	Very low	32	Very low	202 Å²	202	130.6 Å²	130.6	88%	0.878	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.8	7.1	-173.6	-73.4	-174.1	175.3	178.7	0	116.1	M777	M777-K779 VanDerWaalsContact C-N 3.35Å; M777-K779 PolarHBondContact O-N 3.37Å
780	S	33.8	Very low	32.2	Very low	88 Å²	88	131 Å²	131	62%	0.615	75%	0.745	S	S	*	*			trans	-124.5	-8.3	-166.7	-44.4	0	0	0	0	116.4	S782	S780-S782 VanDerWaalsContact C-N 3.34Å; S780-S782 PolarHBondContact O-N 3Å; S780-S782 VanDerWaalsContact O-N 3.15Å
781	K	30.2	Very low	32.4	Very low	175 Å²	175	132 Å²	132	76%	0.761	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	41.9	-169.1	-69.6	-169.9	171.8	-174.8	0	115.3
782	S	33.1	Very low	32.8	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	5.5	-177	59.8	0	0	0	0	115.5	S780	S780-S782 VanDerWaalsContact C-N 3.34Å; S780-S782 PolarHBondContact O-N 3Å; S780-S782 VanDerWaalsContact O-N 3.15Å
783	K	33.5	Very low	32.9	Very low	182 Å²	182	138.2 Å²	138.2	79%	0.791	76%	0.758	S	S	*	*	S	Bend	trans	-143.6	158.1	174.5	-64.6	-176.3	-179.5	176.5	0	109.9
784	I	35	Very low	33.6	Very low	176 Å²	176	139.1 Å²	139.1	90%	0.903	76%	0.764	S	S	*	*			trans	73.3	76.2	-178.2	-44.2	168.5	0	0	0	113.4
785	A	31.2	Very low	33.8	Very low	93 Å²	93	137 Å²	137	77%	0.769	77%	0.766	S	S	*	*			trans	-157	93.1	158	0	0	0	0	0	108.5
786	N	32.8	Very low	34.1	Very low	154 Å²	154	139 Å²	139	82%	0.824	77%	0.769	S	S	*	*			trans	-169.6	148	170.7	-103.8	-15.7	0	0	0	109
787	H	37.9	Very low	34	Very low	164 Å²	164	138.2 Å²	138.2	76%	0.759	77%	0.77	S	S	*	*			trans	67.6	136.7	-172.2	-54.8	-56.9	0	0	0	115.8
788	N	34.5	Very low	34.1	Very low	134 Å²	134	141.1 Å²	141.1	72%	0.717	79%	0.787	S	S	*	*			cis	-157.9	135.1	-13.5	-108.1	-2.4	0	0	0	108.3
789	D	29	Very low	34	Very low	168 Å²	168	141.7 Å²	141.7	90%	0.898	78%	0.78	S	S	*	*			trans	-96.1	130.6	163.6	-64.1	-63.8	0	0	0	109.3
790	V	36.3	Very low	34.1	Very low	114 Å²	114	139.2 Å²	139.2	69%	0.691	78%	0.775	S	S	*	*			trans	-143.3	137.9	167.4	-173.2	0	0	0	0	108.2
791	V	36.1	Very low	33.9	Very low	140 Å²	140	140.8 Å²	140.8	85%	0.848	78%	0.777	S	S	*	*			trans	-135.8	127.7	177.4	178.5	0	0	0	0	108.2
792	D	36.5	Very low	34	Very low	126 Å²	126	137.3 Å²	137.3	67%	0.674	77%	0.77	S	S	*	*			trans	-98.2	139.7	-170.1	-69.7	32.5	0	0	0	112.3	S794	D792-S794 VanDerWaalsContact C-N 3.34Å; D792-S794 PolarHBondContact O-N 2.9Å
793	E	33.2	Very low	33.9	Very low	209 Å²	209	140 Å²	140	98%	0.977	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	70.5	-172.1	-62.2	-170.2	131.8	0	0	113.9
794	S	42.6	Very low	34.1	Very low	89 Å²	89	136.4 Å²	136.4	62%	0.622	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.6	-0.4	171	65.7	0	0	0	0	116.5	D792 N796	D792-S794 VanDerWaalsContact C-N 3.34Å; D792-S794 PolarHBondContact O-N 2.9Å; S794-N796 PolarHBondContact O-N 2.96Å
795	G	33.6	Very low	34.2	Very low	83 Å²	83	133.6 Å²	133.6	86%	0.856	75%	0.754	S	S	*	*			trans	69.1	-4	167.1	0	0	0	0	0	117.4
796	N	36.9	Very low	34.4	Very low	139 Å²	139	134.3 Å²	134.3	74%	0.743	74%	0.744	S	S	*	*			trans	-107.6	115.4	-178.6	-75.1	-43.8	0	0	0	111.5	S794 L798	S794-N796 PolarHBondContact O-N 2.96Å; N796-L798 PolarHBondContact O-N 3.22Å
797	M	30.8	Very low	34.5	Very low	168 Å²	168	132.9 Å²	132.9	83%	0.828	74%	0.737	S	S	*	*			trans	-78.7	105.8	176.6	-169	-166.9	81	0	0	110.7	T799	M797-T799 HydrophobicContact CE-CG2 3.93Å; M797-T799 PolarHBondContact O-N 3.39Å
798	L	32.3	Very low	34.3	Very low	157 Å²	157	130.9 Å²	130.9	82%	0.822	73%	0.732	S	S	*	*			trans	-74.8	114.3	174.2	-73.6	169.9	0	0	0	111	N796 I800	N796-L798 PolarHBondContact O-N 3.22Å; L798-I800 PolarHBondContact O-N 2.89Å
799	T	30.6	Very low	34.3	Very low	107 Å²	107	130.2 Å²	130.2	66%	0.656	72%	0.724	S	S	*	*			trans	-73	111.2	170.3	48.9	0	0	0	0	110.3	M797	M797-T799 HydrophobicContact CE-CG2 3.93Å; M797-T799 PolarHBondContact O-N 3.39Å
800	I	35.9	Very low	34.5	Very low	151 Å²	151	126.7 Å²	126.7	77%	0.774	71%	0.705	S	S	*	*			trans	-85.9	118.1	170.3	-60.7	177.7	0	0	0	108.3	L798 T802	L798-I800 PolarHBondContact O-N 2.89Å; I800-T802 PolarHBondContact O-N 3.1Å; I800-T802 VanDerWaalsContact O-N 3.09Å
801	N	29	Very low	34.3	Very low	121 Å²	121	126 Å²	126	65%	0.647	70%	0.698	S	S	*	*			trans	-73.4	99.3	-175.6	-65.7	-2	0	0	0	111.7	E803	N801-E803 VanDerWaalsContact C-N 3.27Å; N801-E803 PolarHBondContact O-N 3.12Å; N801-E803 VanDerWaalsContact O-N 3.16Å
802	T	33.5	Very low	34.7	Very low	102 Å²	102	123.8 Å²	123.8	63%	0.626	68%	0.68	S	S	*	*			trans	-87.1	51.3	176.8	56.8	0	0	0	0	112.9	I800	I800-T802 PolarHBondContact O-N 3.1Å; I800-T802 VanDerWaalsContact O-N 3.09Å
803	E	31.2	Very low	35	Very low	163 Å²	163	121.5 Å²	121.5	76%	0.762	67%	0.668	S	S	*	*			trans	-91.3	-2	-179.4	-66.8	-169.9	129.6	0	0	114	N801	N801-E803 VanDerWaalsContact C-N 3.27Å; N801-E803 PolarHBondContact O-N 3.12Å; N801-E803 VanDerWaalsContact O-N 3.16Å
804	S	36.8	Very low	35.6	Very low	107 Å²	107	116.4 Å²	116.4	75%	0.748	65%	0.647	S	S	*	*	S	Bend	trans	-106	13.5	-172.3	56.7	0	0	0	0	115.9
805	I	37.5	Very low	36.2	Very low	117 Å²	117	116.9 Å²	116.9	60%	0.6	64%	0.643	S	S	*	*	S	Bend	trans	-112.6	-23.4	-176.5	-63.3	178.2	0	0	0	112.8	D807	I805-D807 PolarHBondContact O-N 2.8Å
806	L	36.1	Very low	37.2	Very low	107 Å²	107	118.2 Å²	118.2	56%	0.56	63%	0.626	S	S	*	*	H	α-helix	trans	-68.5	-25.2	-169.1	-69.3	166	0	0	0	114.9	N808 N810	L806-N808 PolarHBondContact O-N 3.02Å; L806-N810 PolarHBondContact O-ND2 3.46Å; L806-N810 VanDerWaalsContact O-ND2 3.16Å
807	D	33.3	Very low	38.2	Very low	125 Å²	125	113 Å²	113	67%	0.668	60%	0.6	S	S	*	*	H	α-helix	trans	-70	-29.3	-173.8	-68.6	-32.6	0	0	0	114	I805	I805-D807 PolarHBondContact O-N 2.8Å
808	N	35.1	Very low	39.5	Very low	121 Å²	121	111.9 Å²	111.9	65%	0.647	59%	0.591	S	S	*	*	H	α-helix	trans	-75.2	-34.5	-179.8	-85.1	-39.4	0	0	0	112.9	L806 N811 I812	L806-N808 PolarHBondContact O-N 3.02Å; N808-N811 PolarHBondContact O-N 3.37Å; N808-I812 WeakPolarHBondContact O-CG1 3.42Å; N808-I812 PolarHBondContact O-N 2.97Å
809	E	33.4	Very low	41.4	Very low	121 Å²	121	108 Å²	108	57%	0.565	57%	0.571	S	S	*	*	H	α-helix	trans	-67.8	-39.3	177.7	-63.3	-157.2	131.4	0	0	111.7	N811 I812 N813	E809-N811 VanDerWaalsContact C-N 3.28Å; E809-N811 PolarHBondContact O-N 2.74Å; E809-I812 PolarHBondContact O-N 3.33Å; E809-N813 WeakPolarHBondContact O-CB 3.36Å; E809-N813 VanDerWaalsContact O-CG 3.3Å; E809-N813 PolarHBondContact O-N 3.01Å; E809-N813 PolarHBondContact O-ND2 2.75Å
810	N	33.7	Very low	43.5	Very low	93 Å²	93	103.4 Å²	103.4	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-56.7	-41.8	175.9	-76	-43.6	0	0	0	112	L806 N813 N814	L806-N810 PolarHBondContact O-ND2 3.46Å; L806-N810 VanDerWaalsContact O-ND2 3.16Å; N810-N813 PolarHBondContact O-N 2.96Å; N810-N814 WeakPolarHBondContact O-CB 3.47Å; N810-N814 PolarHBondContact O-N 3.35Å; N810-N814 PolarHBondContact O-ND2 2.62Å
811	N	32.9	Very low	45.3	Very low	101 Å²	101	100.5 Å²	100.5	54%	0.54	52%	0.524	S	S	.	.	H	α-helix	trans	-69.8	-40.1	-179.6	-134.1	-8	0	0	0	112.2	N808 E809 N815	N808-N811 PolarHBondContact O-N 3.37Å; E809-N811 VanDerWaalsContact C-N 3.28Å; E809-N811 PolarHBondContact O-N 2.74Å; N811-N815 PolarHBondContact O-N 2.87Å; N811-N815 VanDerWaalsContact O-N 3.16Å; N811-N815 PolarHBondContact O-ND2 3.42Å
812	I	43.6	Very low	47.6	Very low	93 Å²	93	101.4 Å²	101.4	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-41.1	176	-66.6	168.8	0	0	0	111.3	N808 E809 N815 K816	N808-I812 WeakPolarHBondContact O-CG1 3.42Å; N808-I812 PolarHBondContact O-N 2.97Å; E809-I812 PolarHBondContact O-N 3.33Å; I812-N815 PolarHBondContact O-N 3.12Å; I812-K816 HydrophobicContact CG2-CD 4.29Å; I812-K816 WeakPolarHBondContact O-CG 3.41Å; I812-K816 PolarHBondContact O-N 3.18Å; I812-K816 VanDerWaalsContact O-N 3.15Å
813	N	43.2	Very low	49.9	Very low	77 Å²	77	98 Å²	98	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-72.5	-34.6	179.9	-69.9	-24.7	0	0	0	112.1	E809 N810 S817	E809-N813 WeakPolarHBondContact O-CB 3.36Å; E809-N813 VanDerWaalsContact O-CG 3.3Å; E809-N813 PolarHBondContact O-N 3.01Å; E809-N813 PolarHBondContact O-ND2 2.75Å; N810-N813 PolarHBondContact O-N 2.96Å; N813-S817 WeakPolarHBondContact O-CB 3.39Å; N813-S817 PolarHBondContact O-N 3.2Å
814	N	46.2	Very low	52.6	Low	102 Å²	102	90.7 Å²	90.7	55%	0.545	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-45.5	171.2	-78.3	-27.1	0	0	0	112	N810 S817 F818	N810-N814 WeakPolarHBondContact O-CB 3.47Å; N810-N814 PolarHBondContact O-N 3.35Å; N810-N814 PolarHBondContact O-ND2 2.62Å; N814-S817 WeakPolarHBondContact O-CB 3.46Å; N814-S817 PolarHBondContact O-N 2.96Å; N814-F818 WeakPolarHBondContact O-CB 3.38Å; N814-F818 PolarHBondContact O-N 3.43Å
815	N	53.9	Low	55.1	Low	99 Å²	99	87.3 Å²	87.3	53%	0.529	45%	0.445	S	S	.	.	H	α-helix	trans	-62.5	-47.9	177.8	-70.5	-18.9	0	0	0	112	N811 I812 S817 F818 D819	N811-N815 PolarHBondContact O-N 2.87Å; N811-N815 VanDerWaalsContact O-N 3.16Å; N811-N815 PolarHBondContact O-ND2 3.42Å; I812-N815 PolarHBondContact O-N 3.12Å; N815-S817 VanDerWaalsContact C-N 3.32Å; N815-S817 PolarHBondContact O-N 2.94Å; N815-F818 WeakPolarHBondContact O-CB 3.48Å; N815-F818 PolarHBondContact O-N 2.96Å; N815-F818 VanDerWaalsContact O-N 3.09Å; N815-D819 PolarHBondContact O-N 2.82Å
816	K	55.5	Low	57.6	Low	112 Å²	112	86.2 Å²	86.2	49%	0.487	44%	0.44	S	S	.	.	H	α-helix	trans	-59.6	-40.8	175.1	-68.4	170.1	-176.2	169	0	112.6	I812 F818 D819 I820	I812-K816 HydrophobicContact CG2-CD 4.29Å; I812-K816 WeakPolarHBondContact O-CG 3.41Å; I812-K816 PolarHBondContact O-N 3.18Å; I812-K816 VanDerWaalsContact O-N 3.15Å; K816-F818 VanDerWaalsContact C-N 3.29Å; K816-F818 PolarHBondContact O-N 3.15Å; K816-D819 PolarHBondContact O-N 2.99Å; K816-I820 WeakPolarHBondContact O-CD1 3.45Å; K816-I820 VanDerWaalsContact O-CG1 3.29Å; K816-I820 WeakPolarHBondContact O-CG1 3.33Å; K816-I820 PolarHBondContact O-N 3.07Å; K816-I820 VanDerWaalsContact O-N 3.1Å
817	S	58.1	Low	60.3	Low	30 Å²	30	89.6 Å²	89.6	21%	0.21	45%	0.446	C	S	.	.	H	α-helix	trans	-63.2	-36.1	176.2	-168.8	0	0	0	0	111.8	L765 N813 N814 N815 K821	L765-S817 WeakPolarHBondContact CD2-OG 3.44Å; N813-S817 WeakPolarHBondContact O-CB 3.39Å; N813-S817 PolarHBondContact O-N 3.2Å; N814-S817 WeakPolarHBondContact O-CB 3.46Å; N814-S817 PolarHBondContact O-N 2.96Å; N815-S817 VanDerWaalsContact C-N 3.32Å; N815-S817 PolarHBondContact O-N 2.94Å; S817-K821 WeakPolarHBondContact O-CB 3.41Å; S817-K821 VanDerWaalsContact O-CD 3.3Å; S817-K821 WeakPolarHBondContact O-CD 3.33Å; S817-K821 VanDerWaalsContact O-CG 3.23Å; S817-K821 WeakPolarHBondContact O-CG 3.19Å; S817-K821 PolarHBondContact O-N 2.95Å; S817-K821 PolarHBondContact OG-NZ 3.08Å
818	F	58.7	Low	63.1	Low	143 Å²	143	85 Å²	85	63%	0.627	42%	0.422	S	S	*	.	H	α-helix	trans	-69.5	-48.7	174.9	-170.9	-94.7	0	0	0	111.8	N814 N815 K816 I820 K821 H822	N814-F818 WeakPolarHBondContact O-CB 3.38Å; N814-F818 PolarHBondContact O-N 3.43Å; N815-F818 WeakPolarHBondContact O-CB 3.48Å; N815-F818 PolarHBondContact O-N 2.96Å; N815-F818 VanDerWaalsContact O-N 3.09Å; K816-F818 VanDerWaalsContact C-N 3.29Å; K816-F818 PolarHBondContact O-N 3.15Å; F818-I820 PolarHBondContact O-N 2.9Å; F818-K821 CarbonylContact O-C 3.6Å; F818-K821 PolarHBondContact O-N 3.07Å; F818-H822 WeakPolarHBondContact O-CB 3.28Å; F818-H822 PolarHBondContact O-N 2.95Å
819	D	71.2	Confident	66	Low	75 Å²	75	79.2 Å²	79.2	40%	0.401	39%	0.391	S	S	.	.	H	α-helix	trans	-58.1	-47.5	179.4	-71.3	-33.8	0	0	0	112.3	P718 N815 K816 K821 H822 V823	P718-D819 HydrophobicContact CB-CB 4.1Å; N815-D819 PolarHBondContact O-N 2.82Å; K816-D819 PolarHBondContact O-N 2.99Å; D819-K821 PolarHBondContact O-N 3.02Å; D819-H822 WeakPolarHBondContact O-CB 3.42Å; D819-H822 PolarHBondContact O-N 3.24Å; D819-H822 VanDerWaalsContact O-N 3.15Å; D819-V823 WeakPolarHBondContact O-CG2 3.24Å; D819-V823 PolarHBondContact O-N 2.91Å
820	I	75.3	Confident	68.9	Low	12 Å²	12	75.5 Å²	75.5	6%	0.062	38%	0.377	C	S	.	.	H	α-helix	trans	-62.8	-44	179.1	-65.6	162.3	0	0	0	110.8	Q723 L764 K816 F818 H822 V823 F824	Q723-I820 VanDerWaalsContact NE2-CD1 3.3Å; L764-I820 HydrophobicContact CB-CG2 4.11Å; L764-I820 HydrophobicContact CD1-CG2 3.93Å; L764-I820 HydrophobicContact CG-CG2 4.49Å; K816-I820 WeakPolarHBondContact O-CD1 3.45Å; K816-I820 VanDerWaalsContact O-CG1 3.29Å; K816-I820 WeakPolarHBondContact O-CG1 3.33Å; K816-I820 PolarHBondContact O-N 3.07Å; K816-I820 VanDerWaalsContact O-N 3.1Å; F818-I820 PolarHBondContact O-N 2.9Å; I820-H822 VanDerWaalsContact C-N 3.27Å; I820-H822 PolarHBondContact O-N 3.18Å; I820-V823 PolarHBondContact O-N 3.33Å; I820-F824 PolarHBondContact O-N 3.4Å
821	K	73.6	Confident	71.8	Confident	90 Å²	90	74.6 Å²	74.6	39%	0.391	37%	0.37	S	S	.	.	H	α-helix	trans	-68.9	-23.8	176.5	-74	169.8	-176.2	147.3	0	113.1	S817 F818 D819 S825	S817-K821 WeakPolarHBondContact O-CB 3.41Å; S817-K821 VanDerWaalsContact O-CD 3.3Å; S817-K821 WeakPolarHBondContact O-CD 3.33Å; S817-K821 VanDerWaalsContact O-CG 3.23Å; S817-K821 WeakPolarHBondContact O-CG 3.19Å; S817-K821 PolarHBondContact O-N 2.95Å; S817-K821 PolarHBondContact OG-NZ 3.08Å; F818-K821 CarbonylContact O-C 3.6Å; F818-K821 PolarHBondContact O-N 3.07Å; D819-K821 PolarHBondContact O-N 3.02Å; K821-S825 WeakPolarHBondContact O-CA 3.38Å; K821-S825 PolarHBondContact O-N 3.47Å
822	H	77.7	Confident	74.8	Confident	139 Å²	139	69.9 Å²	69.9	64%	0.644	34%	0.344	S	S	*	.	H	α-helix	trans	-75	-48.6	173.6	-175.1	-99.2	0	0	0	110.9	F818 D819 I820	F818-H822 WeakPolarHBondContact O-CB 3.28Å; F818-H822 PolarHBondContact O-N 2.95Å; D819-H822 WeakPolarHBondContact O-CB 3.42Å; D819-H822 PolarHBondContact O-N 3.24Å; D819-H822 VanDerWaalsContact O-N 3.15Å; I820-H822 VanDerWaalsContact C-N 3.27Å; I820-H822 PolarHBondContact O-N 3.18Å
823	V	81.4	Confident	77.3	Confident	32 Å²	32	65.6 Å²	65.6	19%	0.194	32%	0.322	C	S	.	.	H	α-helix	trans	-64.9	-48.4	177.7	-178.7	0	0	0	0	111.3	W692 P718 D819 I820 T828	W692-V823 HydrophobicContact CZ2-CG1 4.27Å; P718-V823 HydrophobicContact CB-CG2 3.83Å; P718-V823 HydrophobicContact CG-CG2 3.69Å; D819-V823 WeakPolarHBondContact O-CG2 3.24Å; D819-V823 PolarHBondContact O-N 2.91Å; I820-V823 PolarHBondContact O-N 3.33Å; V823-T828 PolarHBondContact O-OG1 3.26Å
824	F	87.1	Confident	79.8	Confident	8 Å²	8	66.2 Å²	66.2	4%	0.035	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	54.7	179.4	-68.7	-77.4	0	0	0	111.3	V656 I719 I727 H761 I820 L829	V656-F824 HydrophobicContact CG1-CE1 4.24Å; V656-F824 HydrophobicContact CG1-CZ 4.04Å; V656-F824 HydrophobicContact CG2-CE1 3.97Å; I719-F824 HydrophobicContact CD1-CD2 3.98Å; I719-F824 HydrophobicContact CD1-CE2 3.51Å; I719-F824 HydrophobicContact CD1-CZ 4.46Å; I727-F824 HydrophobicContact CD1-CD1 3.89Å; I727-F824 HydrophobicContact CD1-CD2 3.45Å; I727-F824 VanDerWaalsContact CD1-CD2 3.45Å; I727-F824 HydrophobicContact CD1-CE1 3.79Å; I727-F824 HydrophobicContact CD1-CE2 3.33Å; I727-F824 HydrophobicContact CD1-CG 3.74Å; I727-F824 HydrophobicContact CD1-CZ 3.5Å; I727-F824 HydrophobicContact CG2-CE1 4.03Å; I727-F824 HydrophobicContact CG2-CZ 4.39Å; H761-F824 PolarHBondContact CE1-O 3.35Å; H761-F824 VanDerWaalsContact CE1-O 3.26Å; I820-F824 PolarHBondContact O-N 3.4Å; F824-L829 HydrophobicContact CB-CD2 4.29Å; F824-L829 HydrophobicContact CB-CG 4.4Å; F824-L829 HydrophobicContact CD1-CD2 4.11Å; F824-L829 WeakPolarHBondContact O-CD1 3.36Å
825	S	89.3	Confident	82.2	Confident	36 Å²	36	64 Å²	64	25%	0.252	31%	0.306	S	S	.	.			trans	-57.4	156.3	176.3	81.6	0	0	0	0	112.4	K821 R827 T828 L829	K821-S825 WeakPolarHBondContact O-CA 3.38Å; K821-S825 PolarHBondContact O-N 3.47Å; S825-R827 PolarHBondContact O-N 3.21Å; S825-R827 VanDerWaalsContact O-N 3.08Å; S825-R827 PolarHBondContact OG-N 3.01Å; S825-T828 PolarHBondContact N-OG1 3.09Å; S825-T828 WeakPolarHBondContact O-CB 3.24Å; S825-T828 PolarHBondContact O-N 2.94Å; S825-T828 PolarHBondContact OG-N 3.12Å; S825-T828 VanDerWaalsContact OG-N 3.07Å; S825-T828 PolarHBondContact OG-OG1 2.75Å; S825-L829 PolarHBondContact O-N 3.18Å
826	N	91.1	Very high	84.2	Confident	94 Å²	94	59.3 Å²	59.3	50%	0.503	28%	0.281	S	S	.	.	H	α-helix	trans	-54.8	-30	174.8	-68.2	-5.7	0	0	0	112.3	I757 H761 T830	I757-N826 HydrophobicContact CD1-CB 4.47Å; I757-N826 HydrophobicContact CG2-CB 4.44Å; I757-N826 WeakPolarHBondContact CG2-OD1 3.41Å; H761-N826 PolarHBondContact NE2-OD1 3.18Å; N826-T830 VanDerWaalsContact O-CB 3.29Å; N826-T830 WeakPolarHBondContact O-CB 3.42Å; N826-T830 PolarHBondContact O-N 3.11Å; N826-T830 PolarHBondContact O-OG1 3.37Å
827	R	92.5	Very high	86	Confident	179 Å²	179	59.3 Å²	59.3	68%	0.675	28%	0.281	S	S	*	.	H	α-helix	trans	-68.6	-52.9	172.7	179.6	178.1	173.1	176	-2.9	111.3	S825 L829 T830 E831	S825-R827 PolarHBondContact O-N 3.21Å; S825-R827 VanDerWaalsContact O-N 3.08Å; S825-R827 PolarHBondContact OG-N 3.01Å; R827-L829 VanDerWaalsContact C-N 3.3Å; R827-L829 PolarHBondContact O-N 3.14Å; R827-T830 WeakPolarHBondContact O-CA 3.39Å; R827-T830 WeakPolarHBondContact O-CB 3.44Å; R827-T830 PolarHBondContact O-N 3.19Å; R827-E831 WeakPolarHBondContact CG-OE1 3.32Å; R827-E831 IonicContact CZ-OE1 3.14Å; R827-E831 IonicContact NE-OE1 2.73Å; R827-E831 PolarHBondContact NE-OE1 2.9Å; R827-E831 IonicContact NH2-OE1 2.7Å; R827-E831 PolarHBondContact NH2-OE1 3.21Å; R827-E831 WeakPolarHBondContact O-CG 3.4Å; R827-E831 PolarHBondContact O-N 2.88Å
828	T	92.6	Very high	87.7	Confident	27 Å²	27	63.8 Å²	63.8	17%	0.166	31%	0.307	C	S	.	.	H	α-helix	trans	-54.5	-46.4	177.8	-39.8	0	0	0	0	111.2	V823 S825 E831 I832	V823-T828 PolarHBondContact O-OG1 3.26Å; S825-T828 PolarHBondContact N-OG1 3.09Å; S825-T828 WeakPolarHBondContact O-CB 3.24Å; S825-T828 PolarHBondContact O-N 2.94Å; S825-T828 PolarHBondContact OG-N 3.12Å; S825-T828 VanDerWaalsContact OG-N 3.07Å; S825-T828 PolarHBondContact OG-OG1 2.75Å; T828-E831 PolarHBondContact O-N 3.45Å; T828-I832 HydrophobicContact CG2-CD1 4.22Å; T828-I832 VanDerWaalsContact O-CG1 3.31Å; T828-I832 WeakPolarHBondContact O-CG1 3.48Å; T828-I832 PolarHBondContact O-N 3.35Å
829	L	94.3	Very high	89.3	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-68.2	-33.1	178.3	-65.2	175.8	0	0	0	113	F756 I757 V760 F824 S825 R827 I832 F833	F756-L829 HydrophobicContact CD1-CB 4.5Å; F756-L829 HydrophobicContact CE1-CB 4.17Å; F756-L829 HydrophobicContact CE1-CD2 4.11Å; F756-L829 WeakPolarHBondContact CE1-O 3.37Å; I757-L829 HydrophobicContact CG1-CB 3.86Å; I757-L829 HydrophobicContact CG2-CD1 4.43Å; V760-L829 HydrophobicContact CB-CD1 4.15Å; V760-L829 HydrophobicContact CB-CD2 4.4Å; V760-L829 HydrophobicContact CG1-CD1 3.93Å; V760-L829 HydrophobicContact CG1-CD2 3.86Å; F824-L829 HydrophobicContact CB-CD2 4.29Å; F824-L829 HydrophobicContact CB-CG 4.4Å; F824-L829 HydrophobicContact CD1-CD2 4.11Å; F824-L829 WeakPolarHBondContact O-CD1 3.36Å; S825-L829 PolarHBondContact O-N 3.18Å; R827-L829 VanDerWaalsContact C-N 3.3Å; R827-L829 PolarHBondContact O-N 3.14Å; L829-I832 HydrophobicContact CD2-CD1 4.36Å; L829-F833 WeakPolarHBondContact O-CB 3.49Å; L829-F833 PolarHBondContact O-N 3.26Å
830	T	95.4	Very high	90.3	Very high	43 Å²	43	61.6 Å²	61.6	26%	0.264	29%	0.293	S	S	.	.	H	α-helix	trans	-64.7	-47.6	170.9	-62.8	0	0	0	0	110.7	V753 I757 N826 R827 F833 H834	V753-T830 HydrophobicContact CG1-CG2 4.24Å; I757-T830 WeakPolarHBondContact CD1-OG1 3.35Å; N826-T830 VanDerWaalsContact O-CB 3.29Å; N826-T830 WeakPolarHBondContact O-CB 3.42Å; N826-T830 PolarHBondContact O-N 3.11Å; N826-T830 PolarHBondContact O-OG1 3.37Å; R827-T830 WeakPolarHBondContact O-CA 3.39Å; R827-T830 WeakPolarHBondContact O-CB 3.44Å; R827-T830 PolarHBondContact O-N 3.19Å; T830-F833 WeakPolarHBondContact O-CB 3.27Å; T830-F833 PolarHBondContact O-N 3.01Å; T830-H834 PolarHBondContact O-CD2 2.98Å; T830-H834 PolarHBondContact O-N 3.17Å
831	E	94.6	Very high	91.1	Very high	74 Å²	74	61.7 Å²	61.7	35%	0.346	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-44.1	-179.8	-69.1	178.6	-163.7	0	0	111.5	R827 T828 F833 H834 R835	R827-E831 WeakPolarHBondContact CG-OE1 3.32Å; R827-E831 IonicContact CZ-OE1 3.14Å; R827-E831 IonicContact NE-OE1 2.73Å; R827-E831 PolarHBondContact NE-OE1 2.9Å; R827-E831 IonicContact NH2-OE1 2.7Å; R827-E831 PolarHBondContact NH2-OE1 3.21Å; R827-E831 WeakPolarHBondContact O-CG 3.4Å; R827-E831 PolarHBondContact O-N 2.88Å; T828-E831 PolarHBondContact O-N 3.45Å; E831-F833 PolarHBondContact O-N 3.09Å; E831-H834 PolarHBondContact O-N 3.39Å; E831-R835 WeakPolarHBondContact O-CG 2.93Å; E831-R835 PolarHBondContact O-N 2.96Å
832	I	95.6	Very high	91.8	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-54.7	-50	169.9	-71	163.7	0	0	0	111.2	V656 D657 I731 F756 T828 L829 H834 R835 I836	V656-I832 HydrophobicContact CG2-CD1 3.72Å; V656-I832 HydrophobicContact CG2-CG1 4.49Å; D657-I832 HydrophobicContact CB-CG2 4.24Å; I731-I832 HydrophobicContact CD1-CG2 4.28Å; I731-I832 HydrophobicContact CG1-CG2 4.11Å; F756-I832 HydrophobicContact CE1-CG2 4.28Å; F756-I832 HydrophobicContact CZ-CG2 4.2Å; T828-I832 HydrophobicContact CG2-CD1 4.22Å; T828-I832 VanDerWaalsContact O-CG1 3.31Å; T828-I832 WeakPolarHBondContact O-CG1 3.48Å; T828-I832 PolarHBondContact O-N 3.35Å; L829-I832 HydrophobicContact CD2-CD1 4.36Å; I832-H834 VanDerWaalsContact C-N 3.33Å; I832-H834 PolarHBondContact O-N 3.48Å; I832-R835 VanDerWaalsContact CG1-NH2 3.33Å; I832-R835 PolarHBondContact O-N 2.69Å; I832-I836 WeakPolarHBondContact O-CG1 3.42Å; I832-I836 PolarHBondContact O-N 3.47Å
833	F	96.2	Very high	92.4	Very high	3 Å²	3	60.4 Å²	60.4	1%	0.013	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-43.9	-179.9	179.5	-79.3	0	0	0	111.7	L734 L738 Q751 V753 F756 L829 T830 E831 K837	L734-F833 HydrophobicContact CD1-CD2 3.55Å; L734-F833 HydrophobicContact CD1-CE2 3.53Å; L734-F833 HydrophobicContact CD2-CB 4.31Å; L734-F833 HydrophobicContact CD2-CD2 3.8Å; L734-F833 HydrophobicContact CD2-CG 4.33Å; L734-F833 HydrophobicContact CG-CD2 4.32Å; L738-F833 HydrophobicContact CD1-CE2 4.38Å; L738-F833 HydrophobicContact CD1-CZ 4.37Å; L738-F833 HydrophobicContact CD2-CE2 4.48Å; L738-F833 HydrophobicContact CD2-CZ 4.16Å; Q751-F833 WeakPolarHBondContact O-CE2 3.43Å; Q751-F833 WeakPolarHBondContact O-CZ 3.44Å; V753-F833 HydrophobicContact CB-CD1 4.44Å; V753-F833 HydrophobicContact CB-CE1 4.45Å; V753-F833 HydrophobicContact CG2-CD1 3.53Å; V753-F833 HydrophobicContact CG2-CE1 3.43Å; V753-F833 VanDerWaalsContact CG2-CE1 3.43Å; V753-F833 HydrophobicContact CG2-CG 4.16Å; V753-F833 HydrophobicContact CG2-CZ 3.98Å; F756-F833 HydrophobicContact CB-CD2 3.74Å; F756-F833 HydrophobicContact CB-CE2 4.18Å; F756-F833 HydrophobicContact CD1-CB 4.02Å; F756-F833 HydrophobicContact CD1-CD2 4.09Å; F756-F833 HydrophobicContact CE1-CB 4.4Å; F756-F833 AromaticContact CG-CD2 3.98Å; F756-F833 HydrophobicContact CG-CD2 3.98Å; L829-F833 WeakPolarHBondContact O-CB 3.49Å; L829-F833 PolarHBondContact O-N 3.26Å; T830-F833 WeakPolarHBondContact O-CB 3.27Å; T830-F833 PolarHBondContact O-N 3.01Å; E831-F833 PolarHBondContact O-N 3.09Å; F833-K837 HydrophobicContact CD1-CD 4.43Å; F833-K837 HydrophobicContact CE1-CD 3.76Å; F833-K837 WeakPolarHBondContact O-CB 3.17Å; F833-K837 PolarHBondContact O-N 2.95Å
834	H	96	Very high	92.7	Very high	90 Å²	90	59.4 Å²	59.4	42%	0.417	29%	0.292	S	S	.	.	H	α-helix	trans	-67.5	-39.6	178	-80.1	-79.8	0	0	0	112.5	T830 E831 I832 K837 V838	T830-H834 PolarHBondContact O-CD2 2.98Å; T830-H834 PolarHBondContact O-N 3.17Å; E831-H834 PolarHBondContact O-N 3.39Å; I832-H834 VanDerWaalsContact C-N 3.33Å; I832-H834 PolarHBondContact O-N 3.48Å; H834-K837 PolarHBondContact O-N 2.85Å; H834-V838 WeakPolarHBondContact O-CB 3.49Å; H834-V838 WeakPolarHBondContact O-CG2 3.01Å; H834-V838 PolarHBondContact O-N 3.33Å
835	R	96.1	Very high	92.7	Very high	56 Å²	56	61.9 Å²	61.9	21%	0.211	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-46	174.4	-73.6	-169.6	-60.3	-108.6	4.6	112.3	E655 D657 E831 I832 R839	E655-R835 IonicContact OE2-CZ 2.99Å; E655-R835 IonicContact OE2-NH1 3.93Å; E655-R835 PolarHBondContact OE2-NH1 3.46Å; E655-R835 IonicContact OE2-NH2 2.76Å; E655-R835 PolarHBondContact OE2-NH2 2.88Å; D657-R835 IonicContact OD1-CZ 3.23Å; D657-R835 VanDerWaalsContact OD1-CZ 3.24Å; D657-R835 IonicContact OD1-NE 2.95Å; D657-R835 PolarHBondContact OD1-NE 3.04Å; D657-R835 IonicContact OD1-NH2 2.69Å; D657-R835 PolarHBondContact OD1-NH2 3.18Å; D657-R835 WeakPolarHBondContact OD2-CB 3.32Å; D657-R835 IonicContact OD2-NE 2.64Å; D657-R835 PolarHBondContact OD2-NE 2.91Å; E831-R835 WeakPolarHBondContact O-CG 2.93Å; E831-R835 PolarHBondContact O-N 2.96Å; I832-R835 VanDerWaalsContact CG1-NH2 3.33Å; I832-R835 PolarHBondContact O-N 2.69Å; R835-R839 PolarHBondContact O-N 2.99Å
836	I	95.4	Very high	92.7	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-42.6	174.8	-64.9	-67.5	0	0	0	111.2	D657 I731 L734 Q735 L738 H739 I832 V838 R839 L841	D657-I836 HydrophobicContact CB-CD1 4.04Å; D657-I836 HydrophobicContact CB-CG1 4.36Å; I731-I836 HydrophobicContact CG2-CD1 3.77Å; I731-I836 HydrophobicContact CG2-CG1 4.17Å; L734-I836 HydrophobicContact CD2-CB 4.16Å; L734-I836 HydrophobicContact CD2-CG1 4.39Å; L734-I836 HydrophobicContact CD2-CG2 4.16Å; L734-I836 HydrophobicContact CG-CG2 4.18Å; Q735-I836 HydrophobicContact CB-CG2 4.27Å; L738-I836 HydrophobicContact CD1-CG2 4.2Å; H739-I836 PolarHBondContact NE2-O 3.1Å; I832-I836 WeakPolarHBondContact O-CG1 3.42Å; I832-I836 PolarHBondContact O-N 3.47Å; I836-V838 PolarHBondContact O-N 2.78Å; I836-R839 CarbonylContact O-C 3.53Å; I836-L841 HydrophobicContact CD1-CD1 4.09Å; I836-L841 HydrophobicContact CD1-CD2 3.78Å; I836-L841 HydrophobicContact CD1-CG 3.77Å
837	K	93.5	Very high	92.4	Very high	112 Å²	112	57.2 Å²	57.2	49%	0.487	28%	0.282	S	S	.	.	H	α-helix	trans	-63.7	-37.7	179.6	-178.5	172.4	173	179.8	0	113.2	L738 F833 H834	L738-K837 HydrophobicContact CD1-CB 3.89Å; L738-K837 HydrophobicContact CD1-CG 4.45Å; F833-K837 HydrophobicContact CD1-CD 4.43Å; F833-K837 HydrophobicContact CE1-CD 3.76Å; F833-K837 WeakPolarHBondContact O-CB 3.17Å; F833-K837 PolarHBondContact O-N 2.95Å; H834-K837 PolarHBondContact O-N 2.85Å
838	V	93.3	Very high	92.3	Very high	124 Å²	124	48.9 Å²	48.9	75%	0.752	25%	0.251	S	S	*	.	H	α-helix	trans	-81.8	-42.4	178.8	172.6	0	0	0	0	111.8	H834 I836	H834-V838 WeakPolarHBondContact O-CB 3.49Å; H834-V838 WeakPolarHBondContact O-CG2 3.01Å; H834-V838 PolarHBondContact O-N 3.33Å; I836-V838 PolarHBondContact O-N 2.78Å
839	R	92.8	Very high	92.2	Very high	140 Å²	140	49.1 Å²	49.1	53%	0.528	25%	0.253	S	S	.	.	S	Bend	trans	-123.8	106.8	-178.6	-170.9	-179.7	178.1	176.2	-1.7	110	R661 R835 I836	R661-R839 PolarHBondContact NH1-O 2.83Å; R835-R839 PolarHBondContact O-N 2.99Å; I836-R839 CarbonylContact O-C 3.53Å
840	P	92.3	Very high	91.8	Very high	32 Å²	32	50.4 Å²	50.4	21%	0.208	26%	0.259	C	S	.	.			trans	-60.3	157.7	173.5	20.5	-29.7	0	0	0	113	R661 Q735 E842	R661-P840 PolarHBondContact NH1-O 2.76Å; Q735-P840 VanDerWaalsContact OE1-CA 3.3Å; P840-E842 VanDerWaalsContact C-N 3.33Å; P840-E842 HydrophobicContact CB-CG 4.09Å; P840-E842 HydrophobicContact CG-CG 3.91Å; P840-E842 PolarHBondContact O-N 2.83Å; P840-E842 VanDerWaalsContact O-N 3.09Å
841	L	93.4	Very high	91.5	Very high	14 Å²	14	48.4 Å²	48.4	7%	0.073	25%	0.247	C	C	.	.			trans	-75.7	82.7	166.2	-58.2	177.7	0	0	0	109.5	L660 R661 V664 I731 L732 Q735 I836	L660-L841 HydrophobicContact CD2-CD1 3.89Å; L660-L841 HydrophobicContact CG-CD1 4.36Å; R661-L841 HydrophobicContact CB-CD2 3.63Å; R661-L841 HydrophobicContact CG-CD2 4.08Å; V664-L841 HydrophobicContact CG1-CB 4.46Å; I731-L841 HydrophobicContact CG2-CD1 4.09Å; L732-L841 HydrophobicContact CD2-CD1 4.26Å; Q735-L841 HydrophobicContact CB-CD1 4.09Å; Q735-L841 HydrophobicContact CB-CG 4.45Å; Q735-L841 VanDerWaalsContact CD-N 3.34Å; Q735-L841 HydrophobicContact CG-CB 4.04Å; Q735-L841 HydrophobicContact CG-CD1 4.16Å; Q735-L841 HydrophobicContact CG-CG 4.23Å; I836-L841 HydrophobicContact CD1-CD1 4.09Å; I836-L841 HydrophobicContact CD1-CD2 3.78Å; I836-L841 HydrophobicContact CD1-CG 3.77Å
842	E	88.1	Confident	91.2	Very high	130 Å²	130	48.9 Å²	48.9	61%	0.607	25%	0.245	S	C	*	.			trans	-94.8	138.8	175.8	-64.9	-171.8	149	0	0	111.5	P840	P840-E842 VanDerWaalsContact C-N 3.33Å; P840-E842 HydrophobicContact CB-CG 4.09Å; P840-E842 HydrophobicContact CG-CG 3.91Å; P840-E842 PolarHBondContact O-N 2.83Å; P840-E842 VanDerWaalsContact O-N 3.09Å
843	P	89.4	Confident	90.7	Very high	72 Å²	72	51.9 Å²	51.9	47%	0.468	26%	0.259	S	S	.	.			trans	-68	144.7	163.1	30.9	-33.9	0	0	0	109.7	R621 V664	R621-P843 HydrophobicContact CB-CB 4.47Å; V664-P843 WeakPolarHBondContact O-CA 3.4Å
844	G	86.9	Confident	90.3	Very high	11 Å²	11	51.7 Å²	51.7	11%	0.113	26%	0.259	C	S	.	.			trans	-65	-178.5	176.4	0	0	0	0	0	113.8	R621 H665 D846	R621-G844 WeakPolarHBondContact CD-O 3.32Å; R621-G844 PolarHBondContact NE-O 3.06Å; R621-G844 VanDerWaalsContact NE-O 3.07Å; R621-G844 VanDerWaalsContact NH2-C 3.33Å; H665-G844 PolarHBondContact O-N 2.74Å; G844-D846 PolarHBondContact O-N 3.24Å
845	S	87.7	Confident	89.9	Confident	61 Å²	61	49.2 Å²	49.2	43%	0.427	25%	0.251	S	S	.	.			trans	-68.5	128.4	179.3	42.9	0	0	0	0	113.4	R621	R621-S845 VanDerWaalsContact CZ-O 3.28Å; R621-S845 VanDerWaalsContact NE-C 3.31Å; R621-S845 PolarHBondContact NE-O 3.14Å; R621-S845 PolarHBondContact NH2-O 2.99Å
846	D	88.9	Confident	89.3	Confident	15 Å²	15	51.9 Å²	51.9	8%	0.08	26%	0.264	C	S	.	.			trans	-125.5	-175.9	163.1	65.9	17.9	0	0	0	109.8	C620 R621 G844 T848 T849	C620-D846 WeakPolarHBondContact CA-OD2 3.31Å; C620-D846 PolarHBondContact SG-OD2 2.94Å; C620-D846 VanDerWaalsContact SG-OD2 3.39Å; R621-D846 HydrophobicContact CG-CB 4.19Å; R621-D846 PolarHBondContact N-OD2 3.36Å; G844-D846 PolarHBondContact O-N 3.24Å; D846-T848 PolarHBondContact O-N 3.19Å; D846-T848 WeakPolarHBondContact OD1-CA 3.45Å; D846-T848 VanDerWaalsContact OD1-CB 3.24Å; D846-T848 WeakPolarHBondContact OD1-CB 3.29Å; D846-T848 PolarHBondContact OD1-N 3.31Å; D846-T848 PolarHBondContact OD1-OG1 3.09Å; D846-T849 WeakPolarHBondContact O-CB 3.39Å; D846-T849 PolarHBondContact O-N 3.43Å; D846-T849 VanDerWaalsContact O-N 3.09Å; D846-T849 PolarHBondContact OD1-N 2.94Å
847	Q	86.3	Confident	88.7	Confident	16 Å²	16	52.4 Å²	52.4	8%	0.075	27%	0.268	C	S	.	.	H	α-helix	trans	-55.8	-32.5	177.5	71.4	-73.6	-3.1	0	0	113	N585 D618 C620 T849 I850 V851 P888 R891	N585-Q847 PolarHBondContact ND2-NE2 2.87Å; D618-Q847 VanDerWaalsContact C-OE1 3.25Å; D618-Q847 VanDerWaalsContact O-CD 3.29Å; D618-Q847 PolarHBondContact O-NE2 3.5Å; D618-Q847 PolarHBondContact O-OE1 2.79Å; C620-Q847 VanDerWaalsContact N-NE2 3.18Å; Q847-T849 VanDerWaalsContact C-N 3.28Å; Q847-T849 PolarHBondContact O-N 3.27Å; Q847-I850 PolarHBondContact O-N 3.3Å; Q847-V851 PolarHBondContact O-N 3.09Å; Q847-P888 PolarHBondContact NE2-O 3.34Å; Q847-P888 VanDerWaalsContact NE2-O 3.08Å; Q847-R891 HydrophobicContact CB-CB 3.92Å; Q847-R891 HydrophobicContact CG-CB 3.95Å
848	T	90.3	Very high	88.3	Confident	4 Å²	4	47.4 Å²	47.4	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-68.7	-27.3	-179.5	79.9	0	0	0	0	112	C620 D846 I850 V851 R852	C620-T848 HydrophobicContact CB-CG2 4.11Å; C620-T848 VanDerWaalsContact SG-CG2 3.59Å; D846-T848 PolarHBondContact O-N 3.19Å; D846-T848 WeakPolarHBondContact OD1-CA 3.45Å; D846-T848 VanDerWaalsContact OD1-CB 3.24Å; D846-T848 WeakPolarHBondContact OD1-CB 3.29Å; D846-T848 PolarHBondContact OD1-N 3.31Å; D846-T848 PolarHBondContact OD1-OG1 3.09Å; T848-I850 VanDerWaalsContact C-N 3.29Å; T848-I850 PolarHBondContact O-N 2.86Å; T848-V851 PolarHBondContact O-N 3.42Å; T848-R852 WeakPolarHBondContact O-CB 3.48Å; T848-R852 PolarHBondContact O-N 2.56Å; T848-R852 PolarHBondContact OG1-NH1 3.11Å; T848-R852 PolarHBondContact OG1-NH2 3.23Å
849	T	88.9	Confident	87.8	Confident	33 Å²	33	46 Å²	46	20%	0.202	23%	0.228	C	C	.	.	H	α-helix	trans	-63.3	-35.3	177.3	-70.9	0	0	0	0	112.1	D846 Q847 R852 H853	D846-T849 WeakPolarHBondContact O-CB 3.39Å; D846-T849 PolarHBondContact O-N 3.43Å; D846-T849 VanDerWaalsContact O-N 3.09Å; D846-T849 PolarHBondContact OD1-N 2.94Å; Q847-T849 VanDerWaalsContact C-N 3.28Å; Q847-T849 PolarHBondContact O-N 3.27Å; T849-R852 PolarHBondContact O-N 2.84Å; T849-R852 PolarHBondContact OG1-NH1 3.34Å; T849-R852 VanDerWaalsContact OG1-NH1 3.11Å; T849-H853 PolarHBondContact O-CD2 3.46Å; T849-H853 VanDerWaalsContact O-CG 3.3Å; T849-H853 PolarHBondContact O-N 3.21Å
850	I	86.5	Confident	87.2	Confident	28 Å²	28	41.3 Å²	41.3	14%	0.144	21%	0.213	C	C	.	.	H	α-helix	trans	-70.4	-44.4	173.2	-81.4	166	0	0	0	111.3	Q847 T848 R852 H853 I854 L892 L970 L973	Q847-I850 PolarHBondContact O-N 3.3Å; T848-I850 VanDerWaalsContact C-N 3.29Å; T848-I850 PolarHBondContact O-N 2.86Å; I850-R852 PolarHBondContact O-N 3.22Å; I850-H853 WeakPolarHBondContact O-CB 3.47Å; I850-H853 PolarHBondContact O-N 2.75Å; I850-I854 HydrophobicContact CG2-CD1 4.01Å; I850-I854 WeakPolarHBondContact O-CG1 3.38Å; I850-I854 PolarHBondContact O-N 2.88Å; I850-L892 HydrophobicContact CG2-CB 4.29Å; I850-L970 HydrophobicContact CD1-CB 4.24Å; I850-L970 HydrophobicContact CD1-CD2 3.51Å; I850-L970 HydrophobicContact CD1-CG 4.42Å; I850-L973 HydrophobicContact CG2-CD1 3.55Å
851	V	90.2	Very high	86.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-39	174.6	-175.2	0	0	0	0	111.2	Q847 T848 H853 I854 S855 L885 V886 R890 F920	Q847-V851 PolarHBondContact O-N 3.09Å; T848-V851 PolarHBondContact O-N 3.42Å; V851-H853 VanDerWaalsContact C-N 3.35Å; V851-H853 PolarHBondContact O-N 3.18Å; V851-I854 PolarHBondContact O-N 2.89Å; V851-S855 VanDerWaalsContact O-CB 3.31Å; V851-S855 WeakPolarHBondContact O-CB 3.38Å; V851-S855 PolarHBondContact O-N 3.02Å; V851-L885 HydrophobicContact CG1-CD1 4.41Å; V851-L885 HydrophobicContact CG1-CD2 4.49Å; V851-L885 HydrophobicContact CG1-CG 3.79Å; V851-L885 VanDerWaalsContact CG1-O 3.23Å; V851-L885 WeakPolarHBondContact CG1-O 3.24Å; V851-V886 HydrophobicContact CG1-CG2 4.48Å; V851-R890 WeakPolarHBondContact CG2-O 3.47Å; V851-F920 HydrophobicContact CB-CE1 4.48Å; V851-F920 HydrophobicContact CG1-CE1 4.03Å; V851-F920 HydrophobicContact CG2-CD1 4.31Å; V851-F920 HydrophobicContact CG2-CE1 4.02Å
852	R	88.1	Confident	85.6	Confident	85 Å²	85	46.5 Å²	46.5	32%	0.321	24%	0.235	S	C	.	.	H	α-helix	trans	-66.3	-30.9	174.7	-166	178.9	-65.7	106.8	10.8	112.7	T848 T849 I850 K856 V886	T848-R852 WeakPolarHBondContact O-CB 3.48Å; T848-R852 PolarHBondContact O-N 2.56Å; T848-R852 PolarHBondContact OG1-NH1 3.11Å; T848-R852 PolarHBondContact OG1-NH2 3.23Å; T849-R852 PolarHBondContact O-N 2.84Å; T849-R852 PolarHBondContact OG1-NH1 3.34Å; T849-R852 VanDerWaalsContact OG1-NH1 3.11Å; I850-R852 PolarHBondContact O-N 3.22Å; R852-K856 WeakPolarHBondContact O-CB 3.44Å; R852-K856 VanDerWaalsContact O-CD 3.29Å; R852-K856 WeakPolarHBondContact O-CD 3.37Å; R852-K856 WeakPolarHBondContact O-CG 3.4Å; R852-K856 PolarHBondContact O-N 2.79Å; R852-V886 HydrophobicContact CB-CG1 3.88Å; R852-V886 HydrophobicContact CB-CG2 4.16Å; R852-V886 HydrophobicContact CG-CG1 4.31Å; R852-V886 HydrophobicContact CG-CG2 4.41Å
853	H	85.2	Confident	84.5	Confident	63 Å²	63	47.9 Å²	47.9	29%	0.292	24%	0.242	S	C	.	.	H	α-helix	trans	-73.6	-42	172	-70	173.8	0	0	0	112.3	T849 I850 V851 K856 A857	T849-H853 PolarHBondContact O-CD2 3.46Å; T849-H853 VanDerWaalsContact O-CG 3.3Å; T849-H853 PolarHBondContact O-N 3.21Å; I850-H853 WeakPolarHBondContact O-CB 3.47Å; I850-H853 PolarHBondContact O-N 2.75Å; V851-H853 VanDerWaalsContact C-N 3.35Å; V851-H853 PolarHBondContact O-N 3.18Å; H853-K856 PolarHBondContact O-N 3.24Å; H853-A857 PolarHBondContact O-N 2.69Å
854	I	87.1	Confident	83.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-46.9	176.2	-62.7	163.4	0	0	0	110.4	I850 V851 K856 A857 I858 L885 L892 F918 F920 L973	I850-I854 HydrophobicContact CG2-CD1 4.01Å; I850-I854 WeakPolarHBondContact O-CG1 3.38Å; I850-I854 PolarHBondContact O-N 2.88Å; V851-I854 PolarHBondContact O-N 2.89Å; I854-K856 VanDerWaalsContact C-N 3.29Å; I854-K856 PolarHBondContact O-N 2.95Å; I854-A857 PolarHBondContact O-N 2.7Å; I854-I858 HydrophobicContact CG2-CD1 3.53Å; I854-I858 HydrophobicContact CG2-CG1 4.16Å; I854-I858 PolarHBondContact O-N 2.95Å; I854-L885 HydrophobicContact CG2-CD2 4.48Å; I854-L892 HydrophobicContact CD1-CB 4.4Å; I854-L892 HydrophobicContact CD1-CD1 4.03Å; I854-L892 HydrophobicContact CD1-CD2 4.09Å; I854-L892 HydrophobicContact CD1-CG 4.41Å; I854-F918 HydrophobicContact CD1-CD1 4.27Å; I854-F918 HydrophobicContact CG1-CE1 4.43Å; I854-F918 HydrophobicContact CG2-CD1 4.07Å; I854-F918 HydrophobicContact CG2-CE1 4.03Å; I854-F920 HydrophobicContact CD1-CE1 4.29Å; I854-F920 HydrophobicContact CD1-CZ 4.18Å; I854-F920 HydrophobicContact CG2-CZ 4.22Å; I854-L973 HydrophobicContact CD1-CD1 4.24Å; I854-L973 HydrophobicContact CG1-CD1 4.48Å
855	S	87.2	Confident	82.4	Confident	38 Å²	38	53.1 Å²	53.1	27%	0.266	26%	0.255	S	S	.	.	H	α-helix	trans	-55.8	-40.3	174.2	173.4	0	0	0	0	112.6	V851 A857	V851-S855 VanDerWaalsContact O-CB 3.31Å; V851-S855 WeakPolarHBondContact O-CB 3.38Å; V851-S855 PolarHBondContact O-N 3.02Å; S855-A857 VanDerWaalsContact C-N 3.25Å; S855-A857 PolarHBondContact O-N 2.73Å
856	K	84.9	Confident	81.3	Confident	112 Å²	112	51.3 Å²	51.3	49%	0.487	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-10.8	176	-73.6	168.3	-176.2	174	0	114.3	R852 H853 I854	R852-K856 WeakPolarHBondContact O-CB 3.44Å; R852-K856 VanDerWaalsContact O-CD 3.29Å; R852-K856 WeakPolarHBondContact O-CD 3.37Å; R852-K856 WeakPolarHBondContact O-CG 3.4Å; R852-K856 PolarHBondContact O-N 2.79Å; H853-K856 PolarHBondContact O-N 3.24Å; I854-K856 VanDerWaalsContact C-N 3.29Å; I854-K856 PolarHBondContact O-N 2.95Å
857	A	81.7	Confident	79.9	Confident	10 Å²	10	53.6 Å²	53.6	8%	0.083	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-28.7	-177.2	0	0	0	0	0	114	H853 I854 S855 L940 L1035	H853-A857 PolarHBondContact O-N 2.69Å; I854-A857 PolarHBondContact O-N 2.7Å; S855-A857 VanDerWaalsContact C-N 3.25Å; S855-A857 PolarHBondContact O-N 2.73Å; A857-L940 HydrophobicContact CB-CD1 3.88Å; A857-L940 HydrophobicContact CB-CD2 3.78Å; A857-L940 HydrophobicContact CB-CG 3.63Å; A857-L1035 PolarHBondContact O-N 3.39Å
858	I	84.8	Confident	78.4	Confident	8 Å²	8	54 Å²	54	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	123	177.2	-54.5	177.3	0	0	0	109.7	I854 L861 F918 I925 L1035 A1037	I854-I858 HydrophobicContact CG2-CD1 3.53Å; I854-I858 HydrophobicContact CG2-CG1 4.16Å; I854-I858 PolarHBondContact O-N 2.95Å; I858-L861 HydrophobicContact CB-CD1 4.17Å; I858-L861 HydrophobicContact CB-CD2 4.42Å; I858-L861 HydrophobicContact CB-CG 4.24Å; I858-L861 HydrophobicContact CG2-CD1 4.47Å; I858-L861 HydrophobicContact CG2-CD2 3.94Å; I858-L861 HydrophobicContact CG2-CG 4Å; I858-F918 HydrophobicContact CD1-CD2 4.09Å; I858-F918 HydrophobicContact CD1-CE2 3.86Å; I858-F918 HydrophobicContact CD1-CZ 4.23Å; I858-I925 HydrophobicContact CD1-CG2 4.22Å; I858-L1035 HydrophobicContact CB-CB 4.47Å; I858-L1035 HydrophobicContact CG1-CB 4.03Å; I858-L1035 HydrophobicContact CG1-CD1 4.19Å; I858-L1035 HydrophobicContact CG2-CB 4.5Å; I858-A1037 HydrophobicContact CG2-CB 3.71Å
859	R	82.3	Confident	76.8	Confident	95 Å²	95	56.7 Å²	56.7	36%	0.358	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	164.8	174.2	-71.5	179	164.1	175.7	-6.4	112.2	L861 L1035 A1037	R859-L861 PolarHBondContact O-N 3.47Å; R859-L1035 WeakPolarHBondContact CB-O 3.36Å; R859-L1035 PolarHBondContact N-O 2.9Å; R859-A1037 PolarHBondContact O-N 3.31Å
860	N	80.3	Confident	75	Confident	40 Å²	40	61 Å²	61	21%	0.214	29%	0.291	C	S	.	.			trans	55.6	21.1	165.5	70.5	-93	0	0	0	115.9	Q862 E863 V864 T1036 A1037	N860-Q862 VanDerWaalsContact C-N 3.25Å; N860-Q862 PolarHBondContact O-N 2.96Å; N860-E863 HydrophobicContact CB-CB 4.25Å; N860-E863 HydrophobicContact CB-CG 4.42Å; N860-E863 WeakPolarHBondContact CB-OE2 3.46Å; N860-E863 PolarHBondContact O-N 2.86Å; N860-V864 PolarHBondContact O-N 3.26Å; N860-V864 VanDerWaalsContact O-N 3.17Å; N860-T1036 WeakPolarHBondContact OD1-CA 3.43Å; N860-T1036 VanDerWaalsContact OD1-CB 3.3Å; N860-T1036 WeakPolarHBondContact OD1-CB 3.35Å; N860-T1036 VanDerWaalsContact OD1-CG2 3.25Å; N860-T1036 WeakPolarHBondContact OD1-CG2 3.23Å; N860-T1036 PolarHBondContact OD1-OG1 3.07Å; N860-A1037 PolarHBondContact ND2-O 3.44Å
861	L	80.2	Confident	73.2	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.068	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-37.4	177.5	-75.5	168.9	0	0	0	112.9	I858 R859 E863 L885 I925 A1037	I858-L861 HydrophobicContact CB-CD1 4.17Å; I858-L861 HydrophobicContact CB-CD2 4.42Å; I858-L861 HydrophobicContact CB-CG 4.24Å; I858-L861 HydrophobicContact CG2-CD1 4.47Å; I858-L861 HydrophobicContact CG2-CD2 3.94Å; I858-L861 HydrophobicContact CG2-CG 4Å; R859-L861 PolarHBondContact O-N 3.47Å; L861-E863 VanDerWaalsContact C-N 3.3Å; L861-E863 PolarHBondContact O-N 3.42Å; L861-L885 HydrophobicContact CD1-CB 4.49Å; L861-L885 HydrophobicContact CD1-CD2 4.03Å; L861-I925 HydrophobicContact CD2-CD1 4.01Å; L861-I925 HydrophobicContact CD2-CG2 4.32Å; L861-A1037 HydrophobicContact CD2-CB 3.87Å; L861-A1037 HydrophobicContact CG-CB 4.49Å
862	Q	71.6	Confident	71.1	Confident	142 Å²	142	66.2 Å²	66.2	66%	0.664	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.5	178.2	-67.2	174.4	-23.5	0	0	113.6	N860 P882	N860-Q862 VanDerWaalsContact C-N 3.25Å; N860-Q862 PolarHBondContact O-N 2.96Å; Q862-P882 HydrophobicContact CG-CB 4.23Å
863	E	66.8	Low	69.2	Low	160 Å²	160	65.9 Å²	65.9	75%	0.748	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-18.6	179.4	-61.3	162.2	-148.9	0	0	112.1	N860 L861 K865	N860-E863 HydrophobicContact CB-CB 4.25Å; N860-E863 HydrophobicContact CB-CG 4.42Å; N860-E863 WeakPolarHBondContact CB-OE2 3.46Å; N860-E863 PolarHBondContact O-N 2.86Å; L861-E863 VanDerWaalsContact C-N 3.3Å; L861-E863 PolarHBondContact O-N 3.42Å; E863-K865 PolarHBondContact O-N 3.22Å
864	V	69.1	Low	67.4	Low	19 Å²	19	64 Å²	64	12%	0.115	31%	0.314	C	S	.	.	S	Bend	trans	-72.9	122.4	175.6	171.9	0	0	0	0	108.9	N860 I866 A1037 V1040	N860-V864 PolarHBondContact O-N 3.26Å; N860-V864 VanDerWaalsContact O-N 3.17Å; V864-I866 PolarHBondContact O-N 3.37Å; V864-I866 VanDerWaalsContact O-N 3.07Å; V864-A1037 HydrophobicContact CG2-CB 3.64Å; V864-V1040 HydrophobicContact CB-CG2 4.49Å; V864-V1040 HydrophobicContact CG1-CB 4.37Å; V864-V1040 HydrophobicContact CG1-CG2 3.97Å
865	K	62.2	Low	65	Low	174 Å²	174	68.6 Å²	68.6	76%	0.757	34%	0.336	S	S	*	.			trans	-57.1	115.1	165.5	-65.5	-172.4	177.7	-171.6	0	108.3	E863 L867	E863-K865 PolarHBondContact O-N 3.22Å; K865-L867 PolarHBondContact O-N 3.06Å; K865-L867 VanDerWaalsContact O-N 3.1Å
866	I	64.7	Low	63	Low	23 Å²	23	71.8 Å²	71.8	12%	0.118	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	114.3	161.7	-49.4	173.3	0	0	0	105.2	V864 I869 F878 F883 V1040	V864-I866 PolarHBondContact O-N 3.37Å; V864-I866 VanDerWaalsContact O-N 3.07Å; I866-I869 HydrophobicContact CB-CD1 3.94Å; I866-I869 HydrophobicContact CB-CG1 4.1Å; I866-I869 HydrophobicContact CD1-CD1 4.49Å; I866-I869 HydrophobicContact CG2-CG1 4.24Å; I866-F878 HydrophobicContact CD1-CD1 3.74Å; I866-F878 HydrophobicContact CD1-CE1 4.32Å; I866-F878 HydrophobicContact CD1-CG 4.3Å; I866-F883 HydrophobicContact CD1-CB 4.11Å; I866-F883 HydrophobicContact CD1-CD2 3.49Å; I866-F883 VanDerWaalsContact CD1-CD2 3.49Å; I866-F883 HydrophobicContact CD1-CE2 4.08Å; I866-F883 HydrophobicContact CD1-CG 3.87Å; I866-F883 HydrophobicContact CG1-CD2 4.27Å; I866-F883 HydrophobicContact CG1-CG 4.29Å; I866-V1040 HydrophobicContact CG1-CG1 4.48Å; I866-V1040 HydrophobicContact CG2-CG1 4.37Å
867	L	58.8	Low	61.2	Low	62 Å²	62	69.6 Å²	69.6	33%	0.325	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	137.8	172.5	-63.5	171	0	0	0	106.8	K865 Y1039 V1040 F1041 M1083	K865-L867 PolarHBondContact O-N 3.06Å; K865-L867 VanDerWaalsContact O-N 3.1Å; L867-Y1039 HydrophobicContact CD1-CD1 3.96Å; L867-V1040 PolarHBondContact N-O 3.13Å; L867-V1040 VanDerWaalsContact N-O 3.08Å; L867-F1041 HydrophobicContact CB-CD1 4.02Å; L867-F1041 HydrophobicContact CB-CE1 4.21Å; L867-F1041 HydrophobicContact CD1-CD1 4.18Å; L867-F1041 HydrophobicContact CD1-CE1 3.53Å; L867-F1041 HydrophobicContact CD1-CZ 4.24Å; L867-F1041 HydrophobicContact CG-CE1 4.45Å; L867-M1083 HydrophobicContact CB-CE 3.89Å; L867-M1083 HydrophobicContact CD1-CE 4.43Å
868	N	56.2	Low	59.4	Low	24 Å²	24	70.9 Å²	70.9	13%	0.128	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	99.2	13.6	172.3	-52.9	-16.7	0	0	0	119.7	D870 K1064 M1083	N868-D870 PolarHBondContact O-N 3.33Å; N868-K1064 HydrophobicContact CB-CD 3.58Å; N868-K1064 WeakPolarHBondContact ND2-CD 3.29Å; N868-K1064 PolarHBondContact O-NZ 2.84Å; N868-K1064 WeakPolarHBondContact OD1-CD 3.42Å; N868-M1083 WeakPolarHBondContact ND2-CE 3.42Å; N868-M1083 PolarHBondContact ND2-SD 3.41Å; N868-M1083 VanDerWaalsContact ND2-SD 3.45Å; N868-M1083 WeakPolarHBondContact OD1-CE 3.4Å; N868-M1083 PolarHBondContact OD1-SD 2.83Å
869	I	55.6	Low	57.1	Low	61 Å²	61	71.9 Å²	71.9	31%	0.313	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.1	-176.8	-59.8	161.5	0	0	0	114.3	I866 D871 F878 T879	I866-I869 HydrophobicContact CB-CD1 3.94Å; I866-I869 HydrophobicContact CB-CG1 4.1Å; I866-I869 HydrophobicContact CD1-CD1 4.49Å; I866-I869 HydrophobicContact CG2-CG1 4.24Å; I869-D871 PolarHBondContact O-N 2.9Å; I869-F878 HydrophobicContact CG1-CB 4.47Å; I869-T879 HydrophobicContact CG2-CG2 4.15Å
870	D	50.4	Low	55.2	Low	124 Å²	124	71.5 Å²	71.5	66%	0.663	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	0.5	-165	-33.6	-89.5	0	0	0	117.5	N868 K1064	N868-D870 PolarHBondContact O-N 3.33Å; D870-K1064 IonicContact OD2-NZ 3.94Å; D870-K1064 PolarHBondContact OD2-NZ 3Å; D870-K1064 VanDerWaalsContact OD2-NZ 3.13Å
871	D	50.5	Low	53.9	Low	9 Å²	9	73 Å²	73	5%	0.048	37%	0.374	C	S	.	.	S	Bend	trans	-86.4	101.1	167.5	-82.8	-1.8	0	0	0	108.5	I869 D873 N874 Y1044 R1045 K1067	I869-D871 PolarHBondContact O-N 2.9Å; D871-D873 PolarHBondContact O-N 3.48Å; D871-N874 WeakPolarHBondContact O-CB 3.36Å; D871-N874 PolarHBondContact O-N 2.96Å; D871-Y1044 WeakPolarHBondContact OD2-CE1 3.19Å; D871-R1045 IonicContact OD1-NH1 2.71Å; D871-R1045 PolarHBondContact OD1-NH1 3.46Å; D871-R1045 WeakPolarHBondContact OD2-CD 3.27Å; D871-R1045 IonicContact OD2-CZ 3.22Å; D871-R1045 IonicContact OD2-NH1 3.25Å; D871-R1045 PolarHBondContact OD2-NH1 2.78Å; D871-K1067 VanDerWaalsContact OD1-CB 3.31Å; D871-K1067 WeakPolarHBondContact OD1-CB 3.07Å; D871-K1067 WeakPolarHBondContact OD1-CG 3.42Å
872	I	46	Very low	53	Low	129 Å²	129	75.2 Å²	75.2	66%	0.662	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-50.1	-32.8	-171.6	-61.4	172.4	0	0	0	113.9	N874 E875	I872-N874 PolarHBondContact O-N 3.32Å; I872-N874 VanDerWaalsContact O-N 3.12Å; I872-E875 HydrophobicContact CG2-CG 4.44Å; I872-E875 VanDerWaalsContact O-CB 3.24Å; I872-E875 WeakPolarHBondContact O-CB 3.45Å; I872-E875 VanDerWaalsContact O-CG 3.28Å; I872-E875 WeakPolarHBondContact O-CG 3.38Å; I872-E875 PolarHBondContact O-N 3.45Å
873	D	46.7	Very low	53.1	Low	78 Å²	78	69.5 Å²	69.5	42%	0.417	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-55.1	-31.8	176.3	-38.6	12.2	0	0	0	111.9	D871 E875 S876 K1067	D871-D873 PolarHBondContact O-N 3.48Å; D873-E875 VanDerWaalsContact C-N 3.3Å; D873-E875 PolarHBondContact O-N 2.8Å; D873-S876 PolarHBondContact O-OG 2.97Å; D873-K1067 IonicContact OD1-NZ 3.31Å; D873-K1067 PolarHBondContact OD1-NZ 2.89Å; D873-K1067 IonicContact OD2-NZ 3.26Å; D873-K1067 PolarHBondContact OD2-NZ 3.48Å
874	N	47.4	Very low	53.8	Low	24 Å²	24	67.7 Å²	67.7	13%	0.128	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-81.4	1.7	177.6	-66.1	-41.6	0	0	0	113.9	D871 I872 S876 L877 F878	D871-N874 WeakPolarHBondContact O-CB 3.36Å; D871-N874 PolarHBondContact O-N 2.96Å; I872-N874 PolarHBondContact O-N 3.32Å; I872-N874 VanDerWaalsContact O-N 3.12Å; N874-S876 PolarHBondContact O-N 3.38Å; N874-L877 PolarHBondContact O-N 2.98Å; N874-F878 HydrophobicContact CB-CD2 4.39Å; N874-F878 PolarHBondContact O-N 2.95Å
875	E	38.5	Very low	54.7	Low	96 Å²	96	67 Å²	67	45%	0.449	35%	0.35	S	S	.	.	H	α-helix	trans	-53.8	-39.6	166.9	-78.2	-138.8	89.5	0	0	111	I872 D873 L877 F878 T879	I872-E875 HydrophobicContact CG2-CG 4.44Å; I872-E875 VanDerWaalsContact O-CB 3.24Å; I872-E875 WeakPolarHBondContact O-CB 3.45Å; I872-E875 VanDerWaalsContact O-CG 3.28Å; I872-E875 WeakPolarHBondContact O-CG 3.38Å; I872-E875 PolarHBondContact O-N 3.45Å; D873-E875 VanDerWaalsContact C-N 3.3Å; D873-E875 PolarHBondContact O-N 2.8Å; E875-L877 PolarHBondContact O-N 3.04Å; E875-F878 PolarHBondContact O-N 3.38Å; E875-T879 WeakPolarHBondContact CA-OG1 3.45Å; E875-T879 HydrophobicContact CB-CG2 4.19Å; E875-T879 WeakPolarHBondContact CB-OG1 3.42Å; E875-T879 HydrophobicContact CG-CG2 3.85Å; E875-T879 PolarHBondContact O-N 3.46Å; E875-T879 PolarHBondContact O-OG1 3.29Å; E875-T879 VanDerWaalsContact O-OG1 3.07Å; E875-T879 WeakPolarHBondContact OE1-CB 3.18Å; E875-T879 WeakPolarHBondContact OE1-CG2 3.4Å; E875-T879 PolarHBondContact OE1-OG1 3.32Å
876	S	44.5	Very low	56	Low	104 Å²	104	59.7 Å²	59.7	73%	0.727	32%	0.32	S	S	*	.	H	α-helix	trans	-58.2	-26.7	174	63.9	0	0	0	0	114.5	D873 N874	D873-S876 PolarHBondContact O-OG 2.97Å; N874-S876 PolarHBondContact O-N 3.38Å
877	L	46.2	Very low	57.3	Low	66 Å²	66	60.4 Å²	60.4	35%	0.346	32%	0.323	S	S	.	.	H	α-helix	trans	-100	-27.8	-177.5	-73	170.7	0	0	0	113.4	N874 E875	N874-L877 PolarHBondContact O-N 2.98Å; E875-L877 PolarHBondContact O-N 3.04Å
878	F	44.9	Very low	59	Low	37 Å²	37	59.2 Å²	59.2	16%	0.162	32%	0.319	C	S	.	.	H	α-helix	trans	-136.1	-5.6	-169.8	-64.2	-64.2	0	0	0	117.3	I866 I869 N874 E875 F883	I866-F878 HydrophobicContact CD1-CD1 3.74Å; I866-F878 HydrophobicContact CD1-CE1 4.32Å; I866-F878 HydrophobicContact CD1-CG 4.3Å; I869-F878 HydrophobicContact CG1-CB 4.47Å; N874-F878 HydrophobicContact CB-CD2 4.39Å; N874-F878 PolarHBondContact O-N 2.95Å; E875-F878 PolarHBondContact O-N 3.38Å; F878-F883 HydrophobicContact CD1-CD2 4.45Å; F878-F883 HydrophobicContact CE1-CD2 4.42Å; F878-F883 HydrophobicContact CE1-CE2 4.21Å
879	T	35.2	Very low	60.7	Low	30 Å²	30	58.6 Å²	58.6	18%	0.184	32%	0.315	C	S	.	.	S	Bend	trans	-97.6	153.8	-178.2	68.7	0	0	0	0	115.1	R74 I869 E875 N881	R74-T879 PolarHBondContact NH2-O 3.32Å; I869-T879 HydrophobicContact CG2-CG2 4.15Å; E875-T879 WeakPolarHBondContact CA-OG1 3.45Å; E875-T879 HydrophobicContact CB-CG2 4.19Å; E875-T879 WeakPolarHBondContact CB-OG1 3.42Å; E875-T879 HydrophobicContact CG-CG2 3.85Å; E875-T879 PolarHBondContact O-N 3.46Å; E875-T879 PolarHBondContact O-OG1 3.29Å; E875-T879 VanDerWaalsContact O-OG1 3.07Å; E875-T879 WeakPolarHBondContact OE1-CB 3.18Å; E875-T879 WeakPolarHBondContact OE1-CG2 3.4Å; E875-T879 PolarHBondContact OE1-OG1 3.32Å; T879-N881 PolarHBondContact O-N 3.13Å
880	N	43.9	Very low	62.5	Low	86 Å²	86	55.7 Å²	55.7	46%	0.46	30%	0.3	S	S	.	.	S	Bend	trans	66.3	-10.5	177.6	-57.4	-59.6	0	0	0	117.7	R74 L75	R74-N880 HydrophobicContact CG-CB 4.06Å; R74-N880 VanDerWaalsContact CG-O 3.24Å; R74-N880 WeakPolarHBondContact CG-O 3.31Å; L75-N880 HydrophobicContact CD1-CB 4.45Å
881	N	52.1	Low	64.6	Low	71 Å²	71	52 Å²	52	38%	0.38	28%	0.277	S	S	.	.	S	Bend	trans	-104.9	148.5	172.5	-68.1	34.3	0	0	0	111	S73 R74 T879	S73-N881 PolarHBondContact O-ND2 3.05Å; S73-N881 PolarHBondContact O-OD1 2.88Å; S73-N881 VanDerWaalsContact O-OD1 3.07Å; S73-N881 PolarHBondContact OG-ND2 3.13Å; R74-N881 PolarHBondContact NE-OD1 3.09Å; R74-N881 PolarHBondContact NH2-OD1 3.16Å; T879-N881 PolarHBondContact O-N 3.13Å
882	P	61.5	Low	66.6	Low	61 Å²	61	52.9 Å²	52.9	40%	0.396	28%	0.282	S	S	.	.			trans	-61.9	136.2	163.2	28.1	-34.3	0	0	0	110	Q862 E884	Q862-P882 HydrophobicContact CG-CB 4.23Å; P882-E884 PolarHBondContact O-N 2.87Å; P882-E884 VanDerWaalsContact O-N 3.13Å
883	F	73.6	Confident	68.7	Low	22 Å²	22	47.8 Å²	47.8	10%	0.096	26%	0.256	C	S	.	.			trans	-54.9	117	-177.4	173.8	-119.3	0	0	0	112.1	I866 F878 L885 L923 V1040	I866-F883 HydrophobicContact CD1-CB 4.11Å; I866-F883 HydrophobicContact CD1-CD2 3.49Å; I866-F883 VanDerWaalsContact CD1-CD2 3.49Å; I866-F883 HydrophobicContact CD1-CE2 4.08Å; I866-F883 HydrophobicContact CD1-CG 3.87Å; I866-F883 HydrophobicContact CG1-CD2 4.27Å; I866-F883 HydrophobicContact CG1-CG 4.29Å; F878-F883 HydrophobicContact CD1-CD2 4.45Å; F878-F883 HydrophobicContact CE1-CD2 4.42Å; F878-F883 HydrophobicContact CE1-CE2 4.21Å; F883-L885 HydrophobicContact CE1-CB 4.45Å; F883-L885 HydrophobicContact CZ-CD1 4.08Å; F883-L923 HydrophobicContact CE2-CD2 4.1Å; F883-L923 HydrophobicContact CZ-CD2 3.87Å; F883-V1040 HydrophobicContact CE1-CG1 4.1Å; F883-V1040 HydrophobicContact CE1-CG2 4.11Å; F883-V1040 HydrophobicContact CZ-CG1 3.86Å
884	E	81.7	Confident	70.8	Confident	122 Å²	122	44.9 Å²	44.9	57%	0.57	24%	0.242	S	C	*	.			trans	-105	118.6	174.4	177.1	151.9	-149.2	0	0	110.4	P882 V886 R890	P882-E884 PolarHBondContact O-N 2.87Å; P882-E884 VanDerWaalsContact O-N 3.13Å; E884-V886 VanDerWaalsContact C-N 3.31Å; E884-V886 HydrophobicContact CG-CB 4.43Å; E884-V886 PolarHBondContact O-N 2.91Å; E884-R890 PolarHBondContact O-NH1 3.37Å
885	L	88.4	Confident	72.9	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.016	25%	0.247	C	C	.	.	S	Bend	trans	-72.5	-26	179.3	-176.4	54.7	0	0	0	112.6	V851 I854 L861 F883 E887 R890 F920 L923 I925	V851-L885 HydrophobicContact CG1-CD1 4.41Å; V851-L885 HydrophobicContact CG1-CD2 4.49Å; V851-L885 HydrophobicContact CG1-CG 3.79Å; V851-L885 VanDerWaalsContact CG1-O 3.23Å; V851-L885 WeakPolarHBondContact CG1-O 3.24Å; I854-L885 HydrophobicContact CG2-CD2 4.48Å; L861-L885 HydrophobicContact CD1-CB 4.49Å; L861-L885 HydrophobicContact CD1-CD2 4.03Å; F883-L885 HydrophobicContact CE1-CB 4.45Å; F883-L885 HydrophobicContact CZ-CD1 4.08Å; L885-E887 VanDerWaalsContact C-N 3.33Å; L885-E887 PolarHBondContact O-N 3.28Å; L885-E887 VanDerWaalsContact O-N 3.07Å; L885-R890 WeakPolarHBondContact O-CD 3.33Å; L885-R890 PolarHBondContact O-NH1 2.9Å; L885-F920 HydrophobicContact CD1-CE1 4.49Å; L885-F920 HydrophobicContact CD1-CE2 4.43Å; L885-F920 HydrophobicContact CD1-CZ 4.25Å; L885-F920 HydrophobicContact CD2-CZ 4.18Å; L885-L923 HydrophobicContact CD1-CD1 4.26Å; L885-L923 HydrophobicContact CD1-CD2 4.46Å; L885-I925 HydrophobicContact CD1-CD1 3.63Å; L885-I925 HydrophobicContact CD2-CD1 3.49Å; L885-I925 VanDerWaalsContact CD2-CD1 3.49Å; L885-I925 HydrophobicContact CG-CD1 4.21Å
886	V	89.8	Confident	75.2	Confident	22 Å²	22	42.3 Å²	42.3	13%	0.133	23%	0.228	C	C	.	.			trans	-90.5	61.1	-167.6	-164.3	0	0	0	0	112.1	V851 R852 E884	V851-V886 HydrophobicContact CG1-CG2 4.48Å; R852-V886 HydrophobicContact CB-CG1 3.88Å; R852-V886 HydrophobicContact CB-CG2 4.16Å; R852-V886 HydrophobicContact CG-CG1 4.31Å; R852-V886 HydrophobicContact CG-CG2 4.41Å; E884-V886 VanDerWaalsContact C-N 3.31Å; E884-V886 HydrophobicContact CG-CB 4.43Å; E884-V886 PolarHBondContact O-N 2.91Å
887	E	91.8	Very high	77.3	Confident	37 Å²	37	39 Å²	39	17%	0.173	20%	0.203	C	C	.	.			trans	-85.7	143.6	176	-72.1	174.4	-116.2	0	0	111.9	L885 H889 R890	L885-E887 VanDerWaalsContact C-N 3.33Å; L885-E887 PolarHBondContact O-N 3.28Å; L885-E887 VanDerWaalsContact O-N 3.07Å; E887-H889 VanDerWaalsContact C-N 3.26Å; E887-H889 PolarHBondContact O-N 2.78Å; E887-H889 VanDerWaalsContact O-N 3.12Å; E887-H889 IonicContact OE2-CE1 2.69Å; E887-H889 PolarHBondContact OE2-CE1 3.4Å; E887-H889 IonicContact OE2-NE2 3.24Å; E887-R890 HydrophobicContact CB-CB 4.29Å; E887-R890 VanDerWaalsContact CD-NH1 3.33Å; E887-R890 VanDerWaalsContact CD-NH2 3.28Å; E887-R890 PolarHBondContact O-N 3.38Å; E887-R890 IonicContact OE1-CZ 2.77Å; E887-R890 IonicContact OE1-NH1 2.74Å; E887-R890 PolarHBondContact OE1-NH1 3.48Å; E887-R890 IonicContact OE1-NH2 2.88Å; E887-R890 PolarHBondContact OE1-NH2 3.36Å; E887-R890 IonicContact OE2-NH2 3.86Å
888	P	93.3	Very high	79.3	Confident	38 Å²	38	35.9 Å²	35.9	25%	0.247	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.5	-172.6	-29.6	37.1	0	0	0	116.1	N585 C620 K623 Q847	N585-P888 WeakPolarHBondContact O-CB 3.39Å; C620-P888 HydrophobicContact CB-CB 3.94Å; C620-P888 WeakPolarHBondContact CB-O 3.5Å; K623-P888 HydrophobicContact CG-CB 3.84Å; K623-P888 HydrophobicContact CG-CG 4.47Å; Q847-P888 PolarHBondContact NE2-O 3.34Å; Q847-P888 VanDerWaalsContact NE2-O 3.08Å
889	H	92.9	Very high	81.3	Confident	10 Å²	10	34.8 Å²	34.8	5%	0.046	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-8.1	-179.5	68.1	-96.8	0	0	0	113.8	N585 R586 E887 N921 D922	N585-H889 VanDerWaalsContact CB-CA 3.48Å; N585-H889 HydrophobicContact CB-CB 3.66Å; R586-H889 HydrophobicContact CG-CB 3.84Å; R586-H889 VanDerWaalsContact CZ-CE1 3.45Å; R586-H889 VanDerWaalsContact CZ-NE2 3.29Å; R586-H889 PolarHBondContact NH1-CE1 2.91Å; R586-H889 PolarHBondContact NH2-CD2 3.46Å; R586-H889 PolarHBondContact NH2-NE2 3.3Å; E887-H889 VanDerWaalsContact C-N 3.26Å; E887-H889 PolarHBondContact O-N 2.78Å; E887-H889 VanDerWaalsContact O-N 3.12Å; E887-H889 IonicContact OE2-CE1 2.69Å; E887-H889 PolarHBondContact OE2-CE1 3.4Å; E887-H889 IonicContact OE2-NE2 3.24Å; H889-N921 PolarHBondContact O-ND2 3.14Å; H889-D922 IonicContact NE2-OD2 3.55Å
890	R	93.8	Very high	83.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.178	C	C	.	.			trans	-85.1	129.8	-177	-170	168.2	-62.7	123	2.8	110	V851 E884 L885 E887 F920 N921 D922	V851-R890 WeakPolarHBondContact CG2-O 3.47Å; E884-R890 PolarHBondContact O-NH1 3.37Å; L885-R890 WeakPolarHBondContact O-CD 3.33Å; L885-R890 PolarHBondContact O-NH1 2.9Å; E887-R890 HydrophobicContact CB-CB 4.29Å; E887-R890 VanDerWaalsContact CD-NH1 3.33Å; E887-R890 VanDerWaalsContact CD-NH2 3.28Å; E887-R890 PolarHBondContact O-N 3.38Å; E887-R890 IonicContact OE1-CZ 2.77Å; E887-R890 IonicContact OE1-NH1 2.74Å; E887-R890 PolarHBondContact OE1-NH1 3.48Å; E887-R890 IonicContact OE1-NH2 2.88Å; E887-R890 PolarHBondContact OE1-NH2 3.36Å; E887-R890 IonicContact OE2-NH2 3.86Å; R890-F920 HydrophobicContact CG-CB 3.98Å; R890-F920 HydrophobicContact CG-CD1 3.74Å; R890-F920 HydrophobicContact CG-CG 4.13Å; R890-N921 WeakPolarHBondContact CA-OD1 3.39Å; R890-D922 WeakPolarHBondContact CD-OD1 3.3Å; R890-D922 WeakPolarHBondContact CG-OD1 3.33Å; R890-D922 IonicContact CZ-OD1 3.43Å; R890-D922 IonicContact CZ-OD2 3.18Å; R890-D922 VanDerWaalsContact CZ-OD2 3.23Å; R890-D922 VanDerWaalsContact NE-CG 3.3Å; R890-D922 IonicContact NE-OD1 3.44Å; R890-D922 PolarHBondContact NE-OD1 2.88Å; R890-D922 IonicContact NE-OD2 2.9Å; R890-D922 PolarHBondContact NE-OD2 3.13Å; R890-D922 IonicContact NH2-OD2 2.66Å; R890-D922 PolarHBondContact NH2-OD2 3.32Å
891	R	93.1	Very high	85.6	Confident	48 Å²	48	31.7 Å²	31.7	18%	0.181	17%	0.165	C	C	.	.			trans	-135.3	148.5	175	70.8	-173.1	-168.5	-75.3	-1.9	110.4	Q847 V893 F920 N921 E1107	Q847-R891 HydrophobicContact CB-CB 3.92Å; Q847-R891 HydrophobicContact CG-CB 3.95Å; R891-V893 PolarHBondContact O-N 2.68Å; R891-F920 VanDerWaalsContact O-CA 3.24Å; R891-F920 WeakPolarHBondContact O-CA 3.27Å; R891-F920 WeakPolarHBondContact O-CB 3.44Å; R891-N921 HydrophobicContact CG-CB 4.18Å; R891-N921 PolarHBondContact N-OD1 3.13Å; R891-N921 PolarHBondContact NH1-ND2 3.03Å; R891-N921 PolarHBondContact O-N 2.99Å; R891-N921 PolarHBondContact O-OD1 3.33Å; R891-E1107 IonicContact CZ-OE1 3.92Å; R891-E1107 IonicContact CZ-OE2 2.93Å; R891-E1107 VanDerWaalsContact CZ-OE2 3.3Å; R891-E1107 VanDerWaalsContact NH1-CD 3.28Å; R891-E1107 IonicContact NH1-OE1 2.67Å; R891-E1107 PolarHBondContact NH1-OE1 3.34Å; R891-E1107 IonicContact NH1-OE2 3.13Å; R891-E1107 PolarHBondContact NH1-OE2 2.96Å; R891-E1107 IonicContact NH2-OE1 3.22Å; R891-E1107 IonicContact NH2-OE2 2.69Å; R891-E1107 PolarHBondContact NH2-OE2 2.89Å
892	L	93.1	Very high	86.6	Confident	27 Å²	27	30.5 Å²	30.5	14%	0.141	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	127.9	170.5	-174.2	75.3	0	0	0	108.4	I850 I854 F918 F920 L973	I850-L892 HydrophobicContact CG2-CB 4.29Å; I854-L892 HydrophobicContact CD1-CB 4.4Å; I854-L892 HydrophobicContact CD1-CD1 4.03Å; I854-L892 HydrophobicContact CD1-CD2 4.09Å; I854-L892 HydrophobicContact CD1-CG 4.41Å; L892-F918 HydrophobicContact CD1-CB 4.21Å; L892-F918 HydrophobicContact CD1-CD1 4.15Å; L892-F920 HydrophobicContact CB-CE1 4.45Å; L892-F920 HydrophobicContact CD1-CD1 4.48Å; L892-F920 HydrophobicContact CD1-CE1 4.21Å; L892-F920 HydrophobicContact CD1-CE2 4.47Å; L892-F920 HydrophobicContact CD1-CZ 4.22Å; L892-L973 HydrophobicContact CD2-CD1 3.96Å
893	V	91.2	Very high	86.6	Confident	21 Å²	21	33.1 Å²	33.1	13%	0.127	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-56.9	171	-178.7	0	0	0	0	108.5	R891 V919 N921 P968 D1100 A1104	R891-V893 PolarHBondContact O-N 2.68Å; V893-V919 HydrophobicContact CB-CG1 4.3Å; V893-V919 PolarHBondContact N-O 3.45Å; V893-N921 HydrophobicContact CG2-CB 3.98Å; V893-P968 WeakPolarHBondContact O-CG 3.48Å; V893-D1100 HydrophobicContact CG1-CB 3.82Å; V893-A1104 HydrophobicContact CG2-CB 4.45Å
894	C	90.5	Very high	85.6	Confident	18 Å²	18	39.7 Å²	39.7	12%	0.122	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	161.9	178.4	83.5	0	0	0	0	113.7	V919 D1100	C894-V919 PolarHBondContact N-O 3.29Å; C894-V919 VanDerWaalsContact N-O 3.17Å; C894-V919 PolarHBondContact O-N 3.47Å; C894-D1100 HydrophobicContact CB-CB 4.13Å; C894-D1100 WeakPolarHBondContact CB-OD2 3.43Å; C894-D1100 PolarHBondContact SG-OD2 3.04Å
895	Y	90.5	Very high	83.9	Confident	58 Å²	58	37.9 Å²	37.9	23%	0.227	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	130.4	174.1	160.2	-94.3	0	0	0	108.7	H916 L917 F918 F942	Y895-H916 HydrophobicContact CE2-CB 4.05Å; Y895-H916 AromaticContact CE2-ND1 3.76Å; Y895-H916 AromaticContact CZ-ND1 3.76Å; Y895-H916 PolarHBondContact OH-ND1 3.33Å; Y895-L917 WeakPolarHBondContact CA-O 3.44Å; Y895-F918 AromaticContact CD2-CD1 3.88Å; Y895-F918 HydrophobicContact CD2-CD1 3.88Å; Y895-F918 AromaticContact CD2-CE1 3.6Å; Y895-F918 HydrophobicContact CD2-CE1 3.6Å; Y895-F918 HydrophobicContact CD2-CE2 4.32Å; Y895-F918 HydrophobicContact CD2-CG 4.36Å; Y895-F918 AromaticContact CD2-CZ 3.84Å; Y895-F918 HydrophobicContact CD2-CZ 3.84Å; Y895-F918 HydrophobicContact CE2-CE1 4.11Å; Y895-F918 HydrophobicContact CE2-CE2 4.35Å; Y895-F918 AromaticContact CE2-CZ 3.9Å; Y895-F918 HydrophobicContact CE2-CZ 3.9Å; Y895-F942 AromaticContact CD1-CD1 3.41Å; Y895-F942 HydrophobicContact CD1-CD1 3.41Å; Y895-F942 VanDerWaalsContact CD1-CD1 3.41Å; Y895-F942 AromaticContact CD1-CE1 3.38Å; Y895-F942 HydrophobicContact CD1-CE1 3.38Å; Y895-F942 HydrophobicContact CD1-CG 4.02Å; Y895-F942 AromaticContact CD1-CZ 4Å; Y895-F942 HydrophobicContact CD1-CZ 4Å; Y895-F942 HydrophobicContact CD2-CD1 4.49Å; Y895-F942 AromaticContact CD2-CE1 3.64Å; Y895-F942 HydrophobicContact CD2-CE1 3.64Å; Y895-F942 HydrophobicContact CD2-CE2 4.47Å; Y895-F942 AromaticContact CD2-CZ 3.63Å; Y895-F942 HydrophobicContact CD2-CZ 3.63Å; Y895-F942 HydrophobicContact CE1-CB 4.27Å; Y895-F942 AromaticContact CE1-CD1 3.5Å; Y895-F942 HydrophobicContact CE1-CD1 3.5Å; Y895-F942 AromaticContact CE1-CD2 3.83Å; Y895-F942 HydrophobicContact CE1-CD2 3.83Å; Y895-F942 AromaticContact CE1-CE1 3.6Å; Y895-F942 HydrophobicContact CE1-CE1 3.6Å; Y895-F942 AromaticContact CE1-CE2 3.93Å; Y895-F942 HydrophobicContact CE1-CE2 3.93Å; Y895-F942 AromaticContact CE1-CG 3.61Å; Y895-F942 HydrophobicContact CE1-CG 3.61Å; Y895-F942 AromaticContact CE1-CZ 3.81Å; Y895-F942 HydrophobicContact CE1-CZ 3.81Å; Y895-F942 AromaticContact CE2-CE1 3.82Å; Y895-F942 HydrophobicContact CE2-CE1 3.82Å; Y895-F942 AromaticContact CE2-CE2 3.82Å; Y895-F942 HydrophobicContact CE2-CE2 3.82Å; Y895-F942 AromaticContact CE2-CZ 3.41Å; Y895-F942 HydrophobicContact CE2-CZ 3.41Å; Y895-F942 VanDerWaalsContact CE2-CZ 3.41Å; Y895-F942 AromaticContact CG-CD1 3.94Å; Y895-F942 HydrophobicContact CG-CD1 3.94Å; Y895-F942 AromaticContact CG-CE1 3.4Å; Y895-F942 HydrophobicContact CG-CE1 3.4Å; Y895-F942 VanDerWaalsContact CG-CE1 3.4Å; Y895-F942 AromaticContact CG-CZ 3.91Å; Y895-F942 HydrophobicContact CG-CZ 3.91Å; Y895-F942 AromaticContact CZ-CD2 3.81Å; Y895-F942 AromaticContact CZ-CE1 3.8Å; Y895-F942 AromaticContact CZ-CE2 3.52Å; Y895-F942 AromaticContact CZ-CZ 3.51Å
896	C	86.9	Confident	81.4	Confident	8 Å²	8	42 Å²	42	5%	0.054	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.7	-179.2	-166.4	0	0	0	0	110.9	V898 L917	C896-V898 HydrophobicContact CB-CG1 4.14Å; C896-L917 HydrophobicContact CB-CB 4.48Å; C896-L917 PolarHBondContact N-O 2.95Å; C896-L917 PolarHBondContact O-N 2.98Å
897	T	87.8	Confident	79.1	Confident	34 Å²	34	45.3 Å²	45.3	21%	0.209	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	121.5	164.7	-53.4	0	0	0	0	107.6	L914 R915 L1089	T897-L914 HydrophobicContact CG2-CD2 4.37Å; T897-R915 WeakPolarHBondContact CA-O 3.34Å; T897-L1089 HydrophobicContact CG2-CD1 4.18Å; T897-L1089 WeakPolarHBondContact O-CD1 3.27Å; T897-L1089 WeakPolarHBondContact O-CG 3.43Å
898	V	88.5	Confident	76.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	156.4	-174.4	-60.5	0	0	0	0	111.2	C896 L914 R915 L917 I1086 A1087 L1097	C896-V898 HydrophobicContact CB-CG1 4.14Å; V898-L914 CarbonylContact O-C 3.23Å; V898-L914 WeakPolarHBondContact O-CA 3.48Å; V898-R915 HydrophobicContact CG2-CB 4.35Å; V898-R915 PolarHBondContact N-O 3.33Å; V898-R915 PolarHBondContact O-N 3.17Å; V898-L917 HydrophobicContact CG1-CB 4.24Å; V898-L917 HydrophobicContact CG1-CD2 3.89Å; V898-L917 HydrophobicContact CG2-CB 3.95Å; V898-L917 HydrophobicContact CG2-CD2 4.4Å; V898-I1086 HydrophobicContact CB-CB 4.37Å; V898-I1086 HydrophobicContact CG2-CB 4.24Å; V898-I1086 HydrophobicContact CG2-CG2 3.89Å; V898-A1087 WeakPolarHBondContact CB-O 3.18Å; V898-L1097 HydrophobicContact CG1-CD2 4.19Å
899	V	87.9	Confident	74.2	Confident	15 Å²	15	58 Å²	58	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.9	164.3	-177.6	0	0	0	0	108.2	I901 L914 Y1056 I1086 A1087 L1089	V899-I901 HydrophobicContact CG1-CG1 4.43Å; V899-L914 HydrophobicContact CG2-CD2 4.12Å; V899-Y1056 HydrophobicContact CB-CE1 4.48Å; V899-Y1056 HydrophobicContact CG1-CE1 3.98Å; V899-I1086 CarbonylContact O-C 3.58Å; V899-I1086 VanDerWaalsContact O-CA 3.27Å; V899-I1086 WeakPolarHBondContact O-CA 3.33Å; V899-A1087 HydrophobicContact CB-CB 4.46Å; V899-A1087 PolarHBondContact N-O 3.16Å; V899-A1087 PolarHBondContact O-N 3.31Å; V899-L1089 HydrophobicContact CG2-CD2 4.01Å
900	H	87.1	Confident	71.7	Confident	17 Å²	17	63.6 Å²	63.6	8%	0.079	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	125.8	171.9	-177	-99.3	0	0	0	110.7	N902 I913 R915	H900-N902 PolarHBondContact CE1-OD1 3.33Å; H900-N902 VanDerWaalsContact CE1-OD1 3.23Å; H900-N902 PolarHBondContact ND1-OD1 3.39Å; H900-I913 PolarHBondContact N-O 3.04Å; H900-R915 HydrophobicContact CB-CB 4.41Å; H900-R915 HydrophobicContact CB-CG 3.52Å
901	I	82.9	Confident	69.4	Low	33 Å²	33	67.8 Å²	67.8	17%	0.169	35%	0.347	C	S	.	.			trans	-100.5	102.9	-174.4	-65.6	163.3	0	0	0	108.7	V899 Q903 F1051 Y1056 I1085 A1087	V899-I901 HydrophobicContact CG1-CG1 4.43Å; I901-Q903 PolarHBondContact O-N 2.8Å; I901-F1051 HydrophobicContact CD1-CZ 4.11Å; I901-Y1056 HydrophobicContact CD1-CD1 3.9Å; I901-Y1056 HydrophobicContact CD1-CD2 3.61Å; I901-Y1056 HydrophobicContact CD1-CE1 3.91Å; I901-Y1056 HydrophobicContact CD1-CE2 3.64Å; I901-Y1056 HydrophobicContact CD1-CG 3.75Å; I901-Y1056 HydrophobicContact CG1-CE1 4.18Å; I901-Y1056 HydrophobicContact CG1-CE2 4.04Å; I901-I1085 HydrophobicContact CB-CB 4.03Å; I901-I1085 HydrophobicContact CB-CG2 3.9Å; I901-I1085 HydrophobicContact CD1-CG2 3.75Å; I901-I1085 HydrophobicContact CG1-CG2 4.39Å; I901-I1085 HydrophobicContact CG2-CB 4.4Å; I901-I1085 HydrophobicContact CG2-CG2 4.21Å; I901-I1085 PolarHBondContact N-O 2.87Å; I901-A1087 HydrophobicContact CD1-CB 4.34Å
902	N	71.5	Confident	67.6	Low	47 Å²	47	68.8 Å²	68.8	25%	0.251	36%	0.361	S	S	.	.			trans	-76.5	112.5	176.1	-64.8	-18.8	0	0	0	110	H900 N904 Q905 I913	H900-N902 PolarHBondContact CE1-OD1 3.33Å; H900-N902 VanDerWaalsContact CE1-OD1 3.23Å; H900-N902 PolarHBondContact ND1-OD1 3.39Å; N902-N904 PolarHBondContact O-N 3.48Å; N902-Q905 HydrophobicContact CB-CG 3.99Å; N902-Q905 PolarHBondContact ND2-NE2 2.81Å; N902-I913 VanDerWaalsContact ND2-CD1 3.27Å; N902-I913 WeakPolarHBondContact ND2-CD1 3.35Å
903	Q	61.5	Low	66.8	Low	116 Å²	116	69.7 Å²	69.7	54%	0.542	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.6	177.6	-62.6	-176.8	-8.6	0	0	113.4	I901 Q905 Q1082 I1085	I901-Q903 PolarHBondContact O-N 2.8Å; Q903-Q905 PolarHBondContact O-N 3.18Å; Q903-Q905 VanDerWaalsContact O-N 3.15Å; Q903-Q1082 VanDerWaalsContact NE2-CD 3.34Å; Q903-I1085 HydrophobicContact CG-CD1 4.15Å
904	N	52.4	Low	66.5	Low	160 Å²	160	73.3 Å²	73.3	86%	0.856	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	28.8	-174.3	-61.1	-1.6	0	0	0	113.9	N902	N902-N904 PolarHBondContact O-N 3.48Å
905	Q	46.3	Very low	66.4	Low	83 Å²	83	74 Å²	74	39%	0.388	38%	0.384	S	S	.	.	S	Bend	trans	-118.2	135.4	177.9	-71.8	-174.5	-30.2	0	0	111.6	N902 Q903	N902-Q905 HydrophobicContact CB-CG 3.99Å; N902-Q905 PolarHBondContact ND2-NE2 2.81Å; Q903-Q905 PolarHBondContact O-N 3.18Å; Q903-Q905 VanDerWaalsContact O-N 3.15Å
906	P	36.6	Very low	66.3	Low	89 Å²	89	72.6 Å²	72.6	58%	0.578	38%	0.38	S	S	*	.			trans	-69.3	144.1	-178.9	28.6	-34.6	0	0	0	111.2	H908 K909	P906-H908 PolarHBondContact O-N 3.27Å; P906-K909 PolarHBondContact O-N 2.93Å
907	P	41.9	Very low	66.5	Low	93 Å²	93	72.3 Å²	72.3	60%	0.604	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-0.4	-165.7	27.2	-37	0	0	0	115.9
908	H	41.5	Very low	66.8	Low	181 Å²	181	70.7 Å²	70.7	84%	0.838	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	10.7	178.1	-62.2	-67.1	0	0	0	113.7	P906	P906-H908 PolarHBondContact O-N 3.27Å
909	K	40.7	Very low	66.9	Low	160 Å²	160	70.7 Å²	70.7	70%	0.696	37%	0.368	S	S	*	.			trans	-136.2	72.9	170.8	-73.7	-172.6	176.3	176.4	0	111	P906 T911	P906-K909 PolarHBondContact O-N 2.93Å; K909-T911 PolarHBondContact O-N 3.25Å
910	E	40.6	Very low	67.2	Low	127 Å²	127	70 Å²	70	59%	0.593	36%	0.363	S	S	*	.			trans	-71.2	65.6	171.7	-63.1	-165.8	125.7	0	0	112	S912	E910-S912 VanDerWaalsContact C-N 3.26Å; E910-S912 PolarHBondContact O-N 2.85Å
911	T	44.5	Very low	67.5	Low	89 Å²	89	69.2 Å²	69.2	55%	0.546	36%	0.359	S	S	.	.			trans	-75.9	85.1	163.4	49.8	0	0	0	0	108.4	K909 I913	K909-T911 PolarHBondContact O-N 3.25Å; T911-I913 WeakPolarHBondContact O-CG1 3.15Å; T911-I913 PolarHBondContact O-N 3.48Å
912	S	56.7	Low	67.9	Low	68 Å²	68	68 Å²	68	48%	0.476	35%	0.353	S	S	.	.			trans	-60.7	93.6	176.8	44.9	0	0	0	0	110.9	E910 L914	E910-S912 VanDerWaalsContact C-N 3.26Å; E910-S912 PolarHBondContact O-N 2.85Å; S912-L914 PolarHBondContact O-N 3.01Å
913	I	75.6	Confident	68.9	Low	46 Å²	46	65.9 Å²	65.9	24%	0.236	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	109.4	-167.8	-24.1	178.1	0	0	0	111.1	H900 N902 T911	H900-I913 PolarHBondContact N-O 3.04Å; N902-I913 VanDerWaalsContact ND2-CD1 3.27Å; N902-I913 WeakPolarHBondContact ND2-CD1 3.35Å; T911-I913 WeakPolarHBondContact O-CG1 3.15Å; T911-I913 PolarHBondContact O-N 3.48Å
914	L	84.4	Confident	70.3	Confident	97 Å²	97	60.6 Å²	60.6	51%	0.508	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	141.4	172.4	-63.3	174.7	0	0	0	111.8	T897 V898 V899 S912 L1089	T897-L914 HydrophobicContact CG2-CD2 4.37Å; V898-L914 CarbonylContact O-C 3.23Å; V898-L914 WeakPolarHBondContact O-CA 3.48Å; V899-L914 HydrophobicContact CG2-CD2 4.12Å; S912-L914 PolarHBondContact O-N 3.01Å; L914-L1089 HydrophobicContact CD2-CD2 3.92Å
915	R	88.5	Confident	72.2	Confident	34 Å²	34	53 Å²	53	13%	0.128	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	154.1	177.9	-66.6	-62.4	176.5	-111.6	2.7	111.5	T897 V898 H900 I926 A927	T897-R915 WeakPolarHBondContact CA-O 3.34Å; V898-R915 HydrophobicContact CG2-CB 4.35Å; V898-R915 PolarHBondContact N-O 3.33Å; V898-R915 PolarHBondContact O-N 3.17Å; H900-R915 HydrophobicContact CB-CB 4.41Å; H900-R915 HydrophobicContact CB-CG 3.52Å; R915-I926 HydrophobicContact CB-CG2 3.9Å; R915-I926 HydrophobicContact CG-CG2 3.96Å; R915-A927 WeakPolarHBondContact CD-O 3.46Å
916	H	89.5	Confident	74.2	Confident	28 Å²	28	49.1 Å²	49.1	13%	0.13	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	118	168.8	-59.9	-87.3	0	0	0	108.2	Y895 F918 I926 A927 D929 L1035	Y895-H916 HydrophobicContact CE2-CB 4.05Å; Y895-H916 AromaticContact CE2-ND1 3.76Å; Y895-H916 AromaticContact CZ-ND1 3.76Å; Y895-H916 PolarHBondContact OH-ND1 3.33Å; H916-F918 HydrophobicContact CB-CE2 3.8Å; H916-F918 HydrophobicContact CB-CZ 4.47Å; H916-I926 WeakPolarHBondContact O-CA 3.47Å; H916-A927 HydrophobicContact CB-CB 4.39Å; H916-A927 PolarHBondContact N-O 3.47Å; H916-A927 PolarHBondContact O-N 3.07Å; H916-D929 IonicContact NE2-OD1 2.98Å; H916-D929 PolarHBondContact NE2-OD1 2.86Å; H916-D929 IonicContact NE2-OD2 3.56Å; H916-L1035 HydrophobicContact CB-CD1 4.47Å; H916-L1035 HydrophobicContact CB-CD2 4.5Å; H916-L1035 VanDerWaalsContact CD2-CD2 3.46Å; H916-L1035 WeakPolarHBondContact CD2-CD2 3.07Å
917	L	90.5	Very high	76.8	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123	176.2	-177.5	68.2	0	0	0	108.4	Y895 C896 V898 V919 I924 I926 I1086 L1097	Y895-L917 WeakPolarHBondContact CA-O 3.44Å; C896-L917 HydrophobicContact CB-CB 4.48Å; C896-L917 PolarHBondContact N-O 2.95Å; C896-L917 PolarHBondContact O-N 2.98Å; V898-L917 HydrophobicContact CG1-CB 4.24Å; V898-L917 HydrophobicContact CG1-CD2 3.89Å; V898-L917 HydrophobicContact CG2-CB 3.95Å; V898-L917 HydrophobicContact CG2-CD2 4.4Å; L917-V919 HydrophobicContact CD2-CG2 4.31Å; L917-V919 HydrophobicContact CG-CG2 4.18Å; L917-I924 HydrophobicContact CD1-CG2 3.38Å; L917-I926 HydrophobicContact CD1-CD1 3.78Å; L917-I926 HydrophobicContact CD1-CG1 3.6Å; L917-I1086 HydrophobicContact CD2-CD1 3.76Å; L917-L1097 HydrophobicContact CD2-CD1 3.7Å; L917-L1097 HydrophobicContact CD2-CD2 3.76Å; L917-L1097 HydrophobicContact CD2-CG 4.39Å
918	F	92.9	Very high	78.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.4	170.7	-60.6	-97.9	0	0	0	107.9	I854 I858 L892 Y895 H916 F920 I924 I925 A927 L940 F942 L1035	I854-F918 HydrophobicContact CD1-CD1 4.27Å; I854-F918 HydrophobicContact CG1-CE1 4.43Å; I854-F918 HydrophobicContact CG2-CD1 4.07Å; I854-F918 HydrophobicContact CG2-CE1 4.03Å; I858-F918 HydrophobicContact CD1-CD2 4.09Å; I858-F918 HydrophobicContact CD1-CE2 3.86Å; I858-F918 HydrophobicContact CD1-CZ 4.23Å; L892-F918 HydrophobicContact CD1-CB 4.21Å; L892-F918 HydrophobicContact CD1-CD1 4.15Å; Y895-F918 AromaticContact CD2-CD1 3.88Å; Y895-F918 HydrophobicContact CD2-CD1 3.88Å; Y895-F918 AromaticContact CD2-CE1 3.6Å; Y895-F918 HydrophobicContact CD2-CE1 3.6Å; Y895-F918 HydrophobicContact CD2-CE2 4.32Å; Y895-F918 HydrophobicContact CD2-CG 4.36Å; Y895-F918 AromaticContact CD2-CZ 3.84Å; Y895-F918 HydrophobicContact CD2-CZ 3.84Å; Y895-F918 HydrophobicContact CE2-CE1 4.11Å; Y895-F918 HydrophobicContact CE2-CE2 4.35Å; Y895-F918 AromaticContact CE2-CZ 3.9Å; Y895-F918 HydrophobicContact CE2-CZ 3.9Å; H916-F918 HydrophobicContact CB-CE2 3.8Å; H916-F918 HydrophobicContact CB-CZ 4.47Å; F918-F920 HydrophobicContact CB-CD2 4.35Å; F918-F920 HydrophobicContact CB-CE2 3.64Å; F918-F920 HydrophobicContact CB-CZ 4.3Å; F918-I924 WeakPolarHBondContact O-CA 3.18Å; F918-I925 HydrophobicContact CB-CB 4.35Å; F918-I925 PolarHBondContact N-O 3.42Å; F918-I925 PolarHBondContact O-N 3.21Å; F918-A927 HydrophobicContact CE2-CB 4.46Å; F918-L940 HydrophobicContact CE1-CD1 4.34Å; F918-L940 HydrophobicContact CZ-CD1 4.21Å; F918-F942 HydrophobicContact CE1-CE1 4.45Å; F918-F942 AromaticContact CE1-CZ 3.97Å; F918-F942 HydrophobicContact CE1-CZ 3.97Å; F918-F942 HydrophobicContact CZ-CZ 4.17Å; F918-L1035 HydrophobicContact CE2-CD1 3.8Å; F918-L1035 HydrophobicContact CZ-CD1 3.63Å
919	V	92.1	Very high	80.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	118.6	174.4	-177.7	0	0	0	0	107.8	V893 C894 L917 L1097 L1101 A1104	V893-V919 HydrophobicContact CB-CG1 4.3Å; V893-V919 PolarHBondContact N-O 3.45Å; C894-V919 PolarHBondContact N-O 3.29Å; C894-V919 VanDerWaalsContact N-O 3.17Å; C894-V919 PolarHBondContact O-N 3.47Å; L917-V919 HydrophobicContact CD2-CG2 4.31Å; L917-V919 HydrophobicContact CG-CG2 4.18Å; V919-L1097 HydrophobicContact CG2-CD1 3.87Å; V919-L1101 HydrophobicContact CB-CD2 4.5Å; V919-L1101 HydrophobicContact CG1-CD2 3.83Å; V919-L1101 HydrophobicContact CG2-CD2 3.77Å; V919-L1101 HydrophobicContact CG2-CG 4.4Å; V919-A1104 HydrophobicContact CG1-CB 4.3Å
920	F	94.3	Very high	82.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	170.5	168.3	-59.9	-98.4	0	0	0	108.9	V851 I854 L885 R890 R891 L892 F918 D922 L923 I925 L1043	V851-F920 HydrophobicContact CB-CE1 4.48Å; V851-F920 HydrophobicContact CG1-CE1 4.03Å; V851-F920 HydrophobicContact CG2-CD1 4.31Å; V851-F920 HydrophobicContact CG2-CE1 4.02Å; I854-F920 HydrophobicContact CD1-CE1 4.29Å; I854-F920 HydrophobicContact CD1-CZ 4.18Å; I854-F920 HydrophobicContact CG2-CZ 4.22Å; L885-F920 HydrophobicContact CD1-CE1 4.49Å; L885-F920 HydrophobicContact CD1-CE2 4.43Å; L885-F920 HydrophobicContact CD1-CZ 4.25Å; L885-F920 HydrophobicContact CD2-CZ 4.18Å; R890-F920 HydrophobicContact CG-CB 3.98Å; R890-F920 HydrophobicContact CG-CD1 3.74Å; R890-F920 HydrophobicContact CG-CG 4.13Å; R891-F920 VanDerWaalsContact O-CA 3.24Å; R891-F920 WeakPolarHBondContact O-CA 3.27Å; R891-F920 WeakPolarHBondContact O-CB 3.44Å; L892-F920 HydrophobicContact CB-CE1 4.45Å; L892-F920 HydrophobicContact CD1-CD1 4.48Å; L892-F920 HydrophobicContact CD1-CE1 4.21Å; L892-F920 HydrophobicContact CD1-CE2 4.47Å; L892-F920 HydrophobicContact CD1-CZ 4.22Å; F918-F920 HydrophobicContact CB-CD2 4.35Å; F918-F920 HydrophobicContact CB-CE2 3.64Å; F918-F920 HydrophobicContact CB-CZ 4.3Å; F920-D922 PolarHBondContact O-N 2.83Å; F920-L923 WeakPolarHBondContact CA-O 3.39Å; F920-L923 HydrophobicContact CB-CD1 4.25Å; F920-L923 HydrophobicContact CB-CG 4.33Å; F920-L923 WeakPolarHBondContact CB-O 3.45Å; F920-L923 HydrophobicContact CD2-CD1 3.55Å; F920-L923 HydrophobicContact CD2-CG 4.49Å; F920-L923 HydrophobicContact CE2-CD1 4.18Å; F920-L923 HydrophobicContact CG-CD1 4.11Å; F920-L923 PolarHBondContact N-O 3.45Å; F920-I925 HydrophobicContact CD2-CG1 4.33Å; F920-I925 HydrophobicContact CE2-CB 4.42Å; F920-I925 HydrophobicContact CE2-CD1 3.71Å; F920-I925 HydrophobicContact CE2-CG1 3.85Å; F920-I925 HydrophobicContact CZ-CD1 4.26Å; F920-L1043 WeakPolarHBondContact O-CD1 3.33Å
921	N	92.9	Very high	82.9	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-70.6	-10.2	-178.3	60.7	-45.9	0	0	0	114.6	N582 H889 R890 R891 V893 E1107 T1108	N582-N921 PolarHBondContact ND2-ND2 2.91Å; N582-N921 VanDerWaalsContact ND2-ND2 3.1Å; H889-N921 PolarHBondContact O-ND2 3.14Å; R890-N921 WeakPolarHBondContact CA-OD1 3.39Å; R891-N921 HydrophobicContact CG-CB 4.18Å; R891-N921 PolarHBondContact N-OD1 3.13Å; R891-N921 PolarHBondContact NH1-ND2 3.03Å; R891-N921 PolarHBondContact O-N 2.99Å; R891-N921 PolarHBondContact O-OD1 3.33Å; V893-N921 HydrophobicContact CG2-CB 3.98Å; N921-E1107 WeakPolarHBondContact CB-OE1 3.15Å; N921-E1107 PolarHBondContact ND2-OE1 3.27Å; N921-T1108 PolarHBondContact O-OG1 3.22Å
922	D	91.7	Very high	83.1	Confident	8 Å²	8	32.1 Å²	32.1	4%	0.043	18%	0.184	C	C	.	.	S	Bend	trans	-131.3	-16.9	-179	71.4	-44.2	0	0	0	114.8	H889 R890 F920 L1043 T1108	H889-D922 IonicContact NE2-OD2 3.55Å; R890-D922 WeakPolarHBondContact CD-OD1 3.3Å; R890-D922 WeakPolarHBondContact CG-OD1 3.33Å; R890-D922 IonicContact CZ-OD1 3.43Å; R890-D922 IonicContact CZ-OD2 3.18Å; R890-D922 VanDerWaalsContact CZ-OD2 3.23Å; R890-D922 VanDerWaalsContact NE-CG 3.3Å; R890-D922 IonicContact NE-OD1 3.44Å; R890-D922 PolarHBondContact NE-OD1 2.88Å; R890-D922 IonicContact NE-OD2 2.9Å; R890-D922 PolarHBondContact NE-OD2 3.13Å; R890-D922 IonicContact NH2-OD2 2.66Å; R890-D922 PolarHBondContact NH2-OD2 3.32Å; F920-D922 PolarHBondContact O-N 2.83Å; D922-L1043 WeakPolarHBondContact O-CB 3.48Å; D922-L1043 PolarHBondContact O-N 2.74Å; D922-T1108 WeakPolarHBondContact CA-OG1 3.15Å
923	L	92	Very high	82.4	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	165.2	-176	67.4	78.3	0	0	0	113.6	F883 L885 F920 I925 V1040 F1041	F883-L923 HydrophobicContact CE2-CD2 4.1Å; F883-L923 HydrophobicContact CZ-CD2 3.87Å; L885-L923 HydrophobicContact CD1-CD1 4.26Å; L885-L923 HydrophobicContact CD1-CD2 4.46Å; F920-L923 WeakPolarHBondContact CA-O 3.39Å; F920-L923 HydrophobicContact CB-CD1 4.25Å; F920-L923 HydrophobicContact CB-CG 4.33Å; F920-L923 WeakPolarHBondContact CB-O 3.45Å; F920-L923 HydrophobicContact CD2-CD1 3.55Å; F920-L923 HydrophobicContact CD2-CG 4.49Å; F920-L923 HydrophobicContact CE2-CD1 4.18Å; F920-L923 HydrophobicContact CG-CD1 4.11Å; F920-L923 PolarHBondContact N-O 3.45Å; L923-I925 HydrophobicContact CD1-CD1 4.11Å; L923-I925 HydrophobicContact CD1-CG1 3.57Å; L923-V1040 HydrophobicContact CD1-CG1 4.35Å; L923-V1040 HydrophobicContact CD2-CG1 4.34Å; L923-F1041 CarbonylContact C-O 3.6Å; L923-F1041 WeakPolarHBondContact CA-O 3.46Å; L923-F1041 VanDerWaalsContact CB-O 3.25Å; L923-F1041 WeakPolarHBondContact CB-O 3.26Å
924	I	91.8	Very high	80.8	Confident	5 Å²	5	47.9 Å²	47.9	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137.7	172.2	-64.1	177.5	0	0	0	109.6	L917 F918 I926 V1040 F1041 L1043 L1062 L1101	L917-I924 HydrophobicContact CD1-CG2 3.38Å; F918-I924 WeakPolarHBondContact O-CA 3.18Å; I924-I926 HydrophobicContact CG2-CD1 4.43Å; I924-I926 HydrophobicContact CG2-CG1 4.06Å; I924-V1040 WeakPolarHBondContact O-CA 3.24Å; I924-F1041 HydrophobicContact CG2-CD2 4.49Å; I924-F1041 PolarHBondContact N-O 3.46Å; I924-F1041 PolarHBondContact O-N 3.49Å; I924-L1043 HydrophobicContact CD1-CD2 3.77Å; I924-L1043 HydrophobicContact CG1-CD2 3.85Å; I924-L1043 HydrophobicContact CG1-CG 4.29Å; I924-L1062 HydrophobicContact CD1-CD2 3.56Å; I924-L1101 HydrophobicContact CD1-CD2 3.61Å; I924-L1101 HydrophobicContact CG1-CD2 4.32Å
925	I	91	Very high	78.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.7	167.7	-52.4	-176.5	0	0	0	109.8	I858 L861 L885 F918 F920 L923 A1037 V1040	I858-I925 HydrophobicContact CD1-CG2 4.22Å; L861-I925 HydrophobicContact CD2-CD1 4.01Å; L861-I925 HydrophobicContact CD2-CG2 4.32Å; L885-I925 HydrophobicContact CD1-CD1 3.63Å; L885-I925 HydrophobicContact CD2-CD1 3.49Å; L885-I925 VanDerWaalsContact CD2-CD1 3.49Å; L885-I925 HydrophobicContact CG-CD1 4.21Å; F918-I925 HydrophobicContact CB-CB 4.35Å; F918-I925 PolarHBondContact N-O 3.42Å; F918-I925 PolarHBondContact O-N 3.21Å; F920-I925 HydrophobicContact CD2-CG1 4.33Å; F920-I925 HydrophobicContact CE2-CB 4.42Å; F920-I925 HydrophobicContact CE2-CD1 3.71Å; F920-I925 HydrophobicContact CE2-CG1 3.85Å; F920-I925 HydrophobicContact CZ-CD1 4.26Å; L923-I925 HydrophobicContact CD1-CD1 4.11Å; L923-I925 HydrophobicContact CD1-CG1 3.57Å; I925-A1037 HydrophobicContact CG2-CB 4.49Å; I925-V1040 HydrophobicContact CG1-CG2 4.28Å; I925-V1040 HydrophobicContact CG2-CG2 4.46Å
926	I	89.6	Confident	76.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.3	173.8	-65.3	-176.1	0	0	0	110.2	R915 H916 L917 I924 L1038 Y1039 F1041 I1084	R915-I926 HydrophobicContact CB-CG2 3.9Å; R915-I926 HydrophobicContact CG-CG2 3.96Å; H916-I926 WeakPolarHBondContact O-CA 3.47Å; L917-I926 HydrophobicContact CD1-CD1 3.78Å; L917-I926 HydrophobicContact CD1-CG1 3.6Å; I924-I926 HydrophobicContact CG2-CD1 4.43Å; I924-I926 HydrophobicContact CG2-CG1 4.06Å; I926-L1038 PolarHBondContact O-N 3.1Å; I926-Y1039 PolarHBondContact N-O 3.08Å; I926-Y1039 PolarHBondContact O-N 3.48Å; I926-F1041 HydrophobicContact CD1-CE2 4.19Å; I926-I1084 HydrophobicContact CD1-CD1 3Å; I926-I1084 HydrophobicContact CG1-CD1 4.48Å
927	A	89.6	Confident	74.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	157.4	-176.8	0	0	0	0	0	112.9	R915 H916 F918 L1035 T1036	R915-A927 WeakPolarHBondContact CD-O 3.46Å; H916-A927 HydrophobicContact CB-CB 4.39Å; H916-A927 PolarHBondContact N-O 3.47Å; H916-A927 PolarHBondContact O-N 3.07Å; F918-A927 HydrophobicContact CE2-CB 4.46Å; A927-L1035 HydrophobicContact CB-CB 4.1Å; A927-L1035 HydrophobicContact CB-CD1 4.4Å; A927-L1035 HydrophobicContact CB-CD2 4.47Å; A927-T1036 CarbonylContact C-O 3.6Å; A927-T1036 WeakPolarHBondContact CA-O 3.16Å; A927-T1036 WeakPolarHBondContact CB-O 3.45Å
928	K	87.4	Confident	71.9	Confident	88 Å²	88	58.7 Å²	58.7	38%	0.383	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	157.6	168.2	61.6	174.1	177.2	-170.2	0	110.4	L1035 T1036 L1038	K928-L1035 WeakPolarHBondContact O-CA 3.45Å; K928-T1036 HydrophobicContact CD-CG2 4.38Å; K928-T1036 VanDerWaalsContact CE-CG2 3.41Å; K928-T1036 HydrophobicContact CG-CG2 4Å; K928-T1036 PolarHBondContact N-O 3.28Å; K928-T1036 PolarHBondContact O-N 2.99Å; K928-L1038 HydrophobicContact CB-CD1 4.22Å; K928-L1038 HydrophobicContact CD-CD1 4.42Å; K928-L1038 HydrophobicContact CD-CD2 3.88Å; K928-L1038 HydrophobicContact CD-CG 4.47Å; K928-L1038 HydrophobicContact CG-CD1 4.26Å; K928-L1038 HydrophobicContact CG-CD2 4.06Å; K928-L1038 HydrophobicContact CG-CG 4.2Å
929	D	80.8	Confident	69.8	Low	78 Å²	78	63.2 Å²	63.2	42%	0.417	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	143.8	164.6	-72.1	-41.7	0	0	0	111.9	H916 T1033	H916-D929 IonicContact NE2-OD1 2.98Å; H916-D929 PolarHBondContact NE2-OD1 2.86Å; H916-D929 IonicContact NE2-OD2 3.56Å; D929-T1033 HydrophobicContact CB-CG2 4.26Å; D929-T1033 WeakPolarHBondContact OD1-CB 3.32Å; D929-T1033 VanDerWaalsContact OD1-CG2 3.32Å; D929-T1033 WeakPolarHBondContact OD1-CG2 3.45Å; D929-T1033 PolarHBondContact OD1-OG1 3.24Å
930	T	69.6	Low	67.7	Low	28 Å²	28	64.4 Å²	64.4	17%	0.172	32%	0.324	C	S	.	.			trans	-90.6	123.5	168.5	58.9	0	0	0	0	110.4	S932 R1034 T1036	T930-S932 PolarHBondContact O-N 3.44Å; T930-R1034 WeakPolarHBondContact CB-O 3.48Å; T930-R1034 WeakPolarHBondContact CG2-O 3.38Å; T930-R1034 PolarHBondContact N-O 3Å; T930-R1034 VanDerWaalsContact OG1-CB 3.27Å; T930-R1034 WeakPolarHBondContact OG1-CB 2.97Å; T930-R1034 PolarHBondContact OG1-O 3.07Å; T930-T1036 WeakPolarHBondContact CG2-OG1 3.49Å
931	S	55.9	Low	65.2	Low	126 Å²	126	65.7 Å²	65.7	88%	0.881	33%	0.332	S	S	*	.			trans	-72.5	24.3	178.1	52.2	0	0	0	0	114.2	K933	S931-K933 PolarHBondContact O-N 2.67Å
932	S	49.1	Very low	63.1	Low	62 Å²	62	68.8 Å²	68.8	43%	0.434	35%	0.345	S	S	.	.			trans	-84.2	107.4	-167.3	-167.9	0	0	0	0	112.2	T930	T930-S932 PolarHBondContact O-N 3.44Å
933	K	41.3	Very low	60.5	Low	188 Å²	188	72.3 Å²	72.3	82%	0.817	37%	0.365	S	S	*	.			trans	-63.2	137	176.6	-63.3	169.8	-178.5	172.2	0	111.2	S931 T935	S931-K933 PolarHBondContact O-N 2.67Å; K933-T935 PolarHBondContact O-N 2.87Å
934	R	41.4	Very low	57.9	Low	257 Å²	257	78.4 Å²	78.4	97%	0.97	39%	0.391	S	S	*	.	S	Bend	trans	67.9	20.3	155	-69.6	-175.6	168.3	172.6	-3.6	121.1
935	T	41.6	Very low	55.1	Low	88 Å²	88	82.1 Å²	82.1	54%	0.54	42%	0.417	S	S	.	.			trans	-117.7	136.4	173.6	56	0	0	0	0	115.4	K933 G937 R1034	K933-T935 PolarHBondContact O-N 2.87Å; T935-G937 PolarHBondContact O-N 3.43Å; T935-R1034 PolarHBondContact OG1-NH1 3.19Å
936	S	40.7	Very low	52.3	Low	119 Å²	119	87.3 Å²	87.3	83%	0.832	44%	0.437	S	S	*	.			trans	-73.2	83.7	-172.2	38.5	0	0	0	0	113.6
937	G	40.4	Very low	49.7	Very low	15 Å²	15	92.8 Å²	92.8	16%	0.155	46%	0.461	C	S	.	.			trans	-91	154.1	171.4	0	0	0	0	0	114.3	T935	T935-G937 PolarHBondContact O-N 3.43Å
938	R	44.7	Very low	46.9	Very low	166 Å²	166	99.6 Å²	99.6	63%	0.626	50%	0.497	S	S	*	.			trans	-55.9	146.2	154.2	-69.9	-177.8	176.4	124.8	-1	109
939	R	46.9	Very low	44.3	Very low	96 Å²	96	101.5 Å²	101.5	36%	0.362	51%	0.507	S	S	.	.			trans	-129.3	147.9	-174.5	-63.1	141.4	167.5	-158.6	-6.7	108.8	D976 Y1032	R939-D976 WeakPolarHBondContact CD-OD2 3.5Å; R939-D976 IonicContact CZ-OD2 3.63Å; R939-D976 IonicContact NE-OD2 3.76Å; R939-D976 IonicContact NH1-OD2 2.72Å; R939-D976 PolarHBondContact NH1-OD2 3Å; R939-Y1032 HydrophobicContact CB-CD1 4.06Å; R939-Y1032 HydrophobicContact CG-CD1 4.08Å; R939-Y1032 HydrophobicContact CG-CG 4.36Å
940	L	49.7	Very low	41.9	Very low	24 Å²	24	105.7 Å²	105.7	13%	0.126	53%	0.529	C	S	.	.			trans	-91.2	140	166.1	-59.9	176	0	0	0	108.8	A857 F918 F942 L973 L1035	A857-L940 HydrophobicContact CB-CD1 3.88Å; A857-L940 HydrophobicContact CB-CD2 3.78Å; A857-L940 HydrophobicContact CB-CG 3.63Å; F918-L940 HydrophobicContact CE1-CD1 4.34Å; F918-L940 HydrophobicContact CZ-CD1 4.21Å; L940-F942 HydrophobicContact CB-CD2 4.46Å; L940-F942 HydrophobicContact CB-CE2 3.81Å; L940-F942 HydrophobicContact CB-CZ 4.15Å; L940-F942 HydrophobicContact CD1-CE2 4.22Å; L940-F942 HydrophobicContact CD1-CZ 3.9Å; L940-L973 HydrophobicContact CD2-CD2 4.45Å; L940-L1035 HydrophobicContact CD1-CD1 4.25Å
941	V	41.9	Very low	40	Very low	28 Å²	28	113.8 Å²	113.8	17%	0.17	56%	0.562	C	S	.	*	B	Isolated β-bridge	trans	-120.3	120.9	170.4	-176.2	0	0	0	0	107.1	Y974 Y1032	V941-Y974 WeakPolarHBondContact CB-O 3.16Å; V941-Y974 PolarHBondContact N-O 2.74Å; V941-Y1032 HydrophobicContact CG2-CE1 4.15Å
942	F	47.2	Very low	38.8	Very low	64 Å²	64	114 Å²	114	28%	0.281	55%	0.551	S	S	.	*			trans	-107.6	128.5	174	-57.2	-88.7	0	0	0	108.6	Y895 F918 L940 L973	Y895-F942 AromaticContact CD1-CD1 3.41Å; Y895-F942 HydrophobicContact CD1-CD1 3.41Å; Y895-F942 VanDerWaalsContact CD1-CD1 3.41Å; Y895-F942 AromaticContact CD1-CE1 3.38Å; Y895-F942 HydrophobicContact CD1-CE1 3.38Å; Y895-F942 HydrophobicContact CD1-CG 4.02Å; Y895-F942 AromaticContact CD1-CZ 4Å; Y895-F942 HydrophobicContact CD1-CZ 4Å; Y895-F942 HydrophobicContact CD2-CD1 4.49Å; Y895-F942 AromaticContact CD2-CE1 3.64Å; Y895-F942 HydrophobicContact CD2-CE1 3.64Å; Y895-F942 HydrophobicContact CD2-CE2 4.47Å; Y895-F942 AromaticContact CD2-CZ 3.63Å; Y895-F942 HydrophobicContact CD2-CZ 3.63Å; Y895-F942 HydrophobicContact CE1-CB 4.27Å; Y895-F942 AromaticContact CE1-CD1 3.5Å; Y895-F942 HydrophobicContact CE1-CD1 3.5Å; Y895-F942 AromaticContact CE1-CD2 3.83Å; Y895-F942 HydrophobicContact CE1-CD2 3.83Å; Y895-F942 AromaticContact CE1-CE1 3.6Å; Y895-F942 HydrophobicContact CE1-CE1 3.6Å; Y895-F942 AromaticContact CE1-CE2 3.93Å; Y895-F942 HydrophobicContact CE1-CE2 3.93Å; Y895-F942 AromaticContact CE1-CG 3.61Å; Y895-F942 HydrophobicContact CE1-CG 3.61Å; Y895-F942 AromaticContact CE1-CZ 3.81Å; Y895-F942 HydrophobicContact CE1-CZ 3.81Å; Y895-F942 AromaticContact CE2-CE1 3.82Å; Y895-F942 HydrophobicContact CE2-CE1 3.82Å; Y895-F942 AromaticContact CE2-CE2 3.82Å; Y895-F942 HydrophobicContact CE2-CE2 3.82Å; Y895-F942 AromaticContact CE2-CZ 3.41Å; Y895-F942 HydrophobicContact CE2-CZ 3.41Å; Y895-F942 VanDerWaalsContact CE2-CZ 3.41Å; Y895-F942 AromaticContact CG-CD1 3.94Å; Y895-F942 HydrophobicContact CG-CD1 3.94Å; Y895-F942 AromaticContact CG-CE1 3.4Å; Y895-F942 HydrophobicContact CG-CE1 3.4Å; Y895-F942 VanDerWaalsContact CG-CE1 3.4Å; Y895-F942 AromaticContact CG-CZ 3.91Å; Y895-F942 HydrophobicContact CG-CZ 3.91Å; Y895-F942 AromaticContact CZ-CD2 3.81Å; Y895-F942 AromaticContact CZ-CE1 3.8Å; Y895-F942 AromaticContact CZ-CE2 3.52Å; Y895-F942 AromaticContact CZ-CZ 3.51Å; F918-F942 HydrophobicContact CE1-CE1 4.45Å; F918-F942 AromaticContact CE1-CZ 3.97Å; F918-F942 HydrophobicContact CE1-CZ 3.97Å; F918-F942 HydrophobicContact CZ-CZ 4.17Å; L940-F942 HydrophobicContact CB-CD2 4.46Å; L940-F942 HydrophobicContact CB-CE2 3.81Å; L940-F942 HydrophobicContact CB-CZ 4.15Å; L940-F942 HydrophobicContact CD1-CE2 4.22Å; L940-F942 HydrophobicContact CD1-CZ 3.9Å; F942-L973 HydrophobicContact CD1-CD2 3.8Å; F942-L973 HydrophobicContact CE1-CD2 3.47Å; F942-L973 VanDerWaalsContact CE1-CD2 3.47Å; F942-L973 HydrophobicContact CZ-CD2 4.11Å
943	D	38.4	Very low	37.9	Very low	83 Å²	83	116.9 Å²	116.9	44%	0.444	56%	0.562	S	S	.	*			trans	-107.4	124.5	176.5	-173.7	-10.7	0	0	0	109.4	S945 L972	D943-S945 WeakPolarHBondContact OD1-CB 3.39Å; D943-S945 PolarHBondContact OD1-N 3.35Å; D943-S945 PolarHBondContact OD1-OG 3.18Å; D943-S945 PolarHBondContact OD2-OG 3.12Å; D943-L972 HydrophobicContact CB-CD2 4.12Å; D943-L972 VanDerWaalsContact O-CD2 3.29Å; D943-L972 WeakPolarHBondContact O-CD2 3.15Å
944	K	37.8	Very low	37.3	Very low	130 Å²	130	115.7 Å²	115.7	57%	0.565	57%	0.565	S	S	*	*			trans	-93.3	-0.5	177.8	-74.3	-158.4	174.5	-161.3	0	113.2	R946 D1093	K944-R946 PolarHBondContact O-N 3.04Å; K944-D1093 IonicContact NZ-OD2 3.5Å; K944-D1093 PolarHBondContact NZ-OD2 2.84Å
945	S	33.1	Very low	36.9	Very low	83 Å²	83	111.2 Å²	111.2	58%	0.58	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-68.5	-23.6	-165.5	62.8	0	0	0	0	116.6	D943 K947	D943-S945 WeakPolarHBondContact OD1-CB 3.39Å; D943-S945 PolarHBondContact OD1-N 3.35Å; D943-S945 PolarHBondContact OD1-OG 3.18Å; D943-S945 PolarHBondContact OD2-OG 3.12Å; S945-K947 PolarHBondContact O-N 3.19Å
946	R	31.3	Very low	36.3	Very low	110 Å²	110	117.2 Å²	117.2	42%	0.415	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-88.1	5.2	-170.9	-81.1	-161.7	-176.9	163.5	5.4	117.4	K944 N948 Q949 D971	K944-R946 PolarHBondContact O-N 3.04Å; R946-N948 PolarHBondContact O-N 3.43Å; R946-Q949 PolarHBondContact O-N 3.26Å; R946-D971 IonicContact CZ-OD2 3.1Å; R946-D971 IonicContact NH1-OD2 3.82Å; R946-D971 PolarHBondContact NH1-OD2 2.86Å; R946-D971 IonicContact NH2-OD2 2.74Å; R946-D971 PolarHBondContact NH2-OD2 3Å
947	K	34.2	Very low	35.8	Very low	116 Å²	116	116 Å²	116	50%	0.504	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-56.1	-14.6	179.8	-77.8	-167.9	176.6	-175.2	0	115.3	S945 N1092 D1093	S945-K947 PolarHBondContact O-N 3.19Å; K947-N1092 PolarHBondContact NZ-ND2 3.29Å; K947-D1093 IonicContact NZ-OD1 2.62Å; K947-D1093 PolarHBondContact NZ-OD1 3.12Å
948	N	31.3	Very low	35.2	Very low	143 Å²	143	119 Å²	119	77%	0.765	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-97.4	-7	-173.9	-70.9	-9.4	0	0	0	116.5	R946	R946-N948 PolarHBondContact O-N 3.43Å
949	Q	33.3	Very low	34.4	Very low	128 Å²	128	115.9 Å²	115.9	60%	0.598	57%	0.574	S	S	*	*	S	Bend	trans	-85.5	-11.3	-171.4	-74.5	-174.8	-37.6	0	0	115.7	R946 K951	R946-Q949 PolarHBondContact O-N 3.26Å; Q949-K951 VanDerWaalsContact C-N 3.3Å; Q949-K951 PolarHBondContact O-N 3.5Å
950	L	30.7	Very low	33.7	Very low	165 Å²	165	114.5 Å²	114.5	86%	0.864	59%	0.59	S	S	*	*			trans	-86.2	23.3	-175	-78.4	163.5	0	0	0	115.2
951	K	30	Very low	33	Very low	199 Å²	199	118.9 Å²	118.9	87%	0.865	61%	0.61	S	S	*	*			trans	-99.6	22.8	177.1	-75.7	-167.3	172.9	-174.3	0	114.1	Q949	Q949-K951 VanDerWaalsContact C-N 3.3Å; Q949-K951 PolarHBondContact O-N 3.5Å
952	I	30.5	Very low	32.7	Very low	130 Å²	130	122 Å²	122	67%	0.667	62%	0.619	S	S	*	*			trans	-109.9	112.4	-168.5	-62.1	179.6	0	0	0	111.4
953	N	28.9	Very low	32.1	Very low	122 Å²	122	122.2 Å²	122.2	65%	0.652	62%	0.623	S	S	*	*			trans	70.8	93.4	162.4	-59	-22.4	0	0	0	118.9	K955	N953-K955 PolarHBondContact O-N 3.38Å
954	D	30	Very low	31.8	Very low	164 Å²	164	125 Å²	125	88%	0.877	64%	0.638	S	S	*	*			trans	-65.1	65.2	156.7	-79.2	-37	0	0	0	111.5
955	K	33.4	Very low	31.6	Very low	162 Å²	162	124.6 Å²	124.6	70%	0.704	64%	0.637	S	S	*	*			trans	-105.7	133.7	168.9	-72.1	-167.6	-179.5	-171.4	0	109.9	N953 L957	N953-K955 PolarHBondContact O-N 3.38Å; K955-L957 WeakPolarHBondContact O-CD1 3.43Å; K955-L957 PolarHBondContact O-N 3.48Å
956	K	27.6	Very low	31.7	Very low	215 Å²	215	122.9 Å²	122.9	94%	0.935	62%	0.621	S	S	*	*			trans	-60.8	101	178.6	-69.7	-178.3	176.8	-179.4	0	110.6
957	L	30.5	Very low	31.9	Very low	92 Å²	92	123.2 Å²	123.2	48%	0.482	62%	0.622	S	S	.	*			trans	-67.2	145.1	167.8	-97.3	63.9	0	0	0	110.1	K955 Q961 F965	K955-L957 WeakPolarHBondContact O-CD1 3.43Å; K955-L957 PolarHBondContact O-N 3.48Å; L957-Q961 HydrophobicContact CD2-CB 4.05Å; L957-Q961 HydrophobicContact CG-CB 4.42Å; L957-F965 HydrophobicContact CD2-CE2 4.25Å
958	S	28.3	Very low	31.7	Very low	78 Å²	78	120.6 Å²	120.6	55%	0.545	62%	0.617	S	S	.	*			trans	-79.7	158.3	177.7	-66.8	0	0	0	0	111.4	G960 Q961	S958-G960 PolarHBondContact O-N 3.1Å; S958-Q961 PolarHBondContact O-N 2.87Å
959	P	28.2	Very low	31.7	Very low	101 Å²	101	117.3 Å²	117.3	66%	0.656	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	8.2	-166.9	-24.3	35.8	0	0	0	118.1	Y962	P959-Y962 HydrophobicContact CB-CE2 4.44Å; P959-Y962 WeakPolarHBondContact O-CD2 3.23Å; P959-Y962 VanDerWaalsContact O-CE2 3.25Å; P959-Y962 WeakPolarHBondContact O-CE2 3.31Å
960	G	32.5	Very low	32	Very low	67 Å²	67	114.3 Å²	114.3	69%	0.691	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	14	-178.5	0	0	0	0	0	115.4	S958	S958-G960 PolarHBondContact O-N 3.1Å
961	Q	33.3	Very low	32.2	Very low	117 Å²	117	109.9 Å²	109.9	55%	0.547	57%	0.568	S	S	.	*			trans	-115.9	36.5	-179.4	-66.9	-176.5	-56.9	0	0	112.9	L957 S958	L957-Q961 HydrophobicContact CD2-CB 4.05Å; L957-Q961 HydrophobicContact CG-CB 4.42Å; S958-Q961 PolarHBondContact O-N 2.87Å
962	Y	36.4	Very low	32.7	Very low	92 Å²	92	102.7 Å²	102.7	36%	0.361	54%	0.539	S	S	.	.			trans	-84.4	-7	-171.6	-73.9	-64.6	0	0	0	115.7	F570 P959 D964 F965	F570-Y962 HydrophobicContact CD2-CE1 4.22Å; F570-Y962 AromaticContact CE2-CD1 3.75Å; F570-Y962 HydrophobicContact CE2-CD1 3.75Å; F570-Y962 AromaticContact CE2-CE1 3.59Å; F570-Y962 HydrophobicContact CE2-CE1 3.59Å; F570-Y962 HydrophobicContact CZ-CD1 4.44Å; F570-Y962 HydrophobicContact CZ-CE1 4.48Å; P959-Y962 HydrophobicContact CB-CE2 4.44Å; P959-Y962 WeakPolarHBondContact O-CD2 3.23Å; P959-Y962 VanDerWaalsContact O-CE2 3.25Å; P959-Y962 WeakPolarHBondContact O-CE2 3.31Å; Y962-D964 VanDerWaalsContact C-N 3.31Å; Y962-D964 PolarHBondContact O-N 3.05Å; Y962-F965 PolarHBondContact O-N 3.42Å
963	D	34.1	Very low	32.8	Very low	69 Å²	69	97.7 Å²	97.7	37%	0.369	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-60.6	-31.3	-169.4	-66.8	-38.3	0	0	0	114.3	N615 F965	N615-D963 PolarHBondContact ND2-OD2 3.16Å; D963-F965 VanDerWaalsContact C-N 3.32Å; D963-F965 PolarHBondContact O-N 3.3Å
964	D	32.1	Very low	33.2	Very low	143 Å²	143	95.4 Å²	95.4	77%	0.765	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-73.3	-15.5	-177.5	-78.4	-41.1	0	0	0	114.6	Y962 L966	Y962-D964 VanDerWaalsContact C-N 3.31Å; Y962-D964 PolarHBondContact O-N 3.05Å; D964-L966 PolarHBondContact O-N 3.49Å
965	F	33.6	Very low	33.5	Very low	120 Å²	120	88.7 Å²	88.7	53%	0.526	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-90	7.5	-171.8	-71.8	-80.3	0	0	0	115.6	K574 L957 Y962 D963	K574-F965 PolarHBondContact NZ-O 2.94Å; L957-F965 HydrophobicContact CD2-CE2 4.25Å; Y962-F965 PolarHBondContact O-N 3.42Å; D963-F965 VanDerWaalsContact C-N 3.32Å; D963-F965 PolarHBondContact O-N 3.3Å
966	L	36	Very low	33.4	Very low	47 Å²	47	83.3 Å²	83.3	25%	0.246	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-98	-11.3	177.8	-81.6	160.4	0	0	0	114.2	K574 Y577 D964	K574-L966 HydrophobicContact CG-CD2 4.22Å; Y577-L966 HydrophobicContact CD1-CD1 3.89Å; Y577-L966 HydrophobicContact CE1-CD1 3.99Å; D964-L966 PolarHBondContact O-N 3.49Å
967	R	35.2	Very low	33.7	Very low	118 Å²	118	77.1 Å²	77.1	45%	0.445	42%	0.423	S	S	.	.			trans	-104.1	121.9	-171.1	-72	-176.6	156.7	-158.8	-8.6	113.7	A617 D618 L970	A617-R967 VanDerWaalsContact CB-NH2 3.3Å; A617-R967 PolarHBondContact O-NH2 2.81Å; D618-R967 IonicContact OD1-CZ 3.24Å; D618-R967 IonicContact OD1-NE 3.46Å; D618-R967 PolarHBondContact OD1-NE 3.07Å; D618-R967 IonicContact OD1-NH2 2.75Å; D618-R967 PolarHBondContact OD1-NH2 2.93Å; R967-L970 HydrophobicContact CB-CD1 4.25Å; R967-L970 HydrophobicContact CG-CD1 3.86Å
968	P	30.7	Very low	34.2	Very low	60 Å²	60	74.1 Å²	74.1	39%	0.39	41%	0.408	S	S	.	.			trans	-56.3	157	147.7	-15	29.2	0	0	0	109.2	V893 L970	V893-P968 WeakPolarHBondContact O-CG 3.48Å; P968-L970 WeakPolarHBondContact O-CG 3.43Å; P968-L970 PolarHBondContact O-N 3.17Å
969	P	29.9	Very low	34.5	Very low	75 Å²	75	74.3 Å²	74.3	49%	0.487	40%	0.399	S	S	.	.			trans	-62.1	103.1	176.6	-23.8	34.9	0	0	0	111.5	D971 L972	P969-D971 VanDerWaalsContact C-N 3.27Å; P969-D971 PolarHBondContact O-N 2.89Å; P969-L972 HydrophobicContact CB-CD1 4.02Å; P969-L972 HydrophobicContact CB-CG 4.13Å; P969-L972 VanDerWaalsContact O-CG 3.23Å; P969-L972 WeakPolarHBondContact O-CG 3.41Å
970	L	40.8	Very low	34.8	Very low	64 Å²	64	78.6 Å²	78.6	34%	0.335	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-80.7	-7.3	-176.6	-70.5	156.2	0	0	0	113.2	I850 R967 P968 L972	I850-L970 HydrophobicContact CD1-CB 4.24Å; I850-L970 HydrophobicContact CD1-CD2 3.51Å; I850-L970 HydrophobicContact CD1-CG 4.42Å; R967-L970 HydrophobicContact CB-CD1 4.25Å; R967-L970 HydrophobicContact CG-CD1 3.86Å; P968-L970 WeakPolarHBondContact O-CG 3.43Å; P968-L970 PolarHBondContact O-N 3.17Å; L970-L972 PolarHBondContact O-N 2.67Å
971	D	34.9	Very low	34.9	Very low	72 Å²	72	81.5 Å²	81.5	39%	0.385	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-63.1	2.2	170.2	-86.6	17.2	0	0	0	114.2	R946 P969 Y974	R946-D971 IonicContact CZ-OD2 3.1Å; R946-D971 IonicContact NH1-OD2 3.82Å; R946-D971 PolarHBondContact NH1-OD2 2.86Å; R946-D971 IonicContact NH2-OD2 2.74Å; R946-D971 PolarHBondContact NH2-OD2 3Å; P969-D971 VanDerWaalsContact C-N 3.27Å; P969-D971 PolarHBondContact O-N 2.89Å; D971-Y974 WeakPolarHBondContact O-CE2 3.29Å
972	L	39.8	Very low	34.8	Very low	48 Å²	48	82.5 Å²	82.5	25%	0.251	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-103.3	10.1	-167.8	-56.6	-173	0	0	0	114.8	D943 P969 L970	D943-L972 HydrophobicContact CB-CD2 4.12Å; D943-L972 VanDerWaalsContact O-CD2 3.29Å; D943-L972 WeakPolarHBondContact O-CD2 3.15Å; P969-L972 HydrophobicContact CB-CD1 4.02Å; P969-L972 HydrophobicContact CB-CG 4.13Å; P969-L972 VanDerWaalsContact O-CG 3.23Å; P969-L972 WeakPolarHBondContact O-CG 3.41Å; L970-L972 PolarHBondContact O-N 2.67Å
973	L	33.8	Very low	34.6	Very low	25 Å²	25	85.3 Å²	85.3	13%	0.131	42%	0.423	C	S	.	.			trans	-129.6	80.3	179.3	-78.8	176.2	0	0	0	112.3	I850 I854 L892 L940 F942	I850-L973 HydrophobicContact CG2-CD1 3.55Å; I854-L973 HydrophobicContact CD1-CD1 4.24Å; I854-L973 HydrophobicContact CG1-CD1 4.48Å; L892-L973 HydrophobicContact CD2-CD1 3.96Å; L940-L973 HydrophobicContact CD2-CD2 4.45Å; F942-L973 HydrophobicContact CD1-CD2 3.8Å; F942-L973 HydrophobicContact CE1-CD2 3.47Å; F942-L973 VanDerWaalsContact CE1-CD2 3.47Å; F942-L973 HydrophobicContact CZ-CD2 4.11Å
974	Y	37.3	Very low	34.3	Very low	74 Å²	74	90 Å²	90	29%	0.29	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-102.4	146.3	170	-64.7	-64.6	0	0	0	111.5	V941 D971 D978 K982	V941-Y974 WeakPolarHBondContact CB-O 3.16Å; V941-Y974 PolarHBondContact N-O 2.74Å; D971-Y974 WeakPolarHBondContact O-CE2 3.29Å; Y974-D978 HydrophobicContact CD1-CB 3.59Å; Y974-D978 HydrophobicContact CE1-CB 4.43Å; Y974-D978 HydrophobicContact CG-CB 4.24Å; Y974-K982 PolarHBondContact OH-NZ 3.14Å
975	T	34.7	Very low	34.2	Very low	23 Å²	23	91.1 Å²	91.1	14%	0.141	45%	0.451	C	S	.	.			trans	-85.8	167.2	159.1	73.1	0	0	0	0	109.7	C977 D978	T975-C977 PolarHBondContact O-N 2.93Å; T975-C977 VanDerWaalsContact O-N 3.12Å; T975-C977 WeakPolarHBondContact OG1-CB 3.31Å; T975-C977 PolarHBondContact OG1-N 3.36Å; T975-D978 WeakPolarHBondContact CA-OD2 3.24Å; T975-D978 WeakPolarHBondContact CB-OD2 3.25Å; T975-D978 PolarHBondContact N-OD2 3.29Å; T975-D978 PolarHBondContact O-N 2.93Å; T975-D978 VanDerWaalsContact O-N 3.14Å; T975-D978 PolarHBondContact OG1-OD2 3.12Å
976	D	31.9	Very low	34	Very low	49 Å²	49	92.7 Å²	92.7	26%	0.262	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.3	174.8	-80.7	-28.1	0	0	0	114.1	R939 K979 Y1032	R939-D976 WeakPolarHBondContact CD-OD2 3.5Å; R939-D976 IonicContact CZ-OD2 3.63Å; R939-D976 IonicContact NE-OD2 3.76Å; R939-D976 IonicContact NH1-OD2 2.72Å; R939-D976 PolarHBondContact NH1-OD2 3Å; D976-K979 IonicContact OD1-NZ 3.19Å; D976-K979 PolarHBondContact OD1-NZ 2.82Å; D976-Y1032 WeakPolarHBondContact OD1-CE1 3.43Å; D976-Y1032 PolarHBondContact OD1-OH 3.21Å; D976-Y1032 WeakPolarHBondContact OD2-CE1 3.49Å
977	C	34.9	Very low	33.5	Very low	85 Å²	85	94 Å²	94	57%	0.574	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-35	173.1	-61.8	0	0	0	0	111.9	T975	T975-C977 PolarHBondContact O-N 2.93Å; T975-C977 VanDerWaalsContact O-N 3.12Å; T975-C977 WeakPolarHBondContact OG1-CB 3.31Å; T975-C977 PolarHBondContact OG1-N 3.36Å
978	D	39.3	Very low	33.3	Very low	30 Å²	30	93.9 Å²	93.9	16%	0.16	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-82	-24.5	-165.4	-48.5	-57	0	0	0	112.6	Y974 T975 K980 F981	Y974-D978 HydrophobicContact CD1-CB 3.59Å; Y974-D978 HydrophobicContact CE1-CB 4.43Å; Y974-D978 HydrophobicContact CG-CB 4.24Å; T975-D978 WeakPolarHBondContact CA-OD2 3.24Å; T975-D978 WeakPolarHBondContact CB-OD2 3.25Å; T975-D978 PolarHBondContact N-OD2 3.29Å; T975-D978 PolarHBondContact O-N 2.93Å; T975-D978 VanDerWaalsContact O-N 3.14Å; T975-D978 PolarHBondContact OG1-OD2 3.12Å; D978-K980 PolarHBondContact O-N 3.24Å; D978-K980 VanDerWaalsContact O-N 3.12Å; D978-F981 PolarHBondContact O-N 3.3Å
979	K	36.3	Very low	33	Very low	82 Å²	82	99.1 Å²	99.1	36%	0.357	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-59.1	-25.5	-178.4	-70.6	174.4	-179.5	160.4	0	114.1	D976 F981 Y1032	D976-K979 IonicContact OD1-NZ 3.19Å; D976-K979 PolarHBondContact OD1-NZ 2.82Å; K979-F981 PolarHBondContact O-N 2.96Å; K979-Y1032 PolarHBondContact NZ-OH 3.26Å; K979-Y1032 VanDerWaalsContact NZ-OH 3.09Å
980	K	34.4	Very low	32.9	Very low	190 Å²	190	100.8 Å²	100.8	83%	0.826	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-75.2	-17.8	-177.8	-80.8	-166.8	171.5	-170	0	114.7	D978	D978-K980 PolarHBondContact O-N 3.24Å; D978-K980 VanDerWaalsContact O-N 3.12Å
981	F	33	Very low	32.1	Very low	129 Å²	129	106.7 Å²	106.7	57%	0.566	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-84.4	-7.6	-177.5	-86	-86.7	0	0	0	114.5	D978 K979 I983 G999	D978-F981 PolarHBondContact O-N 3.3Å; K979-F981 PolarHBondContact O-N 2.96Å; F981-I983 VanDerWaalsContact C-N 3.32Å; F981-I983 PolarHBondContact O-N 3.01Å; F981-G999 WeakPolarHBondContact CE2-O 3.21Å
982	K	31.8	Very low	31.6	Very low	137 Å²	137	107.4 Å²	107.4	60%	0.596	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	16.2	-163.3	-146.2	164.5	-173.2	162.9	0	116	Y974	Y974-K982 PolarHBondContact OH-NZ 3.14Å
983	I	32.7	Very low	30.9	Very low	152 Å²	152	110.6 Å²	110.6	78%	0.779	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	-12.3	-170.2	-63.1	179	0	0	0	113.4	F981	F981-I983 VanDerWaalsContact C-N 3.32Å; F981-I983 PolarHBondContact O-N 3.01Å
984	M	28.1	Very low	30.4	Very low	167 Å²	167	117 Å²	117	82%	0.823	65%	0.646	S	S	*	*	S	Bend	trans	-128.9	87.1	-177.3	-64.1	-179.9	74.9	0	0	112.1
985	N	29.8	Very low	29.9	Very low	167 Å²	167	116.7 Å²	116.7	89%	0.893	65%	0.647	S	S	*	*			trans	172.4	96.7	143	-91.8	-11.5	0	0	0	110.7
986	T	28.1	Very low	29.5	Very low	153 Å²	153	120.3 Å²	120.3	94%	0.939	67%	0.67	S	S	*	*			trans	-122.3	97.5	169	49.8	0	0	0	0	109.1
987	G	27	Very low	29.2	Very low	75 Å²	75	122.6 Å²	122.6	77%	0.773	69%	0.686	S	S	*	*			trans	151.5	88.6	172.2	0	0	0	0	0	116
988	S	29.5	Very low	28.9	Very low	115 Å²	115	123 Å²	123	80%	0.804	69%	0.686	S	S	*	*			trans	178.2	137.8	142.8	30.9	0	0	0	0	110
989	N	26	Very low	28.1	Very low	170 Å²	170	123.6 Å²	123.6	91%	0.909	70%	0.699	S	S	*	*			trans	-105.4	95.7	-175	-73.6	-20.5	0	0	0	111.7
990	T	26.7	Very low	27.7	Very low	109 Å²	109	125.2 Å²	125.2	67%	0.669	72%	0.719	S	S	*	*			trans	-144.1	135	162.1	40.4	0	0	0	0	110.3	S992	T990-S992 PolarHBondContact O-N 3.33Å
991	L	24.1	Very low	27.3	Very low	188 Å²	188	123 Å²	123	98%	0.984	72%	0.721	S	S	*	*			trans	-82.8	96.9	176.5	-79.9	78.2	0	0	0	110.1
992	S	24.9	Very low	27	Very low	88 Å²	88	122.8 Å²	122.8	62%	0.615	73%	0.733	S	S	*	*	S	Bend	trans	-149.4	146.9	162.7	60.3	0	0	0	0	109.5	T990 I994	T990-S992 PolarHBondContact O-N 3.33Å; S992-I994 PolarHBondContact O-N 3.32Å
993	C	24.3	Very low	26.9	Very low	114 Å²	114	125.1 Å²	125.1	77%	0.77	75%	0.746	S	S	*	*			trans	-52.6	103.3	-164.7	-56.3	0	0	0	0	114.4	Q995	C993-Q995 PolarHBondContact O-N 2.96Å
994	I	24	Very low	26.7	Very low	161 Å²	161	129.3 Å²	129.3	83%	0.826	75%	0.752	S	S	*	*			trans	-71.2	109.4	-179.9	-60.2	174.1	0	0	0	109.9	S992	S992-I994 PolarHBondContact O-N 3.32Å
995	Q	26.3	Very low	26.8	Very low	67 Å²	67	128.1 Å²	128.1	31%	0.313	75%	0.754	S	S	.	*	P	Polyproline II helix	trans	-97.5	125.7	169.9	-68.9	-173.2	-7.7	0	0	110.4	H665 C993 T997	H665-Q995 PolarHBondContact NE2-OE1 3.15Å; C993-Q995 PolarHBondContact O-N 2.96Å; Q995-T997 PolarHBondContact O-N 3.31Å
996	P	26.5	Very low	26.8	Very low	98 Å²	98	123.9 Å²	123.9	64%	0.636	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-76.2	117.7	173.1	29.8	-32.4	0	0	0	111
997	T	24.7	Very low	26.8	Very low	98 Å²	98	120.8 Å²	120.8	60%	0.601	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-84.1	145.3	171.6	49	0	0	0	0	111.5	Q995	Q995-T997 PolarHBondContact O-N 3.31Å
998	V	28.6	Very low	26.9	Very low	94 Å²	94	120.9 Å²	120.9	57%	0.57	75%	0.749	S	S	*	*			trans	-129.9	144	-177	-175.8	0	0	0	0	110.6
999	G	24.2	Very low	26.9	Very low	42 Å²	42	127.9 Å²	127.9	43%	0.433	76%	0.758	S	S	.	*			trans	-135.3	159.2	173.3	0	0	0	0	0	111.8	F981	F981-G999 WeakPolarHBondContact CE2-O 3.21Å
1000	C	26.4	Very low	27.2	Very low	116 Å²	116	123.6 Å²	123.6	78%	0.784	75%	0.754	S	S	*	*			trans	-122.4	144.8	-169.1	-76	0	0	0	0	114.4
1001	V	26.8	Very low	27.3	Very low	142 Å²	142	130.1 Å²	130.1	86%	0.861	77%	0.766	S	S	*	*			trans	-139.8	132.7	166.4	-176.2	0	0	0	0	109.2
1002	P	27.1	Very low	27.7	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	77%	0.765	S	S	*	*			trans	-88.3	165.4	178.9	35.9	-35.6	0	0	0	113
1003	H	28.8	Very low	27.9	Very low	187 Å²	187	134 Å²	134	87%	0.866	77%	0.769	S	S	*	*			trans	-126.7	135.1	174.4	-151.2	-67.9	0	0	0	111.7
1004	R	29	Very low	28.1	Very low	239 Å²	239	140.3 Å²	140.3	90%	0.902	78%	0.777	S	S	*	*			trans	-75.2	163.2	177	-70.1	-173.6	179	-174.8	1.7	112.2
1005	V	29.5	Very low	28.6	Very low	143 Å²	143	138.4 Å²	138.4	87%	0.867	78%	0.778	S	S	*	*			trans	-110.5	134.6	178.5	176.8	0	0	0	0	110.7
1006	G	30.6	Very low	28.7	Very low	78 Å²	78	144.3 Å²	144.3	80%	0.804	80%	0.802	S	S	*	*			trans	-176.8	157.6	169.5	0	0	0	0	0	109.2
1007	G	27.6	Very low	28.7	Very low	88 Å²	88	147.2 Å²	147.2	91%	0.907	81%	0.813	S	S	*	*			cis	146.7	59.6	0.3	0	0	0	0	0	112.3
1008	G	29.9	Very low	28.9	Very low	77 Å²	77	151.9 Å²	151.9	79%	0.794	83%	0.828	S	S	*	*			trans	-163.4	156.1	-175.9	0	0	0	0	0	113.6
1009	R	29.1	Very low	28.8	Very low	262 Å²	262	154.9 Å²	154.9	99%	0.989	84%	0.84	S	S	*	*			trans	-112.9	137.2	-178.6	-61.7	179.4	-178.6	-176.9	1.3	110.6
1010	G	32	Very low	28.8	Very low	80 Å²	80	163.5 Å²	163.5	83%	0.825	86%	0.86	S	S	*	*			trans	-157.7	118.1	169.7	0	0	0	0	0	111.5
1011	R	29.1	Very low	28.8	Very low	246 Å²	246	163.1 Å²	163.1	93%	0.928	86%	0.859	S	S	*	*			trans	-103.3	130.6	172.2	-76.2	-177.6	174.2	-177.6	-0.9	109.6
1012	R	31.9	Very low	28.7	Very low	257 Å²	257	167.9 Å²	167.9	97%	0.97	86%	0.862	S	S	*	*			trans	-162.3	171.5	140.1	-105.6	160.6	-166.6	-166.1	3.1	109.3
1013	S	29.5	Very low	28.7	Very low	99 Å²	99	171.1 Å²	171.1	69%	0.692	86%	0.863	S	S	*	*			trans	-150.3	150.3	-142.6	57.2	0	0	0	0	115.3
1014	R	29.2	Very low	28.6	Very low	248 Å²	248	166.9 Å²	166.9	94%	0.936	86%	0.86	S	S	*	*			trans	66.8	140.8	170.4	-61.5	172.5	172.9	173.2	-4.5	112.3
1015	S	33.6	Very low	28.5	Very low	120 Å²	120	159.3 Å²	159.3	84%	0.839	85%	0.849	S	S	*	*			cis	-124.3	178.1	38.9	54.3	0	0	0	0	115.2
1016	K	28.4	Very low	28.4	Very low	191 Å²	191	159.9 Å²	159.9	83%	0.83	85%	0.847	S	S	*	*			trans	-115.1	136.4	161.5	-69.3	178.1	175.4	-179	0	107.3
1017	N	27.8	Very low	28.1	Very low	160 Å²	160	159.3 Å²	159.3	86%	0.856	83%	0.831	S	S	*	*			trans	159.3	73.9	139.1	-83.1	1	0	0	0	110.7
1018	E	28.7	Very low	28.2	Very low	196 Å²	196	161.4 Å²	161.4	92%	0.916	83%	0.826	S	S	*	*			trans	-151.5	98.7	158	-118.8	177.4	-150	0	0	106.9
1019	L	26.2	Very low	28	Very low	157 Å²	157	161.5 Å²	161.5	82%	0.822	82%	0.815	S	S	*	*			trans	-150.4	145.1	-172.8	-106.9	160.8	0	0	0	108.6
1020	Y	24.4	Very low	28.2	Very low	222 Å²	222	157.1 Å²	157.1	87%	0.871	81%	0.805	S	S	*	*	S	Bend	trans	76.9	144.3	-165.5	-62.5	-82.8	0	0	0	115.9
1021	S	25	Very low	28.2	Very low	108 Å²	108	157.8 Å²	157.8	76%	0.755	80%	0.797	S	S	*	*	S	Bend	trans	69.2	153.3	-168.8	-151.1	0	0	0	0	116.9	K1023	S1021-K1023 PolarHBondContact O-N 3.01Å
1022	R	26.3	Very low	28.8	Very low	242 Å²	242	150.1 Å²	150.1	91%	0.913	77%	0.769	S	S	*	*	S	Bend	trans	60.7	17.9	172	-58.1	-172.4	178.3	179.7	0.2	120.6
1023	K	26.8	Very low	29.6	Very low	194 Å²	194	140.7 Å²	140.7	84%	0.843	74%	0.74	S	S	*	*			trans	-121.4	15.4	175	-125.7	168.9	-170.1	165.8	0	116.8	S1021 S1027	S1021-K1023 PolarHBondContact O-N 3.01Å; K1023-S1027 PolarHBondContact O-OG 3.39Å
1024	A	26.8	Very low	31.3	Very low	98 Å²	98	139.6 Å²	139.6	81%	0.81	72%	0.72	S	S	*	*	S	Bend	trans	-104.4	0.2	-173.7	0	0	0	0	0	115.3
1025	A	26.3	Very low	33.8	Very low	80 Å²	80	128.1 Å²	128.1	66%	0.661	68%	0.677	S	S	*	*	S	Bend	trans	-96.4	-48.7	-178.8	0	0	0	0	0	113	S1027	A1025-S1027 VanDerWaalsContact C-N 3.35Å; A1025-S1027 PolarHBondContact O-N 3.29Å
1026	D	26.4	Very low	36.3	Very low	154 Å²	154	123.5 Å²	123.5	82%	0.824	64%	0.644	S	S	*	*	S	Bend	trans	-92.7	21.9	-170.2	-51.4	-64.3	0	0	0	114.5
1027	S	26.1	Very low	39	Very low	67 Å²	67	114.5 Å²	114.5	47%	0.469	61%	0.606	S	S	.	*			trans	-115.2	28.8	-162.9	53.3	0	0	0	0	115.8	K1023 A1025 S1029	K1023-S1027 PolarHBondContact O-OG 3.39Å; A1025-S1027 VanDerWaalsContact C-N 3.35Å; A1025-S1027 PolarHBondContact O-N 3.29Å; S1027-S1029 VanDerWaalsContact C-N 3.32Å; S1027-S1029 PolarHBondContact O-N 3.01Å
1028	T	28.9	Very low	41.7	Very low	132 Å²	132	109 Å²	109	81%	0.81	58%	0.576	S	S	*	*			trans	-80.8	-1	179.4	51.6	0	0	0	0	115.3	H1030	T1028-H1030 PolarHBondContact O-N 3.17Å; T1028-H1030 VanDerWaalsContact O-N 3.13Å
1029	S	26.6	Very low	44.3	Very low	79 Å²	79	103.7 Å²	103.7	55%	0.552	55%	0.548	S	S	*	.			trans	-84.1	80.3	174.9	55.4	0	0	0	0	112.5	S1027	S1027-S1029 VanDerWaalsContact C-N 3.32Å; S1027-S1029 PolarHBondContact O-N 3.01Å
1030	H	31.4	Very low	47.2	Very low	169 Å²	169	96.3 Å²	96.3	78%	0.782	51%	0.509	S	S	*	.			trans	-59.4	138	175.8	-77.3	4.4	0	0	0	112.9	T1028 Y1032	T1028-H1030 PolarHBondContact O-N 3.17Å; T1028-H1030 VanDerWaalsContact O-N 3.13Å; H1030-Y1032 PolarHBondContact O-N 3.44Å
1031	S	32	Very low	49.9	Very low	94 Å²	94	86.2 Å²	86.2	66%	0.657	47%	0.47	S	S	*	.			trans	-97.7	96.2	-157.4	60.7	0	0	0	0	115.4
1032	Y	42.8	Very low	52.8	Low	86 Å²	86	82 Å²	82	34%	0.337	44%	0.441	S	S	.	.			trans	56	74.6	131	-50.5	-45.4	0	0	0	119.1	R939 V941 D976 K979 H1030	R939-Y1032 HydrophobicContact CB-CD1 4.06Å; R939-Y1032 HydrophobicContact CG-CD1 4.08Å; R939-Y1032 HydrophobicContact CG-CG 4.36Å; V941-Y1032 HydrophobicContact CG2-CE1 4.15Å; D976-Y1032 WeakPolarHBondContact OD1-CE1 3.43Å; D976-Y1032 PolarHBondContact OD1-OH 3.21Å; D976-Y1032 WeakPolarHBondContact OD2-CE1 3.49Å; K979-Y1032 PolarHBondContact NZ-OH 3.26Å; K979-Y1032 VanDerWaalsContact NZ-OH 3.09Å; H1030-Y1032 PolarHBondContact O-N 3.44Å
1033	T	48.9	Very low	55.8	Low	58 Å²	58	70.6 Å²	70.6	36%	0.356	40%	0.398	S	S	.	.			trans	-110.2	153.5	168.2	55.8	0	0	0	0	112.9	D929	D929-T1033 HydrophobicContact CB-CG2 4.26Å; D929-T1033 WeakPolarHBondContact OD1-CB 3.32Å; D929-T1033 VanDerWaalsContact OD1-CG2 3.32Å; D929-T1033 WeakPolarHBondContact OD1-CG2 3.45Å; D929-T1033 PolarHBondContact OD1-OG1 3.24Å
1034	R	64.5	Low	58.5	Low	77 Å²	77	62.3 Å²	62.3	29%	0.291	36%	0.362	S	S	.	.			trans	-92	141.1	160.9	-97.3	171.4	158.2	153.8	-5.2	107.5	T930 T935	T930-R1034 WeakPolarHBondContact CB-O 3.48Å; T930-R1034 WeakPolarHBondContact CG2-O 3.38Å; T930-R1034 PolarHBondContact N-O 3Å; T930-R1034 VanDerWaalsContact OG1-CB 3.27Å; T930-R1034 WeakPolarHBondContact OG1-CB 2.97Å; T930-R1034 PolarHBondContact OG1-O 3.07Å; T935-R1034 PolarHBondContact OG1-NH1 3.19Å
1035	L	82.3	Confident	61	Low	6 Å²	6	58.1 Å²	58.1	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	152.7	-177.7	-66.6	177.5	0	0	0	111.8	A857 I858 R859 H916 F918 A927 K928 L940	A857-L1035 PolarHBondContact O-N 3.39Å; I858-L1035 HydrophobicContact CB-CB 4.47Å; I858-L1035 HydrophobicContact CG1-CB 4.03Å; I858-L1035 HydrophobicContact CG1-CD1 4.19Å; I858-L1035 HydrophobicContact CG2-CB 4.5Å; R859-L1035 WeakPolarHBondContact CB-O 3.36Å; R859-L1035 PolarHBondContact N-O 2.9Å; H916-L1035 HydrophobicContact CB-CD1 4.47Å; H916-L1035 HydrophobicContact CB-CD2 4.5Å; H916-L1035 VanDerWaalsContact CD2-CD2 3.46Å; H916-L1035 WeakPolarHBondContact CD2-CD2 3.07Å; F918-L1035 HydrophobicContact CE2-CD1 3.8Å; F918-L1035 HydrophobicContact CZ-CD1 3.63Å; A927-L1035 HydrophobicContact CB-CB 4.1Å; A927-L1035 HydrophobicContact CB-CD1 4.4Å; A927-L1035 HydrophobicContact CB-CD2 4.47Å; K928-L1035 WeakPolarHBondContact O-CA 3.45Å; L940-L1035 HydrophobicContact CD1-CD1 4.25Å
1036	T	85.4	Confident	63.7	Low	23 Å²	23	54.5 Å²	54.5	14%	0.141	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.2	169.6	-101.3	0	0	0	0	108.1	N860 A927 K928 T930 L1038	N860-T1036 WeakPolarHBondContact OD1-CA 3.43Å; N860-T1036 VanDerWaalsContact OD1-CB 3.3Å; N860-T1036 WeakPolarHBondContact OD1-CB 3.35Å; N860-T1036 VanDerWaalsContact OD1-CG2 3.25Å; N860-T1036 WeakPolarHBondContact OD1-CG2 3.23Å; N860-T1036 PolarHBondContact OD1-OG1 3.07Å; A927-T1036 CarbonylContact C-O 3.6Å; A927-T1036 WeakPolarHBondContact CA-O 3.16Å; A927-T1036 WeakPolarHBondContact CB-O 3.45Å; K928-T1036 HydrophobicContact CD-CG2 4.38Å; K928-T1036 VanDerWaalsContact CE-CG2 3.41Å; K928-T1036 HydrophobicContact CG-CG2 4Å; K928-T1036 PolarHBondContact N-O 3.28Å; K928-T1036 PolarHBondContact O-N 2.99Å; T930-T1036 WeakPolarHBondContact CG2-OG1 3.49Å; T1036-L1038 HydrophobicContact CG2-CD2 4.44Å
1037	A	86.4	Confident	66.2	Low	3 Å²	3	48.2 Å²	48.2	3%	0.025	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	144.8	173.8	0	0	0	0	0	110.4	I858 R859 N860 L861 V864 I925	I858-A1037 HydrophobicContact CG2-CB 3.71Å; R859-A1037 PolarHBondContact O-N 3.31Å; N860-A1037 PolarHBondContact ND2-O 3.44Å; L861-A1037 HydrophobicContact CD2-CB 3.87Å; L861-A1037 HydrophobicContact CG-CB 4.49Å; V864-A1037 HydrophobicContact CG2-CB 3.64Å; I925-A1037 HydrophobicContact CG2-CB 4.49Å
1038	L	84.2	Confident	68.9	Low	44 Å²	44	45 Å²	45	23%	0.23	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-46.4	173.5	-64.4	179.6	0	0	0	111	I926 K928 T1036	I926-L1038 PolarHBondContact O-N 3.1Å; K928-L1038 HydrophobicContact CB-CD1 4.22Å; K928-L1038 HydrophobicContact CD-CD1 4.42Å; K928-L1038 HydrophobicContact CD-CD2 3.88Å; K928-L1038 HydrophobicContact CD-CG 4.47Å; K928-L1038 HydrophobicContact CG-CD1 4.26Å; K928-L1038 HydrophobicContact CG-CD2 4.06Å; K928-L1038 HydrophobicContact CG-CG 4.2Å; T1036-L1038 HydrophobicContact CG2-CD2 4.44Å
1039	Y	82.6	Confident	71.3	Confident	85 Å²	85	44.2 Å²	44.2	33%	0.333	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	144.8	-176.8	-53	-70.5	0	0	0	110.2	L867 I926 F1041	L867-Y1039 HydrophobicContact CD1-CD1 3.96Å; I926-Y1039 PolarHBondContact N-O 3.08Å; I926-Y1039 PolarHBondContact O-N 3.48Å; Y1039-F1041 VanDerWaalsContact CB-CE2 3.44Å; Y1039-F1041 HydrophobicContact CD1-CZ 4.41Å; Y1039-F1041 HydrophobicContact CD2-CZ 4.48Å; Y1039-F1041 HydrophobicContact CG-CE2 4.15Å; Y1039-F1041 AromaticContact CG-CZ 3.94Å; Y1039-F1041 HydrophobicContact CG-CZ 3.94Å
1040	V	87	Confident	73.8	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.2	166.2	-179.2	0	0	0	0	106.5	V864 I866 L867 F883 L923 I924 I925	V864-V1040 HydrophobicContact CB-CG2 4.49Å; V864-V1040 HydrophobicContact CG1-CB 4.37Å; V864-V1040 HydrophobicContact CG1-CG2 3.97Å; I866-V1040 HydrophobicContact CG1-CG1 4.48Å; I866-V1040 HydrophobicContact CG2-CG1 4.37Å; L867-V1040 PolarHBondContact N-O 3.13Å; L867-V1040 VanDerWaalsContact N-O 3.08Å; F883-V1040 HydrophobicContact CE1-CG1 4.1Å; F883-V1040 HydrophobicContact CE1-CG2 4.11Å; F883-V1040 HydrophobicContact CZ-CG1 3.86Å; L923-V1040 HydrophobicContact CD1-CG1 4.35Å; L923-V1040 HydrophobicContact CD2-CG1 4.34Å; I924-V1040 WeakPolarHBondContact O-CA 3.24Å; I925-V1040 HydrophobicContact CG1-CG2 4.28Å; I925-V1040 HydrophobicContact CG2-CG2 4.46Å
1041	F	82	Confident	76.2	Confident	10 Å²	10	36.2 Å²	36.2	4%	0.044	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	129.8	-178.2	-56.4	-79.7	0	0	0	109.8	L867 L923 I924 I926 Y1039 M1083 I1084	L867-F1041 HydrophobicContact CB-CD1 4.02Å; L867-F1041 HydrophobicContact CB-CE1 4.21Å; L867-F1041 HydrophobicContact CD1-CD1 4.18Å; L867-F1041 HydrophobicContact CD1-CE1 3.53Å; L867-F1041 HydrophobicContact CD1-CZ 4.24Å; L867-F1041 HydrophobicContact CG-CE1 4.45Å; L923-F1041 CarbonylContact C-O 3.6Å; L923-F1041 WeakPolarHBondContact CA-O 3.46Å; L923-F1041 VanDerWaalsContact CB-O 3.25Å; L923-F1041 WeakPolarHBondContact CB-O 3.26Å; I924-F1041 HydrophobicContact CG2-CD2 4.49Å; I924-F1041 PolarHBondContact N-O 3.46Å; I924-F1041 PolarHBondContact O-N 3.49Å; I926-F1041 HydrophobicContact CD1-CE2 4.19Å; Y1039-F1041 VanDerWaalsContact CB-CE2 3.44Å; Y1039-F1041 HydrophobicContact CD1-CZ 4.41Å; Y1039-F1041 HydrophobicContact CD2-CZ 4.48Å; Y1039-F1041 HydrophobicContact CG-CE2 4.15Å; Y1039-F1041 AromaticContact CG-CZ 3.94Å; Y1039-F1041 HydrophobicContact CG-CZ 3.94Å; F1041-M1083 HydrophobicContact CD1-CB 4.14Å; F1041-M1083 HydrophobicContact CD1-CE 3.79Å; F1041-M1083 HydrophobicContact CE1-CB 3.99Å; F1041-M1083 HydrophobicContact CE1-CE 3.76Å; F1041-I1084 HydrophobicContact CE2-CB 4.37Å; F1041-I1084 HydrophobicContact CE2-CD1 4Å; F1041-I1084 HydrophobicContact CE2-CG2 4.47Å; F1041-I1084 HydrophobicContact CZ-CB 4.16Å; F1041-I1084 HydrophobicContact CZ-CD1 4.39Å
1042	S	85.7	Confident	78.4	Confident	21 Å²	21	38.9 Å²	38.9	15%	0.147	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	142	165.4	-176.6	0	0	0	0	110.6	Y1044 C1046	S1042-Y1044 VanDerWaalsContact C-N 3.3Å; S1042-Y1044 PolarHBondContact OG-N 2.93Å; S1042-C1046 PolarHBondContact O-SG 3.24Å; S1042-C1046 VanDerWaalsContact O-SG 3.33Å
1043	L	88.2	Confident	80	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.01	18%	0.179	C	C	.	.			trans	-78.3	-13	172.8	-74.6	176.1	0	0	0	113	F920 D922 I924 R1045 C1046 L1062 A1104 L1105 T1108	F920-L1043 WeakPolarHBondContact O-CD1 3.33Å; D922-L1043 WeakPolarHBondContact O-CB 3.48Å; D922-L1043 PolarHBondContact O-N 2.74Å; I924-L1043 HydrophobicContact CD1-CD2 3.77Å; I924-L1043 HydrophobicContact CG1-CD2 3.85Å; I924-L1043 HydrophobicContact CG1-CG 4.29Å; L1043-R1045 PolarHBondContact O-N 3.27Å; L1043-C1046 WeakPolarHBondContact O-CB 3.48Å; L1043-C1046 PolarHBondContact O-N 3.42Å; L1043-L1062 HydrophobicContact CD2-CD2 4.5Å; L1043-A1104 HydrophobicContact CD1-CB 3.49Å; L1043-A1104 VanDerWaalsContact CD1-CB 3.49Å; L1043-L1105 HydrophobicContact CB-CD2 4.03Å; L1043-L1105 HydrophobicContact CD2-CD2 3.89Å; L1043-L1105 HydrophobicContact CD2-CG 4.32Å; L1043-L1105 WeakPolarHBondContact O-CD2 3.27Å; L1043-T1108 HydrophobicContact CB-CG2 4.11Å; L1043-T1108 WeakPolarHBondContact CB-OG1 3.39Å
1044	Y	84.7	Confident	81.2	Confident	20 Å²	20	43.4 Å²	43.4	8%	0.078	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	126.7	-178.9	178.9	-123.1	0	0	0	110.4	D871 S1042 C1046 N1109 A1112 K1116	D871-Y1044 WeakPolarHBondContact OD2-CE1 3.19Å; S1042-Y1044 VanDerWaalsContact C-N 3.3Å; S1042-Y1044 PolarHBondContact OG-N 2.93Å; Y1044-C1046 PolarHBondContact O-N 2.91Å; Y1044-C1046 VanDerWaalsContact O-N 3.13Å; Y1044-N1109 WeakPolarHBondContact CD2-OD1 3.27Å; Y1044-A1112 HydrophobicContact CD2-CB 3.39Å; Y1044-A1112 HydrophobicContact CE2-CB 3.28Å; Y1044-A1112 HydrophobicContact CG-CB 4.37Å; Y1044-K1116 WeakPolarHBondContact OH-CE 3.02Å; Y1044-K1116 PolarHBondContact OH-NZ 2.87Å
1045	R	77.8	Confident	81.7	Confident	9 Å²	9	43.7 Å²	43.7	3%	0.034	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	21.2	180	-51.4	174.6	66.1	-126.5	-12.6	114.8	D871 L1043 F1065 P1066 K1067 N1109	D871-R1045 IonicContact OD1-NH1 2.71Å; D871-R1045 PolarHBondContact OD1-NH1 3.46Å; D871-R1045 WeakPolarHBondContact OD2-CD 3.27Å; D871-R1045 IonicContact OD2-CZ 3.22Å; D871-R1045 IonicContact OD2-NH1 3.25Å; D871-R1045 PolarHBondContact OD2-NH1 2.78Å; L1043-R1045 PolarHBondContact O-N 3.27Å; R1045-F1065 VanDerWaalsContact CZ-O 3.24Å; R1045-F1065 PolarHBondContact NH1-O 3.38Å; R1045-F1065 PolarHBondContact NH2-O 3.11Å; R1045-F1065 PolarHBondContact O-N 3.42Å; R1045-P1066 VanDerWaalsContact NH2-C 3.28Å; R1045-P1066 PolarHBondContact NH2-O 2.78Å; R1045-K1067 VanDerWaalsContact NH1-CA 3.34Å; R1045-K1067 VanDerWaalsContact NH1-N 3.18Å; R1045-N1109 PolarHBondContact N-OD1 3.21Å
1046	C	83	Confident	81.6	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.027	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	156.9	167.7	-74.5	0	0	0	0	112.1	S1042 L1043 Y1044 W1063 L1105	S1042-C1046 PolarHBondContact O-SG 3.24Å; S1042-C1046 VanDerWaalsContact O-SG 3.33Å; L1043-C1046 WeakPolarHBondContact O-CB 3.48Å; L1043-C1046 PolarHBondContact O-N 3.42Å; Y1044-C1046 PolarHBondContact O-N 2.91Å; Y1044-C1046 VanDerWaalsContact O-N 3.13Å; C1046-W1063 CarbonylContact C-O 3.02Å; C1046-W1063 VanDerWaalsContact CA-O 3.24Å; C1046-W1063 WeakPolarHBondContact CA-O 3.4Å; C1046-L1105 HydrophobicContact CB-CD2 3.78Å; C1046-L1105 WeakPolarHBondContact O-CD2 3.39Å
1047	K	80.3	Confident	81.2	Confident	23 Å²	23	52.2 Å²	52.2	10%	0.1	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	162.5	169	-61.6	-167.5	172.7	-150.7	0	110.7	F523 L1062 W1063 F1065	F523-K1047 VanDerWaalsContact CZ-NZ 3.31Å; F523-K1047 WeakPolarHBondContact O-CD 2.95Å; F523-K1047 WeakPolarHBondContact O-CE 3.38Å; F523-K1047 PolarHBondContact O-NZ 3.42Å; K1047-L1062 WeakPolarHBondContact O-CA 3.47Å; K1047-W1063 PolarHBondContact N-O 3.29Å; K1047-W1063 PolarHBondContact O-N 3.42Å; K1047-F1065 HydrophobicContact CB-CD2 4.43Å; K1047-F1065 HydrophobicContact CB-CE2 3.84Å; K1047-F1065 HydrophobicContact CD-CD2 4.06Å; K1047-F1065 HydrophobicContact CD-CE2 3.54Å; K1047-F1065 HydrophobicContact CD-CZ 3.89Å; K1047-F1065 HydrophobicContact CG-CD2 3.88Å; K1047-F1065 HydrophobicContact CG-CE2 3.61Å; K1047-F1065 HydrophobicContact CG-CZ 4.44Å
1048	I	82	Confident	81.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134	-179	-50.5	-179	0	0	0	109.2	Y524 L525 S526 I1060 E1061 L1098 L1101 L1105	Y524-I1048 PolarHBondContact O-N 3.44Å; L525-I1048 CarbonylContact C-O 3.48Å; L525-I1048 WeakPolarHBondContact CA-O 3.47Å; L525-I1048 HydrophobicContact CD2-CB 4.5Å; L525-I1048 VanDerWaalsContact O-O 3.1Å; S526-I1048 WeakPolarHBondContact CB-O 3.2Å; S526-I1048 PolarHBondContact N-O 3.4Å; S526-I1048 PolarHBondContact OG-O 3.15Å; I1048-I1060 HydrophobicContact CG2-CG2 3.34Å; I1048-E1061 CarbonylContact C-O 3.59Å; I1048-E1061 WeakPolarHBondContact CA-O 3.37Å; I1048-L1098 HydrophobicContact CD1-CD1 4.15Å; I1048-L1098 HydrophobicContact CG2-CD1 3.89Å; I1048-L1101 HydrophobicContact CD1-CB 3.58Å; I1048-L1101 HydrophobicContact CD1-CD1 4.47Å; I1048-L1105 HydrophobicContact CD1-CD1 3.71Å; I1048-L1105 HydrophobicContact CG1-CD1 3.46Å; I1048-L1105 VanDerWaalsContact CG1-CD1 3.46Å
1049	R	78.8	Confident	81.1	Confident	115 Å²	115	52.3 Å²	52.3	43%	0.434	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	100.8	165.2	-170.9	159.9	178.4	-166.1	3.6	110.5	S526 E1061	S526-R1049 VanDerWaalsContact OG-CA 3.27Å; S526-R1049 WeakPolarHBondContact OG-CA 3.45Å; S526-R1049 WeakPolarHBondContact OG-CB 3.46Å; S526-R1049 WeakPolarHBondContact OG-CG 3.33Å; R1049-E1061 HydrophobicContact CB-CB 4.11Å; R1049-E1061 HydrophobicContact CB-CG 4.29Å; R1049-E1061 WeakPolarHBondContact CD-OE2 3.43Å; R1049-E1061 PolarHBondContact N-O 3.4Å; R1049-E1061 PolarHBondContact O-N 2.8Å
1050	P	80.5	Confident	81.3	Confident	38 Å²	38	48.3 Å²	48.3	25%	0.247	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	137.4	167	-20.3	33.3	0	0	0	110	L525 L1098	L525-P1050 HydrophobicContact CD1-CG 4.45Å; L525-P1050 HydrophobicContact CD2-CG 3.85Å; P1050-L1098 HydrophobicContact CG-CD1 4.33Å
1051	F	80.7	Confident	81.2	Confident	42 Å²	42	49.6 Å²	49.6	18%	0.184	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	162.6	174.5	77.3	-87.8	0	0	0	111.7	I901 T1053 G1059 E1061 I1085	I901-F1051 HydrophobicContact CD1-CZ 4.11Å; F1051-T1053 HydrophobicContact CD2-CG2 4.11Å; F1051-T1053 HydrophobicContact CE2-CG2 4.24Å; F1051-G1059 PolarHBondContact N-O 2.91Å; F1051-G1059 CarbonylContact O-C 3.45Å; F1051-G1059 VanDerWaalsContact O-CA 3.27Å; F1051-G1059 WeakPolarHBondContact O-CA 3.41Å; F1051-G1059 PolarHBondContact O-N 2.86Å; F1051-E1061 HydrophobicContact CD1-CG 3.56Å; F1051-E1061 HydrophobicContact CE1-CG 3.84Å; F1051-I1085 HydrophobicContact CE1-CG2 3.48Å; F1051-I1085 VanDerWaalsContact CE1-CG2 3.48Å; F1051-I1085 HydrophobicContact CZ-CG2 3.48Å; F1051-I1085 VanDerWaalsContact CZ-CG2 3.48Å
1052	K	78.9	Confident	81.3	Confident	150 Å²	150	49.4 Å²	49.4	65%	0.652	23%	0.233	S	C	*	.			trans	-140.6	126.7	177.5	-179.5	-175.9	173	-166.6	0	108.8	Y1056	K1052-Y1056 WeakPolarHBondContact CA-O 3.29Å
1053	T	76.1	Confident	81.1	Confident	62 Å²	62	50.8 Å²	50.8	38%	0.38	24%	0.235	S	C	.	.			trans	-122.2	173.2	165.4	66.5	0	0	0	0	109.5	F1051 V1055 Y1056	F1051-T1053 HydrophobicContact CD2-CG2 4.11Å; F1051-T1053 HydrophobicContact CE2-CG2 4.24Å; T1053-V1055 PolarHBondContact O-N 2.97Å; T1053-Y1056 PolarHBondContact N-O 3.12Å; T1053-Y1056 CarbonylContact O-C 3.38Å; T1053-Y1056 PolarHBondContact O-N 2.97Å; T1053-Y1056 PolarHBondContact OG1-N 3.04Å
1054	D	74.9	Confident	80.6	Confident	177 Å²	177	51.1 Å²	51.1	95%	0.947	24%	0.236	S	C	*	.	S	Bend	trans	-63.2	-29.7	176.9	-50.9	-55.5	0	0	0	112.2
1055	V	74.5	Confident	79.9	Confident	83 Å²	83	51.6 Å²	51.6	50%	0.503	24%	0.239	S	C	.	.	S	Bend	trans	-83.7	-43.9	174.9	-174.4	0	0	0	0	111.6	T1053	T1053-V1055 PolarHBondContact O-N 2.97Å
1056	Y	80.2	Confident	79.3	Confident	42 Å²	42	52.8 Å²	52.8	17%	0.165	25%	0.248	C	C	.	.			trans	-115.6	89	-173.2	-60.7	-67.3	0	0	0	110.9	V899 I901 K1052 T1053 Y1058 A1087	V899-Y1056 HydrophobicContact CB-CE1 4.48Å; V899-Y1056 HydrophobicContact CG1-CE1 3.98Å; I901-Y1056 HydrophobicContact CD1-CD1 3.9Å; I901-Y1056 HydrophobicContact CD1-CD2 3.61Å; I901-Y1056 HydrophobicContact CD1-CE1 3.91Å; I901-Y1056 HydrophobicContact CD1-CE2 3.64Å; I901-Y1056 HydrophobicContact CD1-CG 3.75Å; I901-Y1056 HydrophobicContact CG1-CE1 4.18Å; I901-Y1056 HydrophobicContact CG1-CE2 4.04Å; K1052-Y1056 WeakPolarHBondContact CA-O 3.29Å; T1053-Y1056 PolarHBondContact N-O 3.12Å; T1053-Y1056 CarbonylContact O-C 3.38Å; T1053-Y1056 PolarHBondContact O-N 2.97Å; T1053-Y1056 PolarHBondContact OG1-N 3.04Å; Y1056-Y1058 PolarHBondContact O-N 2.82Å; Y1056-A1087 HydrophobicContact CD1-CB 3.56Å; Y1056-A1087 HydrophobicContact CE1-CB 4.39Å; Y1056-A1087 HydrophobicContact CG-CB 4.12Å
1057	R	76.2	Confident	78.4	Confident	165 Å²	165	56.2 Å²	56.2	62%	0.623	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.6	-178.8	-171.8	170.2	175.1	134.8	-0.9	114.2
1058	Y	85.8	Confident	77.2	Confident	50 Å²	50	58 Å²	58	20%	0.196	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	51.8	-170.7	-55.6	-57.3	0	0	0	111.1	Y1056 A1087 A1088 K1091 Y1094	Y1056-Y1058 PolarHBondContact O-N 2.82Å; Y1058-A1087 WeakPolarHBondContact O-CA 3.38Å; Y1058-A1088 PolarHBondContact O-N 2.71Å; Y1058-K1091 HydrophobicContact CE1-CB 3.78Å; Y1058-K1091 HydrophobicContact CE1-CG 4.17Å; Y1058-Y1094 HydrophobicContact CD1-CD1 4.13Å; Y1058-Y1094 HydrophobicContact CD1-CD2 4.48Å; Y1058-Y1094 HydrophobicContact CD1-CG 4.03Å; Y1058-Y1094 HydrophobicContact CG-CD2 4.46Å; Y1058-Y1094 HydrophobicContact CG-CG 4.25Å
1059	G	83.5	Confident	75.4	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	143.2	-175.6	0	0	0	0	0	113.5	F1051	F1051-G1059 PolarHBondContact N-O 2.91Å; F1051-G1059 CarbonylContact O-C 3.45Å; F1051-G1059 VanDerWaalsContact O-CA 3.27Å; F1051-G1059 WeakPolarHBondContact O-CA 3.41Å; F1051-G1059 PolarHBondContact O-N 2.86Å
1060	I	86.9	Confident	73.3	Confident	0 Å²	0	70 Å²	70	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	122.1	173.9	-50.1	-179.4	0	0	0	109	I1048 L1062 I1086 Y1094 L1097	I1048-I1060 HydrophobicContact CG2-CG2 3.34Å; I1060-L1062 HydrophobicContact CG2-CD1 4.02Å; I1060-I1086 HydrophobicContact CB-CD1 4.46Å; I1060-I1086 HydrophobicContact CB-CG1 4Å; I1060-I1086 PolarHBondContact N-O 2.66Å; I1060-I1086 WeakPolarHBondContact O-CG1 3.34Å; I1060-I1086 PolarHBondContact O-N 2.85Å; I1060-I1086 VanDerWaalsContact O-O 3.09Å; I1060-Y1094 HydrophobicContact CD1-CD2 3.99Å; I1060-Y1094 HydrophobicContact CD1-CE2 4.04Å; I1060-Y1094 HydrophobicContact CG1-CD2 4.02Å; I1060-Y1094 HydrophobicContact CG1-CE2 3.69Å; I1060-L1097 HydrophobicContact CD1-CD2 4.04Å; I1060-L1097 HydrophobicContact CD1-CG 4.25Å
1061	E	84.1	Confident	71.1	Confident	29 Å²	29	72.4 Å²	72.4	14%	0.136	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	147.5	165.5	-34.6	179.5	128.8	0	0	109.7	I1048 R1049 F1051 W1063 Q1082 I1084 I1085	I1048-E1061 CarbonylContact C-O 3.59Å; I1048-E1061 WeakPolarHBondContact CA-O 3.37Å; R1049-E1061 HydrophobicContact CB-CB 4.11Å; R1049-E1061 HydrophobicContact CB-CG 4.29Å; R1049-E1061 WeakPolarHBondContact CD-OE2 3.43Å; R1049-E1061 PolarHBondContact N-O 3.4Å; R1049-E1061 PolarHBondContact O-N 2.8Å; F1051-E1061 HydrophobicContact CD1-CG 3.56Å; F1051-E1061 HydrophobicContact CE1-CG 3.84Å; E1061-W1063 PolarHBondContact OE2-NE1 2.93Å; E1061-Q1082 PolarHBondContact OE1-NE2 3.18Å; E1061-Q1082 PolarHBondContact OE2-NE2 2.84Å; E1061-I1084 CarbonylContact C-O 3.54Å; E1061-I1084 VanDerWaalsContact CA-O 3.32Å; E1061-I1084 WeakPolarHBondContact CA-O 3.41Å; E1061-I1085 HydrophobicContact CB-CG1 4.5Å; E1061-I1085 HydrophobicContact CG-CG1 4.3Å
1062	L	84.7	Confident	68.7	Low	6 Å²	6	78.7 Å²	78.7	3%	0.031	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.8	166.2	-70.7	81.5	0	0	0	110.4	I924 L1043 K1047 I1060 M1083 I1084	I924-L1062 HydrophobicContact CD1-CD2 3.56Å; L1043-L1062 HydrophobicContact CD2-CD2 4.5Å; K1047-L1062 WeakPolarHBondContact O-CA 3.47Å; I1060-L1062 HydrophobicContact CG2-CD1 4.02Å; L1062-M1083 PolarHBondContact O-N 3.42Å; L1062-I1084 HydrophobicContact CB-CG2 3.75Å; L1062-I1084 HydrophobicContact CD1-CG2 4.01Å; L1062-I1084 HydrophobicContact CG-CG2 4.38Å; L1062-I1084 PolarHBondContact N-O 2.84Å; L1062-I1084 PolarHBondContact O-N 2.94Å
1063	W	80.8	Confident	66.3	Low	50 Å²	50	77.9 Å²	77.9	19%	0.189	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.8	-173	-67.7	79.7	0	0	0	110.7	C1046 K1047 E1061 F1065 P1080 E1081 Q1082	C1046-W1063 CarbonylContact C-O 3.02Å; C1046-W1063 VanDerWaalsContact CA-O 3.24Å; C1046-W1063 WeakPolarHBondContact CA-O 3.4Å; K1047-W1063 PolarHBondContact N-O 3.29Å; K1047-W1063 PolarHBondContact O-N 3.42Å; E1061-W1063 PolarHBondContact OE2-NE1 2.93Å; W1063-F1065 HydrophobicContact CB-CE2 4.15Å; W1063-P1080 HydrophobicContact CE3-CB 3.92Å; W1063-P1080 HydrophobicContact CE3-CG 3.75Å; W1063-P1080 HydrophobicContact CZ3-CG 4.07Å; W1063-P1080 WeakPolarHBondContact CZ3-O 3.35Å; W1063-E1081 CarbonylContact C-O 3.59Å; W1063-E1081 VanDerWaalsContact CA-O 3.29Å; W1063-E1081 WeakPolarHBondContact CA-O 3.39Å; W1063-Q1082 HydrophobicContact CD2-CB 3.95Å; W1063-Q1082 HydrophobicContact CD2-CG 4.03Å; W1063-Q1082 HydrophobicContact CE3-CB 3.75Å; W1063-Q1082 HydrophobicContact CE3-CG 4.35Å; W1063-Q1082 HydrophobicContact CH2-CB 3.88Å; W1063-Q1082 HydrophobicContact CH2-CG 4.22Å; W1063-Q1082 HydrophobicContact CZ2-CB 4.04Å; W1063-Q1082 VanDerWaalsContact CZ2-CD 3.49Å; W1063-Q1082 HydrophobicContact CZ2-CG 3.87Å; W1063-Q1082 HydrophobicContact CZ3-CB 3.73Å; W1063-Q1082 HydrophobicContact CZ3-CG 4.44Å
1064	K	78	Confident	64.2	Low	9 Å²	9	81.1 Å²	81.1	4%	0.039	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	144.6	170.7	165.4	174.6	164.9	-168.1	0	110.5	N868 D870 P1080 E1081 M1083	N868-K1064 HydrophobicContact CB-CD 3.58Å; N868-K1064 WeakPolarHBondContact ND2-CD 3.29Å; N868-K1064 PolarHBondContact O-NZ 2.84Å; N868-K1064 WeakPolarHBondContact OD1-CD 3.42Å; D870-K1064 IonicContact OD2-NZ 3.94Å; D870-K1064 PolarHBondContact OD2-NZ 3Å; D870-K1064 VanDerWaalsContact OD2-NZ 3.13Å; K1064-P1080 CarbonylContact O-C 3.52Å; K1064-P1080 VanDerWaalsContact O-CA 3.32Å; K1064-P1080 WeakPolarHBondContact O-CA 3.5Å; K1064-P1080 WeakPolarHBondContact O-CB 3.38Å; K1064-E1081 HydrophobicContact CB-CB 4.43Å; K1064-E1081 PolarHBondContact N-O 3.45Å; K1064-E1081 IonicContact NZ-OE2 3.84Å; K1064-E1081 PolarHBondContact O-N 2.8Å; K1064-M1083 HydrophobicContact CB-CG 3.93Å; K1064-M1083 HydrophobicContact CB-SD 3.66Å
1065	F	70.8	Confident	62.2	Low	29 Å²	29	81.1 Å²	81.1	13%	0.127	42%	0.415	C	S	.	.			trans	-105.3	122.8	172.7	-74.9	-100.4	0	0	0	110.8	F550 R1045 K1047 W1063 P1080	F550-F1065 AromaticContact CD1-CE1 3.84Å; F550-F1065 HydrophobicContact CD1-CE1 3.84Å; F550-F1065 AromaticContact CE1-CE1 3.67Å; F550-F1065 HydrophobicContact CE1-CE1 3.67Å; F550-F1065 HydrophobicContact CE1-CZ 4.35Å; F550-F1065 HydrophobicContact CG-CE1 4.41Å; F550-F1065 HydrophobicContact CZ-CE1 4.08Å; R1045-F1065 VanDerWaalsContact CZ-O 3.24Å; R1045-F1065 PolarHBondContact NH1-O 3.38Å; R1045-F1065 PolarHBondContact NH2-O 3.11Å; R1045-F1065 PolarHBondContact O-N 3.42Å; K1047-F1065 HydrophobicContact CB-CD2 4.43Å; K1047-F1065 HydrophobicContact CB-CE2 3.84Å; K1047-F1065 HydrophobicContact CD-CD2 4.06Å; K1047-F1065 HydrophobicContact CD-CE2 3.54Å; K1047-F1065 HydrophobicContact CD-CZ 3.89Å; K1047-F1065 HydrophobicContact CG-CD2 3.88Å; K1047-F1065 HydrophobicContact CG-CE2 3.61Å; K1047-F1065 HydrophobicContact CG-CZ 4.44Å; W1063-F1065 HydrophobicContact CB-CE2 4.15Å; F1065-P1080 HydrophobicContact CD1-CB 4.08Å; F1065-P1080 HydrophobicContact CD2-CB 4.32Å; F1065-P1080 HydrophobicContact CE1-CB 3.72Å; F1065-P1080 HydrophobicContact CE1-CG 4.13Å; F1065-P1080 HydrophobicContact CE2-CB 3.93Å; F1065-P1080 HydrophobicContact CG-CB 4.36Å; F1065-P1080 HydrophobicContact CZ-CB 3.63Å; F1065-P1080 HydrophobicContact CZ-CG 4.05Å
1066	P	65	Low	60.3	Low	35 Å²	35	83.8 Å²	83.8	23%	0.227	43%	0.425	C	S	.	.			trans	-67.2	154.1	-177.1	28	-35.9	0	0	0	112.1	R1045 S1068 Q1078	R1045-P1066 VanDerWaalsContact NH2-C 3.28Å; R1045-P1066 PolarHBondContact NH2-O 2.78Å; P1066-S1068 PolarHBondContact O-N 2.8Å; P1066-Q1078 HydrophobicContact CG-CB 4Å
1067	K	64.4	Low	58.6	Low	75 Å²	75	87.4 Å²	87.4	33%	0.326	45%	0.447	S	S	.	.			trans	-66.1	128.6	175.5	-127.2	-174	-173.6	-161.9	0	110	D871 D873 R1045 R1069	D871-K1067 VanDerWaalsContact OD1-CB 3.31Å; D871-K1067 WeakPolarHBondContact OD1-CB 3.07Å; D871-K1067 WeakPolarHBondContact OD1-CG 3.42Å; D873-K1067 IonicContact OD1-NZ 3.31Å; D873-K1067 PolarHBondContact OD1-NZ 2.89Å; D873-K1067 IonicContact OD2-NZ 3.26Å; D873-K1067 PolarHBondContact OD2-NZ 3.48Å; R1045-K1067 VanDerWaalsContact NH1-CA 3.34Å; R1045-K1067 VanDerWaalsContact NH1-N 3.18Å; K1067-R1069 PolarHBondContact O-N 3.01Å
1068	S	54	Low	57.3	Low	62 Å²	62	84.1 Å²	84.1	43%	0.434	44%	0.439	S	S	.	.			trans	-66.5	100.8	168.4	55.9	0	0	0	0	108.5	P1066 T1070	P1066-S1068 PolarHBondContact O-N 2.8Å; S1068-T1070 PolarHBondContact O-N 2.84Å
1069	R	44	Very low	55.9	Low	214 Å²	214	89 Å²	89	81%	0.808	46%	0.463	S	S	*	.			trans	-62.3	127.5	177.1	-70.3	-174.2	175.5	-171.5	-2.3	108.9	K1067 S1071	K1067-R1069 PolarHBondContact O-N 3.01Å; R1069-S1071 PolarHBondContact O-N 3.42Å
1070	T	35.7	Very low	55	Low	153 Å²	153	90.4 Å²	90.4	94%	0.939	47%	0.472	S	S	*	.			trans	-78.5	74.6	176.6	42	0	0	0	0	110.3	S1068	S1068-T1070 PolarHBondContact O-N 2.84Å
1071	S	33.1	Very low	54.1	Low	88 Å²	88	95 Å²	95	62%	0.615	49%	0.493	S	S	*	.			trans	-134.3	134.5	164.4	53.9	0	0	0	0	107.4	R1069	R1069-S1071 PolarHBondContact O-N 3.42Å
1072	Q	30.7	Very low	53.4	Low	174 Å²	174	96.3 Å²	96.3	81%	0.813	50%	0.5	S	S	*	.	S	Bend	trans	-66.7	162	-177	-64.3	171.2	-4.5	0	0	111.1
1073	T	29.4	Very low	52.9	Low	133 Å²	133	97.6 Å²	97.6	82%	0.816	51%	0.506	S	S	*	.	S	Bend	trans	68.6	49	164.3	-17.5	0	0	0	0	117.9
1074	T	31.8	Very low	53	Low	130 Å²	130	95.7 Å²	95.7	80%	0.798	50%	0.5	S	S	*	.			trans	-165.1	86.9	147.2	9.6	0	0	0	0	111.6	I1076	T1074-I1076 VanDerWaalsContact C-N 3.33Å; T1074-I1076 PolarHBondContact O-N 2.88Å
1075	L	32.9	Very low	53.3	Low	177 Å²	177	96.2 Å²	96.2	93%	0.927	50%	0.503	S	S	*	.			trans	-89.3	21.1	-171.2	-100.1	165.7	0	0	0	115.2
1076	I	35.3	Very low	54.2	Low	139 Å²	139	95 Å²	95	71%	0.713	50%	0.497	S	S	*	.	S	Bend	trans	-121.6	125.8	-164.9	-57.3	176.8	0	0	0	111.6	T1074	T1074-I1076 VanDerWaalsContact C-N 3.33Å; T1074-I1076 PolarHBondContact O-N 2.88Å
1077	N	43.3	Very low	55.3	Low	117 Å²	117	93.5 Å²	93.5	63%	0.626	49%	0.488	S	S	*	.			trans	58.8	52.5	163.8	-64	-20.1	0	0	0	118.7	Q1079	N1077-Q1079 PolarHBondContact O-N 3.48Å
1078	Q	50.1	Low	56.4	Low	97 Å²	97	90.4 Å²	90.4	45%	0.453	48%	0.476	S	S	.	.			trans	-74.5	106.1	150.6	-73.8	-165.5	-17.9	0	0	109.4	P1066	P1066-Q1078 HydrophobicContact CG-CB 4Å
1079	Q	56.3	Low	58	Low	153 Å²	153	91.8 Å²	91.8	72%	0.715	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-77.8	144.2	176.3	-65.6	-172.3	-4.6	0	0	111.1	N1077	N1077-Q1079 PolarHBondContact O-N 3.48Å
1080	P	63.1	Low	60	Low	28 Å²	28	84.5 Å²	84.5	18%	0.182	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-71.5	145.5	171.1	30.4	-33.7	0	0	0	111.1	F550 W1063 K1064 F1065	F550-P1080 HydrophobicContact CZ-CG 4.37Å; W1063-P1080 HydrophobicContact CE3-CB 3.92Å; W1063-P1080 HydrophobicContact CE3-CG 3.75Å; W1063-P1080 HydrophobicContact CZ3-CG 4.07Å; W1063-P1080 WeakPolarHBondContact CZ3-O 3.35Å; K1064-P1080 CarbonylContact O-C 3.52Å; K1064-P1080 VanDerWaalsContact O-CA 3.32Å; K1064-P1080 WeakPolarHBondContact O-CA 3.5Å; K1064-P1080 WeakPolarHBondContact O-CB 3.38Å; F1065-P1080 HydrophobicContact CD1-CB 4.08Å; F1065-P1080 HydrophobicContact CD2-CB 4.32Å; F1065-P1080 HydrophobicContact CE1-CB 3.72Å; F1065-P1080 HydrophobicContact CE1-CG 4.13Å; F1065-P1080 HydrophobicContact CE2-CB 3.93Å; F1065-P1080 HydrophobicContact CG-CB 4.36Å; F1065-P1080 HydrophobicContact CZ-CB 3.63Å; F1065-P1080 HydrophobicContact CZ-CG 4.05Å
1081	E	67.9	Low	62.3	Low	96 Å²	96	81.5 Å²	81.5	45%	0.449	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.5	-178.7	-64.7	176.9	143.6	0	0	109.6	W1063 K1064 M1083	W1063-E1081 CarbonylContact C-O 3.59Å; W1063-E1081 VanDerWaalsContact CA-O 3.29Å; W1063-E1081 WeakPolarHBondContact CA-O 3.39Å; K1064-E1081 HydrophobicContact CB-CB 4.43Å; K1064-E1081 PolarHBondContact N-O 3.45Å; K1064-E1081 IonicContact NZ-OE2 3.84Å; K1064-E1081 PolarHBondContact O-N 2.8Å; E1081-M1083 HydrophobicContact CB-SD 4.12Å; E1081-M1083 PolarHBondContact O-N 3.5Å; E1081-M1083 VanDerWaalsContact O-N 3.15Å
1082	Q	69.7	Low	64.6	Low	57 Å²	57	80.5 Å²	80.5	27%	0.266	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	106	176.2	-167.1	169.3	27.8	0	0	109.7	Q903 E1061 W1063	Q903-Q1082 VanDerWaalsContact NE2-CD 3.34Å; E1061-Q1082 PolarHBondContact OE1-NE2 3.18Å; E1061-Q1082 PolarHBondContact OE2-NE2 2.84Å; W1063-Q1082 HydrophobicContact CD2-CB 3.95Å; W1063-Q1082 HydrophobicContact CD2-CG 4.03Å; W1063-Q1082 HydrophobicContact CE3-CB 3.75Å; W1063-Q1082 HydrophobicContact CE3-CG 4.35Å; W1063-Q1082 HydrophobicContact CH2-CB 3.88Å; W1063-Q1082 HydrophobicContact CH2-CG 4.22Å; W1063-Q1082 HydrophobicContact CZ2-CB 4.04Å; W1063-Q1082 VanDerWaalsContact CZ2-CD 3.49Å; W1063-Q1082 HydrophobicContact CZ2-CG 3.87Å; W1063-Q1082 HydrophobicContact CZ3-CB 3.73Å; W1063-Q1082 HydrophobicContact CZ3-CG 4.44Å
1083	M	73.9	Confident	67.1	Low	33 Å²	33	73.2 Å²	73.2	16%	0.163	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-38.6	-174	-59.8	-46.6	-48.4	0	0	112.4	L867 N868 F1041 L1062 K1064 E1081	L867-M1083 HydrophobicContact CB-CE 3.89Å; L867-M1083 HydrophobicContact CD1-CE 4.43Å; N868-M1083 WeakPolarHBondContact ND2-CE 3.42Å; N868-M1083 PolarHBondContact ND2-SD 3.41Å; N868-M1083 VanDerWaalsContact ND2-SD 3.45Å; N868-M1083 WeakPolarHBondContact OD1-CE 3.4Å; N868-M1083 PolarHBondContact OD1-SD 2.83Å; F1041-M1083 HydrophobicContact CD1-CB 4.14Å; F1041-M1083 HydrophobicContact CD1-CE 3.79Å; F1041-M1083 HydrophobicContact CE1-CB 3.99Å; F1041-M1083 HydrophobicContact CE1-CE 3.76Å; L1062-M1083 PolarHBondContact O-N 3.42Å; K1064-M1083 HydrophobicContact CB-CG 3.93Å; K1064-M1083 HydrophobicContact CB-SD 3.66Å; E1081-M1083 HydrophobicContact CB-SD 4.12Å; E1081-M1083 PolarHBondContact O-N 3.5Å; E1081-M1083 VanDerWaalsContact O-N 3.15Å
1084	I	82.9	Confident	69.8	Low	11 Å²	11	68 Å²	68	6%	0.056	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	150.3	-170.2	179.9	161.3	0	0	0	112.3	I926 F1041 E1061 L1062 I1086	I926-I1084 HydrophobicContact CD1-CD1 3Å; I926-I1084 HydrophobicContact CG1-CD1 4.48Å; F1041-I1084 HydrophobicContact CE2-CB 4.37Å; F1041-I1084 HydrophobicContact CE2-CD1 4Å; F1041-I1084 HydrophobicContact CE2-CG2 4.47Å; F1041-I1084 HydrophobicContact CZ-CB 4.16Å; F1041-I1084 HydrophobicContact CZ-CD1 4.39Å; E1061-I1084 CarbonylContact C-O 3.54Å; E1061-I1084 VanDerWaalsContact CA-O 3.32Å; E1061-I1084 WeakPolarHBondContact CA-O 3.41Å; L1062-I1084 HydrophobicContact CB-CG2 3.75Å; L1062-I1084 HydrophobicContact CD1-CG2 4.01Å; L1062-I1084 HydrophobicContact CG-CG2 4.38Å; L1062-I1084 PolarHBondContact N-O 2.84Å; L1062-I1084 PolarHBondContact O-N 2.94Å; I1084-I1086 HydrophobicContact CD1-CG2 3.74Å; I1084-I1086 HydrophobicContact CG1-CG2 3.92Å
1085	I	85.8	Confident	72.2	Confident	20 Å²	20	63.5 Å²	63.5	10%	0.103	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.6	164.3	-52.5	-178.4	0	0	0	108.9	I901 Q903 F1051 E1061	I901-I1085 HydrophobicContact CB-CB 4.03Å; I901-I1085 HydrophobicContact CB-CG2 3.9Å; I901-I1085 HydrophobicContact CD1-CG2 3.75Å; I901-I1085 HydrophobicContact CG1-CG2 4.39Å; I901-I1085 HydrophobicContact CG2-CB 4.4Å; I901-I1085 HydrophobicContact CG2-CG2 4.21Å; I901-I1085 PolarHBondContact N-O 2.87Å; Q903-I1085 HydrophobicContact CG-CD1 4.15Å; F1051-I1085 HydrophobicContact CE1-CG2 3.48Å; F1051-I1085 VanDerWaalsContact CE1-CG2 3.48Å; F1051-I1085 HydrophobicContact CZ-CG2 3.48Å; F1051-I1085 VanDerWaalsContact CZ-CG2 3.48Å; E1061-I1085 HydrophobicContact CB-CG1 4.5Å; E1061-I1085 HydrophobicContact CG-CG1 4.3Å
1086	I	89.7	Confident	74.7	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	161.6	171.6	54.7	173.7	0	0	0	111.2	V898 V899 L917 I1060 I1084 L1097	V898-I1086 HydrophobicContact CB-CB 4.37Å; V898-I1086 HydrophobicContact CG2-CB 4.24Å; V898-I1086 HydrophobicContact CG2-CG2 3.89Å; V899-I1086 CarbonylContact O-C 3.58Å; V899-I1086 VanDerWaalsContact O-CA 3.27Å; V899-I1086 WeakPolarHBondContact O-CA 3.33Å; L917-I1086 HydrophobicContact CD2-CD1 3.76Å; I1060-I1086 HydrophobicContact CB-CD1 4.46Å; I1060-I1086 HydrophobicContact CB-CG1 4Å; I1060-I1086 PolarHBondContact N-O 2.66Å; I1060-I1086 WeakPolarHBondContact O-CG1 3.34Å; I1060-I1086 PolarHBondContact O-N 2.85Å; I1060-I1086 VanDerWaalsContact O-O 3.09Å; I1084-I1086 HydrophobicContact CD1-CG2 3.74Å; I1084-I1086 HydrophobicContact CG1-CG2 3.92Å; I1086-L1097 HydrophobicContact CD1-CD2 4.1Å
1087	A	87.6	Confident	77.2	Confident	4 Å²	4	52.2 Å²	52.2	3%	0.033	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.4	164	0	0	0	0	0	110.8	V898 V899 I901 Y1056 Y1058	V898-A1087 WeakPolarHBondContact CB-O 3.18Å; V899-A1087 HydrophobicContact CB-CB 4.46Å; V899-A1087 PolarHBondContact N-O 3.16Å; V899-A1087 PolarHBondContact O-N 3.31Å; I901-A1087 HydrophobicContact CD1-CB 4.34Å; Y1056-A1087 HydrophobicContact CD1-CB 3.56Å; Y1056-A1087 HydrophobicContact CE1-CB 4.39Å; Y1056-A1087 HydrophobicContact CG-CB 4.12Å; Y1058-A1087 WeakPolarHBondContact O-CA 3.38Å
1088	A	88.2	Confident	79.2	Confident	9 Å²	9	46.9 Å²	46.9	7%	0.074	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	153.5	173.5	0	0	0	0	0	111.2	Y1058 Y1094	Y1058-A1088 PolarHBondContact O-N 2.71Å; A1088-Y1094 HydrophobicContact CB-CD2 4.32Å
1089	L	86	Confident	80.9	Confident	92 Å²	92	45.3 Å²	45.3	48%	0.482	23%	0.227	S	C	.	.	S	Bend	trans	-78.7	-29.4	-173.3	-61.9	174.8	0	0	0	113.6	T897 V899 L914	T897-L1089 HydrophobicContact CG2-CD1 4.18Å; T897-L1089 WeakPolarHBondContact O-CD1 3.27Å; T897-L1089 WeakPolarHBondContact O-CG 3.43Å; V899-L1089 HydrophobicContact CG2-CD2 4.01Å; L914-L1089 HydrophobicContact CD2-CD2 3.92Å
1090	D	85.8	Confident	82.4	Confident	61 Å²	61	39.5 Å²	39.5	33%	0.326	20%	0.201	S	C	.	.	S	Bend	trans	-144.6	168.5	178.5	72.9	64.4	0	0	0	112.1	N1092 D1093 Y1094	D1090-N1092 PolarHBondContact O-N 3.23Å; D1090-N1092 WeakPolarHBondContact OD1-CA 3.27Å; D1090-N1092 VanDerWaalsContact OD1-CB 3.32Å; D1090-N1092 WeakPolarHBondContact OD1-CB 3.32Å; D1090-N1092 PolarHBondContact OD1-N 3.48Å; D1090-D1093 PolarHBondContact OD1-N 3Å; D1090-Y1094 VanDerWaalsContact O-CB 3.31Å; D1090-Y1094 WeakPolarHBondContact O-CB 3.34Å; D1090-Y1094 PolarHBondContact O-N 3.44Å
1091	K	84.6	Confident	83.7	Confident	90 Å²	90	38.2 Å²	38.2	39%	0.391	19%	0.193	S	C	.	.	H	α-helix	trans	-61.8	-39.4	-177.5	-177.7	178.3	167.8	178.9	0	112.5	Y1058 Y1094 E1095	Y1058-K1091 HydrophobicContact CE1-CB 3.78Å; Y1058-K1091 HydrophobicContact CE1-CG 4.17Å; K1091-Y1094 WeakPolarHBondContact O-CB 3.2Å; K1091-Y1094 PolarHBondContact O-N 2.85Å; K1091-E1095 WeakPolarHBondContact CE-OE1 3.3Å; K1091-E1095 VanDerWaalsContact CE-OE2 3.29Å; K1091-E1095 WeakPolarHBondContact CE-OE2 3.46Å; K1091-E1095 HydrophobicContact CG-CG 4.35Å; K1091-E1095 IonicContact NZ-OE1 3.6Å; K1091-E1095 PolarHBondContact NZ-OE1 2.92Å; K1091-E1095 WeakPolarHBondContact O-CB 3.44Å; K1091-E1095 WeakPolarHBondContact O-CG 3.25Å; K1091-E1095 PolarHBondContact O-N 2.98Å
1092	N	80.9	Confident	84.5	Confident	67 Å²	67	34.1 Å²	34.1	36%	0.358	17%	0.173	S	C	.	.	H	α-helix	trans	-69.3	-51.2	-178.6	172.2	103.3	0	0	0	110.3	K947 D1090 Y1094 E1095 N1096	K947-N1092 PolarHBondContact NZ-ND2 3.29Å; D1090-N1092 PolarHBondContact O-N 3.23Å; D1090-N1092 WeakPolarHBondContact OD1-CA 3.27Å; D1090-N1092 VanDerWaalsContact OD1-CB 3.32Å; D1090-N1092 WeakPolarHBondContact OD1-CB 3.32Å; D1090-N1092 PolarHBondContact OD1-N 3.48Å; N1092-Y1094 PolarHBondContact O-N 2.81Å; N1092-E1095 PolarHBondContact O-N 3.02Å; N1092-N1096 PolarHBondContact ND2-ND2 2.74Å; N1092-N1096 VanDerWaalsContact ND2-ND2 3.11Å; N1092-N1096 PolarHBondContact O-N 3.09Å; N1092-N1096 PolarHBondContact O-ND2 3.39Å; N1092-N1096 PolarHBondContact OD1-ND2 2.93Å
1093	D	84.4	Confident	85.2	Confident	20 Å²	20	34.2 Å²	34.2	11%	0.107	17%	0.174	C	C	.	.	H	α-helix	trans	-65.5	-25.3	-179.3	-76	10.9	0	0	0	110.4	K944 K947 D1090 L1097	K944-D1093 IonicContact NZ-OD2 3.5Å; K944-D1093 PolarHBondContact NZ-OD2 2.84Å; K947-D1093 IonicContact NZ-OD1 2.62Å; K947-D1093 PolarHBondContact NZ-OD1 3.12Å; D1090-D1093 PolarHBondContact OD1-N 3Å; D1093-L1097 WeakPolarHBondContact O-CB 3.43Å; D1093-L1097 PolarHBondContact O-N 2.85Å; D1093-L1097 VanDerWaalsContact O-N 3.15Å
1094	Y	85.9	Confident	86	Confident	24 Å²	24	32.8 Å²	32.8	9%	0.094	17%	0.167	C	C	.	.	H	α-helix	trans	-67	-54.3	166.1	175	-101.8	0	0	0	113.9	Y1058 I1060 A1088 D1090 K1091 N1092 N1096 L1097 L1098	Y1058-Y1094 HydrophobicContact CD1-CD1 4.13Å; Y1058-Y1094 HydrophobicContact CD1-CD2 4.48Å; Y1058-Y1094 HydrophobicContact CD1-CG 4.03Å; Y1058-Y1094 HydrophobicContact CG-CD2 4.46Å; Y1058-Y1094 HydrophobicContact CG-CG 4.25Å; I1060-Y1094 HydrophobicContact CD1-CD2 3.99Å; I1060-Y1094 HydrophobicContact CD1-CE2 4.04Å; I1060-Y1094 HydrophobicContact CG1-CD2 4.02Å; I1060-Y1094 HydrophobicContact CG1-CE2 3.69Å; A1088-Y1094 HydrophobicContact CB-CD2 4.32Å; D1090-Y1094 VanDerWaalsContact O-CB 3.31Å; D1090-Y1094 WeakPolarHBondContact O-CB 3.34Å; D1090-Y1094 PolarHBondContact O-N 3.44Å; K1091-Y1094 WeakPolarHBondContact O-CB 3.2Å; K1091-Y1094 PolarHBondContact O-N 2.85Å; N1092-Y1094 PolarHBondContact O-N 2.81Å; Y1094-N1096 VanDerWaalsContact C-N 3.33Å; Y1094-N1096 PolarHBondContact O-N 2.9Å; Y1094-L1097 PolarHBondContact O-N 2.91Å; Y1094-L1098 HydrophobicContact CE1-CD2 4.46Å; Y1094-L1098 WeakPolarHBondContact O-CB 3.34Å; Y1094-L1098 PolarHBondContact O-N 2.89Å
1095	E	82.9	Confident	86.3	Confident	35 Å²	35	32.2 Å²	32.2	16%	0.164	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-40.1	-177.2	-75.7	176	145.9	0	0	111.5	L504 K1091 N1092 N1099	L504-E1095 HydrophobicContact CD2-CG 3.93Å; K1091-E1095 WeakPolarHBondContact CE-OE1 3.3Å; K1091-E1095 VanDerWaalsContact CE-OE2 3.29Å; K1091-E1095 WeakPolarHBondContact CE-OE2 3.46Å; K1091-E1095 HydrophobicContact CG-CG 4.35Å; K1091-E1095 IonicContact NZ-OE1 3.6Å; K1091-E1095 PolarHBondContact NZ-OE1 2.92Å; K1091-E1095 WeakPolarHBondContact O-CB 3.44Å; K1091-E1095 WeakPolarHBondContact O-CG 3.25Å; K1091-E1095 PolarHBondContact O-N 2.98Å; N1092-E1095 PolarHBondContact O-N 3.02Å; E1095-N1099 PolarHBondContact O-N 2.84Å; E1095-N1099 PolarHBondContact O-ND2 2.88Å
1096	N	84.5	Confident	86.2	Confident	77 Å²	77	31.3 Å²	31.3	41%	0.412	16%	0.159	S	C	.	.	H	α-helix	trans	-66.4	-49.7	174.6	-71.5	-84.9	0	0	0	110.9	N1092 Y1094 L1098 N1099 D1100	N1092-N1096 PolarHBondContact ND2-ND2 2.74Å; N1092-N1096 VanDerWaalsContact ND2-ND2 3.11Å; N1092-N1096 PolarHBondContact O-N 3.09Å; N1092-N1096 PolarHBondContact O-ND2 3.39Å; N1092-N1096 PolarHBondContact OD1-ND2 2.93Å; Y1094-N1096 VanDerWaalsContact C-N 3.33Å; Y1094-N1096 PolarHBondContact O-N 2.9Å; N1096-L1098 VanDerWaalsContact C-N 3.27Å; N1096-L1098 PolarHBondContact O-N 2.94Å; N1096-N1099 PolarHBondContact O-N 3.5Å; N1096-N1099 VanDerWaalsContact O-N 3.12Å; N1096-D1100 WeakPolarHBondContact O-CB 3.42Å; N1096-D1100 PolarHBondContact O-N 2.72Å
1097	L	88.5	Confident	86.2	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.016	16%	0.16	C	C	.	.	H	α-helix	trans	-58.1	-37.4	179	178.6	61.3	0	0	0	112.7	V898 L917 V919 I1060 I1086 D1093 Y1094 L1101	V898-L1097 HydrophobicContact CG1-CD2 4.19Å; L917-L1097 HydrophobicContact CD2-CD1 3.7Å; L917-L1097 HydrophobicContact CD2-CD2 3.76Å; L917-L1097 HydrophobicContact CD2-CG 4.39Å; V919-L1097 HydrophobicContact CG2-CD1 3.87Å; I1060-L1097 HydrophobicContact CD1-CD2 4.04Å; I1060-L1097 HydrophobicContact CD1-CG 4.25Å; I1086-L1097 HydrophobicContact CD1-CD2 4.1Å; D1093-L1097 WeakPolarHBondContact O-CB 3.43Å; D1093-L1097 PolarHBondContact O-N 2.85Å; D1093-L1097 VanDerWaalsContact O-N 3.15Å; Y1094-L1097 PolarHBondContact O-N 2.91Å; L1097-L1101 HydrophobicContact CD1-CD1 3.84Å; L1097-L1101 HydrophobicContact CD1-CG 3.89Å; L1097-L1101 HydrophobicContact CG-CD1 3.84Å; L1097-L1101 HydrophobicContact CG-CG 4.32Å; L1097-L1101 VanDerWaalsContact O-CB 3.27Å; L1097-L1101 WeakPolarHBondContact O-CB 3.29Å; L1097-L1101 WeakPolarHBondContact O-CG 3.37Å; L1097-L1101 PolarHBondContact O-N 2.88Å
1098	L	84.8	Confident	86.3	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.021	16%	0.162	C	C	.	.	H	α-helix	trans	-68	-42.1	177.2	-172.8	61.1	0	0	0	112.2	L504 W521 L525 I1048 P1050 Y1094 N1096 Y1102	L504-L1098 HydrophobicContact CD1-CD2 4.23Å; W521-L1098 HydrophobicContact CZ2-CG 4.45Å; L525-L1098 HydrophobicContact CD2-CD1 4Å; I1048-L1098 HydrophobicContact CD1-CD1 4.15Å; I1048-L1098 HydrophobicContact CG2-CD1 3.89Å; P1050-L1098 HydrophobicContact CG-CD1 4.33Å; Y1094-L1098 HydrophobicContact CE1-CD2 4.46Å; Y1094-L1098 WeakPolarHBondContact O-CB 3.34Å; Y1094-L1098 PolarHBondContact O-N 2.89Å; N1096-L1098 VanDerWaalsContact C-N 3.27Å; N1096-L1098 PolarHBondContact O-N 2.94Å; L1098-Y1102 WeakPolarHBondContact O-CB 3.32Å; L1098-Y1102 PolarHBondContact O-N 2.96Å
1099	N	84.9	Confident	86.2	Confident	64 Å²	64	31.4 Å²	31.4	34%	0.342	16%	0.158	S	C	.	.	H	α-helix	trans	-64.6	-41.3	173.8	-81.6	-70.2	0	0	0	112.5	W521 E1095 N1096 Q1103	W521-N1099 WeakPolarHBondContact CH2-OD1 3.45Å; E1095-N1099 PolarHBondContact O-N 2.84Å; E1095-N1099 PolarHBondContact O-ND2 2.88Å; N1096-N1099 PolarHBondContact O-N 3.5Å; N1096-N1099 VanDerWaalsContact O-N 3.12Å; N1099-Q1103 WeakPolarHBondContact O-CG 3.36Å; N1099-Q1103 PolarHBondContact O-N 2.7Å; N1099-Q1103 PolarHBondContact O-NE2 2.59Å; N1099-Q1103 VanDerWaalsContact O-NE2 3.13Å
1100	D	88.9	Confident	86.2	Confident	32 Å²	32	27.4 Å²	27.4	17%	0.171	14%	0.137	C	C	.	.	H	α-helix	trans	-68.4	-45.8	-179.6	-70	-28.5	0	0	0	111.5	V893 C894 N1096 Q1103 A1104	V893-D1100 HydrophobicContact CG1-CB 3.82Å; C894-D1100 HydrophobicContact CB-CB 4.13Å; C894-D1100 WeakPolarHBondContact CB-OD2 3.43Å; C894-D1100 PolarHBondContact SG-OD2 3.04Å; N1096-D1100 WeakPolarHBondContact O-CB 3.42Å; N1096-D1100 PolarHBondContact O-N 2.72Å; D1100-Q1103 PolarHBondContact O-N 2.88Å; D1100-A1104 WeakPolarHBondContact O-CB 3.12Å; D1100-A1104 PolarHBondContact O-N 3.2Å
1101	L	89.4	Confident	86.4	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-63.6	-39.6	175.4	-73.9	171.1	0	0	0	111.8	V919 I924 I1048 L1097 A1104 L1105	V919-L1101 HydrophobicContact CB-CD2 4.5Å; V919-L1101 HydrophobicContact CG1-CD2 3.83Å; V919-L1101 HydrophobicContact CG2-CD2 3.77Å; V919-L1101 HydrophobicContact CG2-CG 4.4Å; I924-L1101 HydrophobicContact CD1-CD2 3.61Å; I924-L1101 HydrophobicContact CG1-CD2 4.32Å; I1048-L1101 HydrophobicContact CD1-CB 3.58Å; I1048-L1101 HydrophobicContact CD1-CD1 4.47Å; L1097-L1101 HydrophobicContact CD1-CD1 3.84Å; L1097-L1101 HydrophobicContact CD1-CG 3.89Å; L1097-L1101 HydrophobicContact CG-CD1 3.84Å; L1097-L1101 HydrophobicContact CG-CG 4.32Å; L1097-L1101 VanDerWaalsContact O-CB 3.27Å; L1097-L1101 WeakPolarHBondContact O-CB 3.29Å; L1097-L1101 WeakPolarHBondContact O-CG 3.37Å; L1097-L1101 PolarHBondContact O-N 2.88Å; L1101-A1104 PolarHBondContact O-N 2.9Å; L1101-L1105 WeakPolarHBondContact O-CB 3.31Å; L1101-L1105 VanDerWaalsContact O-CG 3.3Å; L1101-L1105 WeakPolarHBondContact O-CG 2.74Å; L1101-L1105 PolarHBondContact O-N 3.23Å
1102	Y	85.2	Confident	86.5	Confident	9 Å²	9	21.1 Å²	21.1	4%	0.035	11%	0.111	C	C	.	.	H	α-helix	trans	-62.6	-47.2	174.7	164.6	-99.3	0	0	0	112	N520 W521 Y524 H575 L1098 A1104 L1105 C1106	N520-Y1102 PolarHBondContact ND2-OH 2.87Å; W521-Y1102 VanDerWaalsContact CA-CE2 3.47Å; W521-Y1102 HydrophobicContact CB-CE2 4.01Å; W521-Y1102 HydrophobicContact CD2-CD1 4.49Å; W521-Y1102 HydrophobicContact CD2-CD2 4.26Å; W521-Y1102 HydrophobicContact CD2-CE2 4.43Å; W521-Y1102 HydrophobicContact CD2-CG 4.28Å; W521-Y1102 AromaticContact CE3-CD1 3.34Å; W521-Y1102 HydrophobicContact CE3-CD1 3.34Å; W521-Y1102 AromaticContact CE3-CD2 3.81Å; W521-Y1102 HydrophobicContact CE3-CD2 3.81Å; W521-Y1102 AromaticContact CE3-CE1 3.52Å; W521-Y1102 HydrophobicContact CE3-CE1 3.52Å; W521-Y1102 AromaticContact CE3-CE2 3.98Å; W521-Y1102 HydrophobicContact CE3-CE2 3.98Å; W521-Y1102 AromaticContact CE3-CG 3.48Å; W521-Y1102 HydrophobicContact CE3-CG 3.48Å; W521-Y1102 VanDerWaalsContact CE3-CG 3.48Å; W521-Y1102 AromaticContact CE3-CZ 3.82Å; W521-Y1102 HydrophobicContact CH2-CD1 4.47Å; W521-Y1102 HydrophobicContact CH2-CG 4.42Å; W521-Y1102 AromaticContact CZ3-CD1 3.34Å; W521-Y1102 HydrophobicContact CZ3-CD1 3.34Å; W521-Y1102 HydrophobicContact CZ3-CD2 4.35Å; W521-Y1102 AromaticContact CZ3-CE1 3.92Å; W521-Y1102 HydrophobicContact CZ3-CE1 3.92Å; W521-Y1102 AromaticContact CZ3-CG 3.57Å; W521-Y1102 HydrophobicContact CZ3-CG 3.57Å; Y524-Y1102 HydrophobicContact CD2-CD2 4.05Å; Y524-Y1102 AromaticContact CD2-CE2 3.93Å; Y524-Y1102 HydrophobicContact CD2-CE2 3.93Å; H575-Y1102 AromaticContact NE2-CE1 3.86Å; L1098-Y1102 WeakPolarHBondContact O-CB 3.32Å; L1098-Y1102 PolarHBondContact O-N 2.96Å; Y1102-A1104 VanDerWaalsContact C-N 3.34Å; Y1102-A1104 PolarHBondContact O-N 2.97Å; Y1102-L1105 PolarHBondContact O-N 2.84Å; Y1102-C1106 VanDerWaalsContact O-CB 3.31Å; Y1102-C1106 WeakPolarHBondContact O-CB 3.37Å; Y1102-C1106 PolarHBondContact O-N 3.11Å
1103	Q	85.2	Confident	86.6	Confident	60 Å²	60	20.3 Å²	20.3	28%	0.28	10%	0.104	S	C	.	.	H	α-helix	trans	-60.2	-44.1	177.1	-79.1	170.6	87	0	0	111.3	N1099 D1100 C1106 E1107	N1099-Q1103 WeakPolarHBondContact O-CG 3.36Å; N1099-Q1103 PolarHBondContact O-N 2.7Å; N1099-Q1103 PolarHBondContact O-NE2 2.59Å; N1099-Q1103 VanDerWaalsContact O-NE2 3.13Å; D1100-Q1103 PolarHBondContact O-N 2.88Å; Q1103-C1106 PolarHBondContact O-N 3.13Å; Q1103-E1107 WeakPolarHBondContact O-CB 3.33Å; Q1103-E1107 PolarHBondContact O-N 3.31Å
1104	A	90.5	Very high	86.7	Confident	2 Å²	2	21.2 Å²	21.2	2%	0.017	11%	0.107	C	C	.	.	H	α-helix	trans	-66.4	-40.6	178.3	0	0	0	0	0	112.6	V893 V919 L1043 D1100 L1101 Y1102 T1108	V893-A1104 HydrophobicContact CG2-CB 4.45Å; V919-A1104 HydrophobicContact CG1-CB 4.3Å; L1043-A1104 HydrophobicContact CD1-CB 3.49Å; L1043-A1104 VanDerWaalsContact CD1-CB 3.49Å; D1100-A1104 WeakPolarHBondContact O-CB 3.12Å; D1100-A1104 PolarHBondContact O-N 3.2Å; L1101-A1104 PolarHBondContact O-N 2.9Å; Y1102-A1104 VanDerWaalsContact C-N 3.34Å; Y1102-A1104 PolarHBondContact O-N 2.97Å; A1104-T1108 WeakPolarHBondContact O-CB 3.43Å; A1104-T1108 PolarHBondContact O-N 2.87Å; A1104-T1108 PolarHBondContact O-OG1 3.39Å
1105	L	88.3	Confident	86.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63	-43.9	172.6	-76.9	174.5	0	0	0	112.2	Y524 L1043 C1046 I1048 L1101 Y1102 N1109	Y524-L1105 HydrophobicContact CD1-CB 4.02Å; Y524-L1105 HydrophobicContact CD1-CD1 4.01Å; Y524-L1105 HydrophobicContact CE1-CB 4.11Å; Y524-L1105 HydrophobicContact CG-CB 4.3Å; Y524-L1105 HydrophobicContact CG-CD1 4.3Å; L1043-L1105 HydrophobicContact CB-CD2 4.03Å; L1043-L1105 HydrophobicContact CD2-CD2 3.89Å; L1043-L1105 HydrophobicContact CD2-CG 4.32Å; L1043-L1105 WeakPolarHBondContact O-CD2 3.27Å; C1046-L1105 HydrophobicContact CB-CD2 3.78Å; C1046-L1105 WeakPolarHBondContact O-CD2 3.39Å; I1048-L1105 HydrophobicContact CD1-CD1 3.71Å; I1048-L1105 HydrophobicContact CG1-CD1 3.46Å; I1048-L1105 VanDerWaalsContact CG1-CD1 3.46Å; L1101-L1105 WeakPolarHBondContact O-CB 3.31Å; L1101-L1105 VanDerWaalsContact O-CG 3.3Å; L1101-L1105 WeakPolarHBondContact O-CG 2.74Å; L1101-L1105 PolarHBondContact O-N 3.23Å; Y1102-L1105 PolarHBondContact O-N 2.84Å; L1105-N1109 WeakPolarHBondContact O-CB 3.09Å; L1105-N1109 PolarHBondContact O-N 3.45Å; L1105-N1109 VanDerWaalsContact O-N 3.1Å; L1105-N1109 PolarHBondContact O-ND2 3.04Å
1106	C	84.8	Confident	86.6	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-58.9	-52.9	176.4	-175.6	0	0	0	0	110.5	N520 H575 Y1102 Q1103 N1109 L1110	N520-C1106 PolarHBondContact ND2-SG 3.48Å; H575-C1106 PolarHBondContact CD2-SG 2.96Å; Y1102-C1106 VanDerWaalsContact O-CB 3.31Å; Y1102-C1106 WeakPolarHBondContact O-CB 3.37Å; Y1102-C1106 PolarHBondContact O-N 3.11Å; Q1103-C1106 PolarHBondContact O-N 3.13Å; C1106-N1109 PolarHBondContact O-N 3.41Å; C1106-L1110 WeakPolarHBondContact O-CB 3.5Å; C1106-L1110 VanDerWaalsContact O-CG 3.25Å; C1106-L1110 WeakPolarHBondContact O-CG 3.43Å; C1106-L1110 PolarHBondContact O-N 3.35Å
1107	E	89.1	Confident	86.7	Confident	8 Å²	8	24.9 Å²	24.9	4%	0.037	12%	0.123	C	C	.	.	H	α-helix	trans	-61.3	-47.5	178.3	-170.8	-175.8	130.4	0	0	112	V579 N582 R891 N921 Q1103 N1109 L1110 V1111	V579-E1107 HydrophobicContact CG2-CG 4.19Å; N582-E1107 PolarHBondContact ND2-OE1 2.99Å; R891-E1107 IonicContact CZ-OE1 3.92Å; R891-E1107 IonicContact CZ-OE2 2.93Å; R891-E1107 VanDerWaalsContact CZ-OE2 3.3Å; R891-E1107 VanDerWaalsContact NH1-CD 3.28Å; R891-E1107 IonicContact NH1-OE1 2.67Å; R891-E1107 PolarHBondContact NH1-OE1 3.34Å; R891-E1107 IonicContact NH1-OE2 3.13Å; R891-E1107 PolarHBondContact NH1-OE2 2.96Å; R891-E1107 IonicContact NH2-OE1 3.22Å; R891-E1107 IonicContact NH2-OE2 2.69Å; R891-E1107 PolarHBondContact NH2-OE2 2.89Å; N921-E1107 WeakPolarHBondContact CB-OE1 3.15Å; N921-E1107 PolarHBondContact ND2-OE1 3.27Å; Q1103-E1107 WeakPolarHBondContact O-CB 3.33Å; Q1103-E1107 PolarHBondContact O-N 3.31Å; E1107-N1109 VanDerWaalsContact C-N 3.32Å; E1107-N1109 PolarHBondContact O-N 3.42Å; E1107-L1110 PolarHBondContact O-N 2.89Å; E1107-V1111 HydrophobicContact CG-CG2 4.11Å; E1107-V1111 VanDerWaalsContact O-CB 3.29Å; E1107-V1111 WeakPolarHBondContact O-CB 3.4Å; E1107-V1111 WeakPolarHBondContact O-CG2 3.04Å; E1107-V1111 PolarHBondContact O-N 3.34Å
1108	T	89.7	Confident	86.6	Confident	11 Å²	11	26 Å²	26	7%	0.067	13%	0.128	C	C	.	.	H	α-helix	trans	-56.4	-47.1	-178.9	-54.8	0	0	0	0	111.5	N921 D922 L1043 A1104 A1112	N921-T1108 PolarHBondContact O-OG1 3.22Å; D922-T1108 WeakPolarHBondContact CA-OG1 3.15Å; L1043-T1108 HydrophobicContact CB-CG2 4.11Å; L1043-T1108 WeakPolarHBondContact CB-OG1 3.39Å; A1104-T1108 WeakPolarHBondContact O-CB 3.43Å; A1104-T1108 PolarHBondContact O-N 2.87Å; A1104-T1108 PolarHBondContact O-OG1 3.39Å; T1108-A1112 WeakPolarHBondContact O-CB 3.38Å; T1108-A1112 PolarHBondContact O-N 3.27Å
1109	N	85.8	Confident	86.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-80.3	-30.1	-174.2	-69.3	-68.2	0	0	0	112.8	Y524 H553 L557 Y1044 R1045 L1105 C1106 E1107 F1113	Y524-N1109 WeakPolarHBondContact OH-CB 3.36Å; H553-N1109 PolarHBondContact CE1-OD1 3.43Å; L557-N1109 HydrophobicContact CD1-CB 4.18Å; L557-N1109 HydrophobicContact CD2-CB 3.93Å; Y1044-N1109 WeakPolarHBondContact CD2-OD1 3.27Å; R1045-N1109 PolarHBondContact N-OD1 3.21Å; L1105-N1109 WeakPolarHBondContact O-CB 3.09Å; L1105-N1109 PolarHBondContact O-N 3.45Å; L1105-N1109 VanDerWaalsContact O-N 3.1Å; L1105-N1109 PolarHBondContact O-ND2 3.04Å; C1106-N1109 PolarHBondContact O-N 3.41Å; E1107-N1109 VanDerWaalsContact C-N 3.32Å; E1107-N1109 PolarHBondContact O-N 3.42Å; N1109-F1113 WeakPolarHBondContact O-CB 3.38Å; N1109-F1113 PolarHBondContact O-N 3.38Å
1110	L	86	Confident	86.8	Confident	8 Å²	8	25.1 Å²	25.1	4%	0.042	12%	0.122	C	C	.	.	H	α-helix	trans	-68.1	-45	169.5	-71.6	176.5	0	0	0	111.4	I561 F564 V579 C1106 E1107 F1113 E1114	I561-L1110 HydrophobicContact CD1-CD2 3.83Å; I561-L1110 HydrophobicContact CG1-CD2 3.44Å; I561-L1110 VanDerWaalsContact CG1-CD2 3.44Å; F564-L1110 HydrophobicContact CE2-CD1 4.41Å; F564-L1110 HydrophobicContact CZ-CD1 4.22Å; V579-L1110 HydrophobicContact CG1-CB 4.43Å; V579-L1110 HydrophobicContact CG2-CB 3.65Å; V579-L1110 HydrophobicContact CG2-CD1 3.92Å; V579-L1110 HydrophobicContact CG2-CG 4.46Å; C1106-L1110 WeakPolarHBondContact O-CB 3.5Å; C1106-L1110 VanDerWaalsContact O-CG 3.25Å; C1106-L1110 WeakPolarHBondContact O-CG 3.43Å; C1106-L1110 PolarHBondContact O-N 3.35Å; E1107-L1110 PolarHBondContact O-N 2.89Å; L1110-F1113 WeakPolarHBondContact O-CB 3.38Å; L1110-F1113 PolarHBondContact O-N 3.34Å; L1110-E1114 WeakPolarHBondContact O-CB 3.32Å; L1110-E1114 WeakPolarHBondContact O-CG 3.27Å; L1110-E1114 PolarHBondContact O-N 3.15Å
1111	V	90.1	Very high	86.7	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-63.1	-43.1	175.2	170.3	0	0	0	0	111	V579 N582 L583 E1107 F1113 E1114 L1115	V579-V1111 HydrophobicContact CB-CG2 4.26Å; V579-V1111 HydrophobicContact CG1-CG2 3.87Å; V579-V1111 HydrophobicContact CG2-CG2 4.21Å; N582-V1111 HydrophobicContact CB-CG2 3.8Å; L583-V1111 HydrophobicContact CD2-CG1 4.29Å; E1107-V1111 HydrophobicContact CG-CG2 4.11Å; E1107-V1111 VanDerWaalsContact O-CB 3.29Å; E1107-V1111 WeakPolarHBondContact O-CB 3.4Å; E1107-V1111 WeakPolarHBondContact O-CG2 3.04Å; E1107-V1111 PolarHBondContact O-N 3.34Å; V1111-F1113 PolarHBondContact O-N 3.34Å; V1111-E1114 CarbonylContact O-C 3.5Å; V1111-E1114 PolarHBondContact O-N 2.99Å; V1111-L1115 HydrophobicContact CG1-CD1 3.74Å; V1111-L1115 HydrophobicContact CG1-CG 4.19Å; V1111-L1115 VanDerWaalsContact O-CB 3.29Å; V1111-L1115 WeakPolarHBondContact O-CB 3.44Å; V1111-L1115 WeakPolarHBondContact O-CG 3.27Å; V1111-L1115 PolarHBondContact O-N 3.15Å
1112	A	85.9	Confident	86.5	Confident	18 Å²	18	26.2 Å²	26.2	15%	0.149	13%	0.126	C	C	.	.	H	α-helix	trans	-71.3	-17.4	176.9	0	0	0	0	0	113.8	Y1044 T1108 K1116	Y1044-A1112 HydrophobicContact CD2-CB 3.39Å; Y1044-A1112 HydrophobicContact CE2-CB 3.28Å; Y1044-A1112 HydrophobicContact CG-CB 4.37Å; T1108-A1112 WeakPolarHBondContact O-CB 3.38Å; T1108-A1112 PolarHBondContact O-N 3.27Å; A1112-K1116 WeakPolarHBondContact O-CE 3.44Å; A1112-K1116 WeakPolarHBondContact O-CG 3.46Å
1113	F	84.1	Confident	86.6	Confident	49 Å²	49	27.4 Å²	27.4	22%	0.215	13%	0.133	C	C	.	.	H	α-helix	trans	-77.8	-52.1	165.9	178	-89.6	0	0	0	110.6	N558 I561 N1109 L1110 V1111 L1115 K1116	N558-F1113 WeakPolarHBondContact OD1-CZ 3.39Å; I561-F1113 HydrophobicContact CD1-CB 4.28Å; I561-F1113 HydrophobicContact CD1-CD1 3.36Å; I561-F1113 HydrophobicContact CD1-CD2 4.13Å; I561-F1113 HydrophobicContact CD1-CE1 3.6Å; I561-F1113 HydrophobicContact CD1-CE2 4.33Å; I561-F1113 HydrophobicContact CD1-CG 3.64Å; I561-F1113 HydrophobicContact CD1-CZ 4.08Å; N1109-F1113 WeakPolarHBondContact O-CB 3.38Å; N1109-F1113 PolarHBondContact O-N 3.38Å; L1110-F1113 WeakPolarHBondContact O-CB 3.38Å; L1110-F1113 PolarHBondContact O-N 3.34Å; V1111-F1113 PolarHBondContact O-N 3.34Å; F1113-L1115 PolarHBondContact O-N 3.01Å; F1113-L1115 VanDerWaalsContact O-N 3.09Å; F1113-K1116 WeakPolarHBondContact O-CB 3.02Å; F1113-K1116 PolarHBondContact O-N 2.83Å; F1113-K1116 VanDerWaalsContact O-N 3.09Å
1114	E	87.3	Confident	86.7	Confident	39 Å²	39	24.9 Å²	24.9	18%	0.182	12%	0.122	C	C	.	.	H	α-helix	trans	-66.9	-5.5	178.4	-73.2	-65.8	146.4	0	0	114.8	V579 L583 R590 Y594 L1110 V1111	V579-E1114 HydrophobicContact CG1-CG 4.48Å; L583-E1114 HydrophobicContact CD1-CB 3.86Å; L583-E1114 HydrophobicContact CD1-CG 4.31Å; L583-E1114 HydrophobicContact CD2-CB 4.15Å; R590-E1114 PolarHBondContact NE-O 3.27Å; R590-E1114 PolarHBondContact NH2-O 3.2Å; Y594-E1114 HydrophobicContact CD2-CG 3.99Å; Y594-E1114 WeakPolarHBondContact CD2-OE2 3.32Å; Y594-E1114 HydrophobicContact CE2-CG 3.57Å; L1110-E1114 WeakPolarHBondContact O-CB 3.32Å; L1110-E1114 WeakPolarHBondContact O-CG 3.27Å; L1110-E1114 PolarHBondContact O-N 3.15Å; V1111-E1114 CarbonylContact O-C 3.5Å; V1111-E1114 PolarHBondContact O-N 2.99Å
1115	L	86.4	Confident	86.4	Confident	55 Å²	55	26.8 Å²	26.8	29%	0.288	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-21.6	172.6	-78.5	173.4	0	0	0	114.1	L583 R590 V1111 F1113	L583-L1115 HydrophobicContact CD2-CD2 4.06Å; L583-L1115 HydrophobicContact CD2-CG 4.15Å; R590-L1115 PolarHBondContact NH1-O 3.41Å; R590-L1115 VanDerWaalsContact NH2-C 3.34Å; R590-L1115 PolarHBondContact NH2-O 2.97Å; V1111-L1115 HydrophobicContact CG1-CD1 3.74Å; V1111-L1115 HydrophobicContact CG1-CG 4.19Å; V1111-L1115 VanDerWaalsContact O-CB 3.29Å; V1111-L1115 WeakPolarHBondContact O-CB 3.44Å; V1111-L1115 WeakPolarHBondContact O-CG 3.27Å; V1111-L1115 PolarHBondContact O-N 3.15Å; F1113-L1115 PolarHBondContact O-N 3.01Å; F1113-L1115 VanDerWaalsContact O-N 3.09Å
1116	K	79.8	Confident	86.3	Confident	133 Å²	133	29.3 Å²	29.3	58%	0.578	14%	0.142	S	C	*	.			trans	-70.3	0	169.6	-65.9	168.7	-172.3	174.2	0	111	D554 R590 Y1044 A1112 F1113	D554-K1116 IonicContact OD1-NZ 2.98Å; D554-K1116 PolarHBondContact OD1-NZ 3.19Å; R590-K1116 PolarHBondContact NH2-OXT 3.29Å; Y1044-K1116 WeakPolarHBondContact OH-CE 3.02Å; Y1044-K1116 PolarHBondContact OH-NZ 2.87Å; A1112-K1116 WeakPolarHBondContact O-CE 3.44Å; A1112-K1116 WeakPolarHBondContact O-CG 3.46Å; F1113-K1116 WeakPolarHBondContact O-CB 3.02Å; F1113-K1116 PolarHBondContact O-N 2.83Å; F1113-K1116 VanDerWaalsContact O-N 3.09Å

Retrieved 1,116 of 1,116 residues in 777.8 ms (Link to these results)

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