A0A5K4F9P8_SCHMA Loading...

Transcriptional repressor scratch 1

AlphaFold DB , UniProt , Accession A0A5K4F9P8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 921 aa.

						>A0A5K4F9P8_SCHMA|A0A5K4F9P8
MVVQPPRRLNTKILDTRMNMLHDNSSGIYIDPDFQSNKFMMNANLADANMNTNNNDIDNNHKPFYKLFKHFPNCTSINGLNSISTNDIMPSENNVNSNSNSITSHGTSAFRTPSPIMDFMKEQFGITQSSPKQSLSNFTFPNDIYHRNTSIINEQINTQLQNTKMNITDLQSTIQLAGKLAQHFIALSNNNNNNNNNSMNSNFSLKSNSTDSQLGQYHHQQRQQSNEFHQPSLQRPYNCQQLIPSLVNSNHEMKLLNLNDTSNIQSLDQLTELLLYQQYYQNNNNNNKHIIPEIQYHNTSTTTTTNVNKLNYNIISNNYKASSIHLENLNQLDNSHFDETIQFTPLQSSLEESGCIDLSYNGSNKTSTNQNKQTSLNPSNNIVSSDTYSNNNVNNSIDNIEQHASESNELSKPLIQKSINELQHYSSISSFLTSTLTTGTMMMTTQTPTTISPTSFSTMTTIPTQSEIDFNSLPFPLNTDINLSSYPGTNDFFSSLLKLKISTADKLNEIFVNTATATTNSSSNNNSNTHNLKSNNNINASNDKHTNLSSMGEEYSHELSYDEYIQNQYNTNHTLNSSCSNSGSGISNKSHRNISNKSRHHHLQEHMTNDLTRAKNRKSGFQPGVTVGYTYDAFFISDGRSRKRVKNSHIKQSKLQKRQSYHSNNDDTSLQLISPQSNITNTSRSCSLDDLSNCTNEERVINNTLNNNSSKSHLSSITSSSTSLLVTLNETQTQRYSCPDCGKNYATSSNLSRHKQTHRSLDSQSARKCPQCGKAYVSMPALSMHLLTHDLKHQCDICGKAFSRPWLLQGHRRAHTGEKPYGCAHCGRAFADRSNLRAHMQTHSGMKQFECKQCHKNFALKSYLNKHLESGCMNKSDWSVMNSSLTSEEKSYFSPEPSEKLSKMEFHQQSDLSWSVTKLIN
					

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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	33.7	Very low	32.7	Very low	238 Å²	238	155.7 Å²	155.7	100%	1.172	80%	0.797	S	S	*	*				0	129.5	0	-72.6	171.5	164.4	0	0	108.8
2	V	31.8	Very low	32.6	Very low	131 Å²	131	154.4 Å²	154.4	79%	0.794	78%	0.781	S	S	*	*			trans	-99.7	104.4	-177.1	-178.7	0	0	0	0	110.1	Q4	V2-Q4 HydrophobicContact CG1-CG 4.03Å; V2-Q4 PolarHBondContact O-N 3.35Å
3	V	37.1	Very low	32.5	Very low	137 Å²	137	153.8 Å²	153.8	83%	0.83	78%	0.779	S	S	*	*			trans	-85.4	90.8	173.1	-176.6	0	0	0	0	108.8
4	Q	36.4	Very low	32.6	Very low	137 Å²	137	152.7 Å²	152.7	64%	0.64	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.7	131.5	173.4	-63.1	-169.2	22.4	0	0	110.3	V2	V2-Q4 HydrophobicContact CG1-CG 4.03Å; V2-Q4 PolarHBondContact O-N 3.35Å
5	P	34.9	Very low	32.4	Very low	111 Å²	111	151.5 Å²	151.5	72%	0.721	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-67.6	145.8	163.4	30.2	-33.1	0	0	0	109.5	R7	P5-R7 PolarHBondContact O-N 2.74Å
6	P	31.6	Very low	32.3	Very low	120 Å²	120	149.6 Å²	149.6	78%	0.779	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-68.9	125.3	-167.4	26.1	-34.7	0	0	0	112.6	R8	P6-R8 PolarHBondContact O-N 3.41Å
7	R	29	Very low	32.1	Very low	218 Å²	218	153.6 Å²	153.6	82%	0.823	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62.4	125.1	156.9	-61.6	-178.6	-177.7	-165.1	-0.1	107.8	P5	P5-R7 PolarHBondContact O-N 2.74Å
8	R	33.4	Very low	32.1	Very low	244 Å²	244	152.7 Å²	152.7	92%	0.921	77%	0.767	S	S	*	*			trans	-108.6	129.8	156.8	-86.1	-164.3	166.6	-159.4	-4.9	108.8	P6	P6-R8 PolarHBondContact O-N 3.41Å
9	L	31.5	Very low	31.9	Very low	146 Å²	146	151.7 Å²	151.7	76%	0.764	77%	0.765	S	S	*	*			trans	-75.5	150.3	-172	-66.1	82.5	0	0	0	110.7
10	N	26.4	Very low	31.8	Very low	118 Å²	118	152.6 Å²	152.6	63%	0.631	77%	0.768	S	S	*	*			trans	-84.6	128.2	152.2	-93.5	-40	0	0	0	108.3	Y569	N10-Y569 HydrophobicContact CB-CE1 3.93Å; N10-Y569 WeakPolarHBondContact ND2-CE1 3.36Å; N10-Y569 PolarHBondContact ND2-OH 2.98Å; N10-Y569 VanDerWaalsContact ND2-OH 3.1Å
11	T	34	Very low	31.8	Very low	113 Å²	113	152.8 Å²	152.8	69%	0.693	77%	0.771	S	S	*	*			trans	-138.9	121.2	158.3	39.3	0	0	0	0	108.5
12	K	31.3	Very low	31.6	Very low	140 Å²	140	150.3 Å²	150.3	61%	0.609	76%	0.756	S	S	*	*			trans	-94.7	124	168.6	-72.5	-179.6	177.5	-179.9	0	108.6	N570	K12-N570 PolarHBondContact O-ND2 3.08Å
13	I	31.8	Very low	31.7	Very low	146 Å²	146	150.7 Å²	150.7	75%	0.749	75%	0.753	S	S	*	*			trans	-137.7	110.4	158.3	-65.9	-172.5	0	0	0	108.2
14	L	33.2	Very low	31.1	Very low	139 Å²	139	150.9 Å²	150.9	73%	0.728	75%	0.75	S	S	*	*			trans	55.6	121.4	152.7	-55	174.3	0	0	0	117.7
15	D	29.4	Very low	30.9	Very low	135 Å²	135	149.5 Å²	149.5	72%	0.722	76%	0.755	S	S	*	*				65.1	135.9	69	-69.4	-49.2	0	0	0	113.3
16	T	31.3	Very low	30.6	Very low	121 Å²	121	150.6 Å²	150.6	74%	0.742	77%	0.766	S	S	*	*			cis	-151.2	143.6	13.4	-2.4	0	0	0	0	111.2
17	R	29.3	Very low	30.4	Very low	218 Å²	218	147.5 Å²	147.5	82%	0.823	76%	0.755	S	S	*	*			trans	169.7	136.1	130.8	-99.1	171.8	125.5	117.9	-0.3	113.8
18	M	32.3	Very low	30.3	Very low	136 Å²	136	144.5 Å²	144.5	67%	0.67	75%	0.754	S	S	*	*			trans	53.8	101.8	153.4	-54.1	-54.3	175.5	0	0	117.2
19	N	27.9	Very low	30	Very low	134 Å²	134	141.6 Å²	141.6	72%	0.717	74%	0.744	S	S	*	*				81.9	153.7	73.3	-78.5	-12.1	0	0	0	114.2
20	M	29.9	Very low	30	Very low	170 Å²	170	141.3 Å²	141.3	84%	0.837	74%	0.742	S	S	*	*			trans	91.1	120.2	172.8	-56.3	-61.8	178	0	0	116.9
21	L	32.6	Very low	30.3	Very low	157 Å²	157	141.6 Å²	141.6	82%	0.822	74%	0.744	S	S	*	*			trans	70.7	87.5	159	-54.9	176.9	0	0	0	118.2
22	H	29.5	Very low	30	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.856	74%	0.739	S	S	*	*				-46.4	132.1	117.7	-74.8	-122.3	0	0	0	108.9
23	D	31.9	Very low	30.1	Very low	139 Å²	139	140.3 Å²	140.3	74%	0.743	74%	0.744	S	S	*	*				-159.2	163.9	123	-131.3	-38.8	0	0	0	113.7
24	N	25.9	Very low	30.2	Very low	141 Å²	141	143.3 Å²	143.3	75%	0.754	75%	0.752	S	S	*	*			trans	-66.7	130.3	-179.9	-60.9	-88.1	0	0	0	111.7
25	S	31.4	Very low	30.1	Very low	108 Å²	108	144.6 Å²	144.6	76%	0.755	75%	0.754	S	S	*	*				172.7	119.1	129	43	0	0	0	0	112.5	G27	S25-G27 PolarHBondContact O-N 3.39Å; S25-G27 VanDerWaalsContact O-N 3.13Å
26	S	28.9	Very low	30.2	Very low	135 Å²	135	143.3 Å²	143.3	94%	0.944	76%	0.756	S	S	*	*			trans	-80.9	54.7	148.5	60.5	0	0	0	0	109.2
27	G	27.7	Very low	30.2	Very low	54 Å²	54	145.9 Å²	145.9	56%	0.557	77%	0.765	S	S	*	*			trans	-82.8	133.9	-176.3	0	0	0	0	0	110.9	S25 Y29	S25-G27 PolarHBondContact O-N 3.39Å; S25-G27 VanDerWaalsContact O-N 3.13Å; G27-Y29 PolarHBondContact O-N 3.23Å; G27-Y29 VanDerWaalsContact O-N 3.12Å
28	I	27.7	Very low	30.3	Very low	155 Å²	155	144 Å²	144	80%	0.795	76%	0.763	S	S	*	*			trans	-80	91.9	170.6	-61.7	170.9	0	0	0	106.9	I30	I28-I30 HydrophobicContact CG2-CD1 4.03Å; I28-I30 HydrophobicContact CG2-CG1 4.05Å
29	Y	26.3	Very low	30.2	Very low	184 Å²	184	148 Å²	148	72%	0.722	78%	0.777	S	S	*	*			trans	-86.9	116.4	169	-159.7	-87	0	0	0	108.4	G27 D31	G27-Y29 PolarHBondContact O-N 3.23Å; G27-Y29 VanDerWaalsContact O-N 3.12Å; Y29-D31 WeakPolarHBondContact CE1-OD1 3.47Å
30	I	31.6	Very low	30.3	Very low	140 Å²	140	147.5 Å²	147.5	72%	0.718	77%	0.772	S	S	*	*			trans	-122.1	129.6	167.2	-65	174.7	0	0	0	105	I28	I28-I30 HydrophobicContact CG2-CD1 4.03Å; I28-I30 HydrophobicContact CG2-CG1 4.05Å
31	D	31.9	Very low	30.4	Very low	124 Å²	124	148.7 Å²	148.7	66%	0.663	78%	0.778	S	S	*	*			trans	-61.2	136.9	-172.1	-64.4	-69.9	0	0	0	112.8	Y29	Y29-D31 WeakPolarHBondContact CE1-OD1 3.47Å
32	P	29	Very low	30.3	Very low	91 Å²	91	147.8 Å²	147.8	59%	0.591	77%	0.774	S	S	*	*	S	Bend	trans	-68	154.1	150	32.7	-31.9	0	0	0	109.6
33	D	33.7	Very low	30.4	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	77%	0.768	S	S	*	*			trans	61.8	73.7	172.8	-62.4	-36	0	0	0	117.7
34	F	32.5	Very low	30.4	Very low	209 Å²	209	144.6 Å²	144.6	92%	0.917	78%	0.776	S	S	*	*			trans	-131.9	96.4	136.4	-138	-93.1	0	0	0	111.8	S36	F34-S36 PolarHBondContact O-N 3.3Å
35	Q	31.9	Very low	30.6	Very low	165 Å²	165	145.7 Å²	145.7	77%	0.771	78%	0.78	S	S	*	*			trans	-75.4	118.4	178.4	-61	179.8	11.6	0	0	110.8
36	S	30.2	Very low	30.7	Very low	108 Å²	108	145.1 Å²	145.1	76%	0.755	78%	0.782	S	S	*	*			trans	179.3	82.9	144.8	-84.2	0	0	0	0	112.8	F34	F34-S36 PolarHBondContact O-N 3.3Å
37	N	31.8	Very low	30.6	Very low	175 Å²	175	146.2 Å²	146.2	94%	0.936	78%	0.778	S	S	*	*			trans	-176.1	111.7	136.4	-96.6	-33.5	0	0	0	109.5
38	K	32.1	Very low	30.9	Very low	179 Å²	179	148.5 Å²	148.5	78%	0.778	79%	0.791	S	S	*	*			trans	-112.1	101	-168.5	176.7	-166.5	172.8	-173.2	0	110.5
39	F	30.6	Very low	31	Very low	219 Å²	219	148.2 Å²	148.2	96%	0.961	79%	0.791	S	S	*	*			trans	-135.2	138.4	155.4	-95.1	-83.7	0	0	0	109.2
40	M	28.5	Very low	31.2	Very low	125 Å²	125	147 Å²	147	62%	0.616	79%	0.794	S	S	*	*			trans	-115.5	144.4	-172.3	-59.1	171.7	68.2	0	0	110.2	N42	M40-N42 WeakPolarHBondContact CE-OD1 3.46Å
41	M	33	Very low	31.2	Very low	195 Å²	195	147.2 Å²	147.2	96%	0.961	80%	0.797	S	S	*	*			trans	-135.1	141.8	135.3	-79	-157.7	166.9	0	0	108.8
42	N	31.1	Very low	31	Very low	137 Å²	137	147.5 Å²	147.5	73%	0.733	80%	0.803	S	S	*	*			trans	-92.9	157.4	-171	-79.9	-15.3	0	0	0	112.1	M40	M40-N42 WeakPolarHBondContact CE-OD1 3.46Å
43	A	31.5	Very low	31.2	Very low	89 Å²	89	150 Å²	150	74%	0.736	81%	0.811	S	S	*	*			trans	-68.7	158.7	167.9	0	0	0	0	0	112.2
44	N	31.4	Very low	31.1	Very low	169 Å²	169	149.3 Å²	149.3	90%	0.904	81%	0.808	S	S	*	*			trans	-113.8	121.5	150.8	-85.2	-40.6	0	0	0	107.9
45	L	28.9	Very low	31	Very low	163 Å²	163	145.9 Å²	145.9	85%	0.853	80%	0.799	S	S	*	*			trans	-119.5	132.2	167.3	-149.9	79.9	0	0	0	106.5
46	A	34.1	Very low	31.1	Very low	97 Å²	97	146.4 Å²	146.4	80%	0.802	81%	0.807	S	S	*	*			trans	-151.6	130.6	176	0	0	0	0	0	109.4
47	D	27.7	Very low	31.1	Very low	158 Å²	158	148.2 Å²	148.2	85%	0.845	81%	0.807	S	S	*	*			trans	-85.5	154.6	-166.7	-49.6	-88.7	0	0	0	114
48	A	33.1	Very low	31.3	Very low	102 Å²	102	147.3 Å²	147.3	84%	0.843	80%	0.802	S	S	*	*			trans	-153.2	127	152.7	0	0	0	0	0	110.7
49	N	29.5	Very low	31.2	Very low	148 Å²	148	144.3 Å²	144.3	79%	0.791	80%	0.795	S	S	*	*			trans	-60.5	160.1	172.3	-69.4	-59.5	0	0	0	112.3
50	M	31.7	Very low	31.3	Very low	159 Å²	159	141.2 Å²	141.2	78%	0.783	79%	0.788	S	S	*	*				-170.5	135	105.5	-93.8	-52.3	166.8	0	0	114.1
51	N	31.6	Very low	31.5	Very low	145 Å²	145	143.5 Å²	143.5	78%	0.775	80%	0.797	S	S	*	*			trans	52.2	115	153.4	-64.2	-9.9	0	0	0	122.1
52	T	26.9	Very low	31.3	Very low	129 Å²	129	142.5 Å²	142.5	79%	0.791	79%	0.787	S	S	*	*			trans	-65.4	155.8	152.8	49.8	0	0	0	0	113.1
53	N	33.3	Very low	31.4	Very low	143 Å²	143	141.8 Å²	141.8	77%	0.765	79%	0.79	S	S	*	*			trans	-155.8	125.4	141.8	-114	-20.5	0	0	0	112.2
54	N	31.2	Very low	31.2	Very low	122 Å²	122	146.5 Å²	146.5	65%	0.652	79%	0.794	S	S	*	*			trans	32.3	109.8	143.7	-55.7	-21.9	0	0	0	118.4
55	N	31.4	Very low	30.9	Very low	137 Å²	137	148.7 Å²	148.7	73%	0.733	79%	0.791	S	S	*	*				80.2	96.6	88.5	-66.1	-15.3	0	0	0	113.1
56	D	34	Very low	30.8	Very low	175 Å²	175	149.4 Å²	149.4	94%	0.936	79%	0.787	S	S	*	*			trans	-129.1	135.4	142.9	-99.1	-45.1	0	0	0	107.9
57	I	30.6	Very low	30.5	Very low	147 Å²	147	151.5 Å²	151.5	75%	0.754	78%	0.784	S	S	*	*			trans	-113.7	118.1	179.7	-62.7	170.4	0	0	0	106.9
58	D	34.7	Very low	30.5	Very low	156 Å²	156	153.8 Å²	153.8	83%	0.834	79%	0.787	S	S	*	*			trans	-149.3	161.7	140.8	-137.9	-21.7	0	0	0	113.5
59	N	31.4	Very low	30.5	Very low	116 Å²	116	156.5 Å²	156.5	62%	0.62	78%	0.78	S	S	*	*			trans	-110	140.7	-161.5	-62.4	-98.1	0	0	0	111.2
60	N	31.7	Very low	30.6	Very low	153 Å²	153	155.2 Å²	155.2	82%	0.818	77%	0.769	S	S	*	*				-171.2	158.6	125.5	-103.9	-54.3	0	0	0	114.5
61	H	31.9	Very low	30.5	Very low	173 Å²	173	156.1 Å²	156.1	80%	0.801	77%	0.769	S	S	*	*			trans	64.1	61.8	171.1	-77.9	-76.1	0	0	0	120.4
62	K	29.8	Very low	30.7	Very low	174 Å²	174	153.9 Å²	153.9	76%	0.757	76%	0.762	S	S	*	*			trans	4.2	130.4	133.8	-64.4	171.6	175.2	173.9	0	119	F64	K62-F64 HydrophobicContact CD-CE2 4.37Å
63	P	32.6	Very low	30.9	Very low	123 Å²	123	154.8 Å²	154.8	80%	0.799	76%	0.762	S	S	*	*			trans	-83.8	166.8	148.7	36.7	-33.4	0	0	0	111.6
64	F	27.4	Very low	30.7	Very low	187 Å²	187	153.3 Å²	153.3	82%	0.82	76%	0.762	S	S	*	*			trans	-142.1	154.2	170.3	-112.3	-89.9	0	0	0	113.4	K62	K62-F64 HydrophobicContact CD-CE2 4.37Å
65	Y	24.9	Very low	30.6	Very low	215 Å²	215	153.7 Å²	153.7	84%	0.843	77%	0.769	S	S	*	*			trans	-133.6	166	-170.9	-118.6	-82.5	0	0	0	110.4
66	K	28.3	Very low	30.6	Very low	178 Å²	178	151.6 Å²	151.6	77%	0.774	77%	0.765	S	S	*	*			trans	82.1	149	145.5	-98.4	175.3	-179.4	174.4	0	121.6
67	L	26.6	Very low	30.5	Very low	141 Å²	141	150.5 Å²	150.5	74%	0.738	76%	0.758	S	S	*	*			trans	72.6	134.5	160.8	-62.5	156.1	0	0	0	114.9
68	F	28.6	Very low	30.4	Very low	206 Å²	206	151.1 Å²	151.1	90%	0.904	76%	0.762	S	S	*	*			cis	-128.6	-178.4	49.4	-102.7	-94.2	0	0	0	116.9
69	K	31.8	Very low	30.2	Very low	160 Å²	160	146.7 Å²	146.7	70%	0.696	75%	0.754	S	S	*	*			trans	-141	157.1	-174.6	-156.7	-178.5	179.9	-161.8	0	109.4
70	H	32.9	Very low	30.2	Very low	120 Å²	120	148.9 Å²	148.9	56%	0.556	77%	0.765	S	S	*	*			trans	94.2	123	157.6	-73.5	-65.6	0	0	0	123.2
71	F	29.3	Very low	30.2	Very low	179 Å²	179	148.8 Å²	148.8	79%	0.785	76%	0.764	S	S	*	*			trans	76.6	156.8	138.1	-67.1	-38.9	0	0	0	121.5
72	P	36.1	Very low	30	Very low	97 Å²	97	145.6 Å²	145.6	63%	0.63	76%	0.761	S	S	*	*			cis	-144.1	-173.3	-30.6	38.6	-19.9	0	0	0	116.5
73	N	29.6	Very low	30	Very low	148 Å²	148	145.4 Å²	145.4	79%	0.791	77%	0.767	S	S	*	*			trans	101.3	149.7	151.5	-64.8	-16.2	0	0	0	122.2
74	C	29.6	Very low	29.9	Very low	112 Å²	112	144.1 Å²	144.1	76%	0.757	76%	0.761	S	S	*	*			trans	63.5	107.6	176.8	-56	0	0	0	0	115.8
75	T	29.2	Very low	29.9	Very low	130 Å²	130	140.7 Å²	140.7	80%	0.798	76%	0.755	S	S	*	*			cis	57.9	135.4	48	83.9	0	0	0	0	113.1
76	S	31.5	Very low	30	Very low	93 Å²	93	137.1 Å²	137.1	65%	0.65	75%	0.751	S	S	*	*			cis	-161.4	171.2	27.9	-36.7	0	0	0	0	112.9
77	I	31.4	Very low	30.1	Very low	153 Å²	153	135 Å²	135	79%	0.785	75%	0.748	S	S	*	*			trans	72.3	148.6	156.9	-61.9	158.1	0	0	0	116.8
78	N	29.5	Very low	30.3	Very low	159 Å²	159	135.7 Å²	135.7	85%	0.85	75%	0.751	S	S	*	*			cis	172	147	-46.3	-94.6	-3.8	0	0	0	107.6
79	G	31.2	Very low	30.4	Very low	64 Å²	64	133.9 Å²	133.9	66%	0.66	75%	0.747	S	S	*	*			trans	135.5	92.9	176.5	0	0	0	0	0	112.3
80	L	30.6	Very low	30.5	Very low	162 Å²	162	131.1 Å²	131.1	85%	0.848	75%	0.745	S	S	*	*				67.7	127.9	78.6	-63	178.5	0	0	0	112.7
81	N	32.2	Very low	30.5	Very low	150 Å²	150	130.1 Å²	130.1	80%	0.802	75%	0.752	S	S	*	*			cis	-134.6	157.9	15.7	-79.4	-52.6	0	0	0	114
82	S	27	Very low	30.6	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	75%	0.749	S	S	*	*			trans	-108.4	143.5	161.2	50.8	0	0	0	0	110.6
83	I	30.9	Very low	30.5	Very low	170 Å²	170	130.1 Å²	130.1	87%	0.872	75%	0.75	S	S	*	*			trans	-179.7	147.5	162.6	-99.3	147.8	0	0	0	105.4
84	S	30.1	Very low	30.6	Very low	96 Å²	96	129.3 Å²	129.3	67%	0.671	75%	0.746	S	S	*	*			cis	167.2	109.4	-24.9	172.8	0	0	0	0	103.8
85	T	26.2	Very low	30.9	Very low	115 Å²	115	129.2 Å²	129.2	71%	0.706	74%	0.742	S	S	*	*			trans	2.6	141	160.4	50	0	0	0	0	121.7
86	N	27.1	Very low	31.1	Very low	139 Å²	139	129.5 Å²	129.5	74%	0.743	74%	0.738	S	S	*	*			trans	75.4	148.5	159.2	-49	-8.8	0	0	0	114.6
87	D	30.2	Very low	31.3	Very low	135 Å²	135	128.8 Å²	128.8	72%	0.722	73%	0.733	S	S	*	*			cis	-161.5	167.9	35.9	-119	-43.6	0	0	0	114.2
88	I	31.7	Very low	31.4	Very low	155 Å²	155	128.3 Å²	128.3	80%	0.795	73%	0.732	S	S	*	*			trans	73.9	149.8	154.9	-66.2	160.4	0	0	0	120.2
89	M	29.6	Very low	31.7	Very low	168 Å²	168	125 Å²	125	83%	0.828	72%	0.722	S	S	*	*			trans	-108.1	-158	-175.5	-51.6	-179.3	68.4	0	0	110.7
90	P	35.5	Very low	31.8	Very low	101 Å²	101	129.7 Å²	129.7	66%	0.656	73%	0.731	S	S	*	*			cis	-138.1	-166.5	-10.4	42.5	-23.2	0	0	0	115.3
91	S	32.1	Very low	31.7	Very low	100 Å²	100	127 Å²	127	70%	0.699	73%	0.726	S	S	*	*			trans	73.2	151.1	156.5	80.8	0	0	0	0	116.8
92	E	31.6	Very low	31.8	Very low	153 Å²	153	126.8 Å²	126.8	72%	0.715	72%	0.723	S	S	*	*			cis	-161.8	164.7	-4.4	-135.3	172.7	-115.8	0	0	111.2
93	N	32.7	Very low	31.9	Very low	122 Å²	122	127.8 Å²	127.8	65%	0.652	73%	0.725	S	S	*	*			trans	66.1	141.4	154.5	-64.6	-35.5	0	0	0	119.6
94	N	32.1	Very low	32	Very low	131 Å²	131	124.5 Å²	124.5	70%	0.701	72%	0.718	S	S	*	*			cis	-164.7	166.7	-14	-141.3	-23.5	0	0	0	111
95	V	36.5	Very low	32.1	Very low	111 Å²	111	129 Å²	129	67%	0.673	73%	0.728	S	S	*	*			trans	58	131.6	152.6	166.8	0	0	0	0	118
96	N	32.9	Very low	32.4	Very low	136 Å²	136	127.3 Å²	127.3	73%	0.727	73%	0.733	S	S	*	*			cis	-171.6	174.9	-3.6	-107.9	3.6	0	0	0	106.8
97	S	37.1	Very low	32.5	Very low	78 Å²	78	127.2 Å²	127.2	55%	0.545	74%	0.738	S	S	.	*			cis	-172.9	124.2	-25.7	51.3	0	0	0	0	106.1
98	N	33.2	Very low	32.5	Very low	142 Å²	142	126.3 Å²	126.3	76%	0.759	74%	0.741	S	S	*	*				178.5	121.1	104.6	-89.6	-19.1	0	0	0	107.1
99	S	35	Very low	32.5	Very low	90 Å²	90	122.8 Å²	122.8	63%	0.629	74%	0.736	S	S	*	*				69.9	128	80.8	82.6	0	0	0	0	112.5
100	N	33.6	Very low	32.4	Very low	162 Å²	162	123.8 Å²	123.8	87%	0.866	74%	0.736	S	S	*	*			cis	-124.6	172	22.5	-76.7	-52.6	0	0	0	115.4
101	S	28.7	Very low	32	Very low	105 Å²	105	129.9 Å²	129.9	73%	0.734	75%	0.746	S	S	*	*			trans	-124.1	-154.2	-167.2	59.6	0	0	0	0	112.7
102	I	33.1	Very low	32.1	Very low	146 Å²	146	131.8 Å²	131.8	75%	0.749	75%	0.753	S	S	*	*			trans	89.1	90.1	-177	-54.2	164.6	0	0	0	111.6
103	T	30	Very low	32.3	Very low	128 Å²	128	129.5 Å²	129.5	79%	0.785	75%	0.752	S	S	*	*				61.8	139.2	72.3	76	0	0	0	0	113.3
104	S	33.8	Very low	32.3	Very low	102 Å²	102	128.3 Å²	128.3	71%	0.713	75%	0.753	S	S	*	*			cis	-153.4	-178.2	20.6	65	0	0	0	0	114.2
105	H	32.2	Very low	32.4	Very low	191 Å²	191	126.9 Å²	126.9	88%	0.884	75%	0.751	S	S	*	*			trans	-23.1	147.8	179	-47.9	-76.3	0	0	0	121.3
106	G	32.6	Very low	32.1	Very low	79 Å²	79	129 Å²	129	81%	0.814	76%	0.757	S	S	*	*			trans	173.8	112.9	161.9	0	0	0	0	0	113.4
107	T	28.9	Very low	32.1	Very low	137 Å²	137	129.2 Å²	129.2	84%	0.84	76%	0.755	S	S	*	*			trans	-80.7	147.8	-174.8	44.2	0	0	0	0	114.9
108	S	29.9	Very low	32.1	Very low	115 Å²	115	131.3 Å²	131.3	80%	0.804	76%	0.76	S	S	*	*			trans	83.5	146	152.3	81.1	0	0	0	0	120.9
109	A	30.4	Very low	32.1	Very low	82 Å²	82	132.9 Å²	132.9	68%	0.678	76%	0.761	S	S	*	*			trans	54.7	116.1	151.5	0	0	0	0	0	122.1
110	F	29.3	Very low	32.2	Very low	189 Å²	189	135.7 Å²	135.7	83%	0.829	77%	0.766	S	S	*	*			trans	49	106.3	137.3	-75	-91.4	0	0	0	121.8
111	R	27.2	Very low	32.5	Very low	229 Å²	229	137 Å²	137	86%	0.864	76%	0.763	S	S	*	*			trans	45.4	113.3	136.4	-66.7	-175	172.6	-162	-0.8	119.7
112	T	32.3	Very low	32.9	Very low	140 Å²	140	140 Å²	140	86%	0.859	77%	0.766	S	S	*	*			trans	-172.9	179	138.3	19.9	0	0	0	0	108.5
113	P	36.8	Very low	33.3	Very low	104 Å²	104	139.5 Å²	139.5	68%	0.675	76%	0.761	S	S	*	*				-136.6	-162.6	-79.5	39.5	-18.2	0	0	0	114.4
114	S	31.8	Very low	33.7	Very low	97 Å²	97	142.8 Å²	142.8	68%	0.678	76%	0.764	S	S	*	*			trans	70.5	175.4	149.1	-74.1	0	0	0	0	119.4
115	P	35	Very low	33.5	Very low	102 Å²	102	141.5 Å²	141.5	66%	0.662	77%	0.767	S	S	*	*			cis	-133.3	130.3	-25.5	24.8	-4.7	0	0	0	113.9
116	I	29.7	Very low	33.4	Very low	156 Å²	156	140.7 Å²	140.7	80%	0.8	77%	0.767	S	S	*	*	S	Bend	trans	-141.8	-36.8	163.4	-67.8	-171.5	0	0	0	113.6
117	M	33.3	Very low	33.2	Very low	139 Å²	139	143.6 Å²	143.6	69%	0.685	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-88.5	-6	-166.7	-74.7	-64.2	-67.2	0	0	116.6	F119	M117-F119 VanDerWaalsContact C-N 3.26Å; M117-F119 PolarHBondContact O-N 3.21Å
118	D	36.6	Very low	33.2	Very low	123 Å²	123	146.2 Å²	146.2	66%	0.658	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-74.7	-15	-176.4	-60	-56.5	0	0	0	113.6
119	F	34.7	Very low	33.2	Very low	175 Å²	175	146.6 Å²	146.6	77%	0.768	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-76.8	-18.6	-179.7	-168.6	-104.8	0	0	0	114.5	M117	M117-F119 VanDerWaalsContact C-N 3.26Å; M117-F119 PolarHBondContact O-N 3.21Å
120	M	37.3	Very low	32.9	Very low	148 Å²	148	148.1 Å²	148.1	73%	0.729	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-101.8	4.4	-170.8	-70	-169.6	172.7	0	0	115.2
121	K	40	Very low	33	Very low	189 Å²	189	145 Å²	145	82%	0.822	78%	0.779	S	S	*	*	S	Bend	trans	-88.2	-7.4	178.9	-87.2	-178.1	173.8	175.7	0	115.3
122	E	36.7	Very low	32.9	Very low	169 Å²	169	143.7 Å²	143.7	79%	0.79	78%	0.78	S	S	*	*	S	Bend	trans	-96.7	-11.7	-168.8	-163.1	165.4	-150.4	0	0	114.5
123	Q	41.9	Very low	32.7	Very low	136 Å²	136	146.1 Å²	146.1	64%	0.636	78%	0.781	S	S	*	*	S	Bend	trans	-98.4	-28.5	-166.7	-70.5	-65.7	-66.1	0	0	116.4
124	F	36.6	Very low	32.1	Very low	197 Å²	197	146.5 Å²	146.5	86%	0.864	79%	0.786	S	S	*	*			trans	-140.9	81.7	-171.7	-60.5	-71	0	0	0	112.9
125	G	30.2	Very low	31.8	Very low	74 Å²	74	149.2 Å²	149.2	76%	0.763	79%	0.792	S	S	*	*			trans	-89.4	138	167.6	0	0	0	0	0	112.2
126	I	29.7	Very low	31.2	Very low	175 Å²	175	148.7 Å²	148.7	90%	0.897	79%	0.791	S	S	*	*			trans	-159.4	149.7	153.2	-101.8	150.2	0	0	0	107.7
127	T	29	Very low	31	Very low	140 Å²	140	148.1 Å²	148.1	86%	0.859	79%	0.79	S	S	*	*			trans	-98.6	169.3	-161.8	45	0	0	0	0	115
128	Q	28.3	Very low	30.6	Very low	191 Å²	191	151 Å²	151	89%	0.893	80%	0.799	S	S	*	*			trans	-76.5	150.1	-176	-58	172.1	-4.3	0	0	113.5
129	S	30.7	Very low	30.1	Very low	124 Å²	124	151 Å²	151	87%	0.867	80%	0.804	S	S	*	*			trans	-152.8	144.7	146.7	63.5	0	0	0	0	111.6
130	S	24.4	Very low	29.7	Very low	113 Å²	113	152.3 Å²	152.3	79%	0.79	81%	0.809	S	S	*	*			trans	-142.1	167.4	171.3	73.4	0	0	0	0	107.6
131	P	31.5	Very low	29.3	Very low	124 Å²	124	149.4 Å²	149.4	81%	0.805	80%	0.802	S	S	*	*				-151.7	-164.1	75.2	40.7	-19.4	0	0	0	114.9
132	K	25.1	Very low	28.7	Very low	201 Å²	201	147.4 Å²	147.4	87%	0.874	80%	0.8	S	S	*	*			trans	-82.7	155.4	-176.4	-54.3	167.5	-176	173.1	0	112.8
133	Q	28.3	Very low	28.4	Very low	192 Å²	192	145 Å²	145	90%	0.897	79%	0.792	S	S	*	*			trans	-127.7	151.4	149.5	-76.3	-169.3	-6.6	0	0	110.1
134	S	22.3	Very low	27.9	Very low	111 Å²	111	144 Å²	144	78%	0.776	79%	0.79	S	S	*	*			trans	-107.6	132	-178.6	53.3	0	0	0	0	111
135	L	26.6	Very low	27.6	Very low	154 Å²	154	143.8 Å²	143.8	81%	0.806	79%	0.785	S	S	*	*			trans	-131.8	128.9	161.6	-113.1	95.1	0	0	0	111.2
136	S	22.6	Very low	27.7	Very low	92 Å²	92	147.6 Å²	147.6	64%	0.643	78%	0.783	S	S	*	*			trans	-77.8	167.3	158.1	48.2	0	0	0	0	110.3
137	N	24.2	Very low	27.9	Very low	144 Å²	144	148.7 Å²	148.7	77%	0.77	78%	0.775	S	S	*	*			trans	70.8	117.6	-177.8	-45.5	-31.1	0	0	0	114.6
138	F	26.1	Very low	28	Very low	200 Å²	200	146.1 Å²	146.1	88%	0.877	76%	0.757	S	S	*	*				-158.6	153.9	122.6	-110.2	-70.9	0	0	0	110.5
139	T	25.7	Very low	28.3	Very low	122 Å²	122	140.1 Å²	140.1	75%	0.748	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-89.1	154.2	-171.9	37.6	0	0	0	0	113.1	P141	T139-P141 WeakPolarHBondContact O-CD 3.33Å
140	F	25.6	Very low	28.7	Very low	203 Å²	203	137.6 Å²	137.6	89%	0.89	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-77.2	123.4	173.8	-83.9	-92.6	0	0	0	111.8
141	P	29.3	Very low	29.4	Very low	87 Å²	87	136.1 Å²	136.1	57%	0.565	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-91.3	139.2	168	-3.7	24.6	0	0	0	111.4	T139 D143	T139-P141 WeakPolarHBondContact O-CD 3.33Å; P141-D143 VanDerWaalsContact C-N 3.32Å; P141-D143 PolarHBondContact O-N 3.28Å
142	N	27.6	Very low	29.9	Very low	146 Å²	146	134.4 Å²	134.4	78%	0.781	68%	0.681	S	S	*	*	S	Bend	trans	-80.2	-8.6	-177.4	-78.6	-48.6	0	0	0	114.3	I144 Y145	N142-I144 VanDerWaalsContact C-N 3.27Å; N142-I144 PolarHBondContact O-N 3.14Å; N142-I144 VanDerWaalsContact O-N 3.13Å; N142-Y145 PolarHBondContact O-N 3.45Å
143	D	30.1	Very low	30.6	Very low	118 Å²	118	129.1 Å²	129.1	63%	0.631	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-16.3	-161.5	-51.3	-71.4	0	0	0	115.3	P141 Y145 H146	P141-D143 VanDerWaalsContact C-N 3.32Å; P141-D143 PolarHBondContact O-N 3.28Å; D143-Y145 PolarHBondContact O-N 3.25Å; D143-H146 PolarHBondContact O-N 3.21Å
144	I	32.4	Very low	31.9	Very low	116 Å²	116	126.1 Å²	126.1	60%	0.595	65%	0.648	S	S	*	*	H	α-helix	trans	-64.5	-30.8	179.6	-61.4	173.9	0	0	0	111.3	N142 H146 N148	N142-I144 VanDerWaalsContact C-N 3.27Å; N142-I144 PolarHBondContact O-N 3.14Å; N142-I144 VanDerWaalsContact O-N 3.13Å; I144-H146 PolarHBondContact O-N 3.28Å; I144-N148 PolarHBondContact O-N 3.28Å
145	Y	29.1	Very low	32.8	Very low	193 Å²	193	126.4 Å²	126.4	76%	0.757	64%	0.637	S	S	*	*	H	α-helix	trans	-67.2	-33.3	-178.6	-118	-86	0	0	0	113.2	N142 D143 T149	N142-Y145 PolarHBondContact O-N 3.45Å; D143-Y145 PolarHBondContact O-N 3.25Å; Y145-T149 PolarHBondContact O-N 3.42Å; Y145-T149 PolarHBondContact O-OG1 3.27Å
146	H	32.9	Very low	33.8	Very low	154 Å²	154	123.7 Å²	123.7	71%	0.713	62%	0.622	S	S	*	*	H	α-helix	trans	-77.7	-38.6	178.8	-86	-71.8	0	0	0	113.1	D143 I144 T149 S150	D143-H146 PolarHBondContact O-N 3.21Å; I144-H146 PolarHBondContact O-N 3.28Å; H146-T149 WeakPolarHBondContact CA-OG1 3.1Å; H146-T149 PolarHBondContact O-OG1 3.11Å; H146-T149 VanDerWaalsContact O-OG1 3.09Å; H146-S150 PolarHBondContact O-N 2.94Å
147	R	33.1	Very low	34.9	Very low	197 Å²	197	123.8 Å²	123.8	74%	0.743	62%	0.616	S	S	*	*	H	α-helix	trans	-64.4	-44.4	175	-85.3	-176.3	169.3	165.8	-1.9	112.2	T149 S150 I151	R147-T149 PolarHBondContact O-N 3.5Å; R147-S150 WeakPolarHBondContact O-CB 3.43Å; R147-S150 PolarHBondContact O-N 3.3Å; R147-I151 WeakPolarHBondContact O-CG1 3.34Å; R147-I151 PolarHBondContact O-N 3.44Å
148	N	31.3	Very low	36	Very low	87 Å²	87	120.5 Å²	120.5	47%	0.465	60%	0.601	S	S	.	*	H	α-helix	trans	-66.6	-36.7	-179.3	-71	-8.2	0	0	0	112.3	I144 I152	I144-N148 PolarHBondContact O-N 3.28Å; N148-I152 WeakPolarHBondContact O-CB 2.91Å; N148-I152 WeakPolarHBondContact O-CD1 3.33Å; N148-I152 WeakPolarHBondContact O-CG1 3.34Å; N148-I152 PolarHBondContact O-N 2.9Å
149	T	36.3	Very low	36.7	Very low	65 Å²	65	117.2 Å²	117.2	40%	0.399	59%	0.588	S	S	.	*	H	α-helix	trans	-68.5	-35.5	172.7	40.1	0	0	0	0	112.5	Y145 H146 R147 N153	Y145-T149 PolarHBondContact O-N 3.42Å; Y145-T149 PolarHBondContact O-OG1 3.27Å; H146-T149 WeakPolarHBondContact CA-OG1 3.1Å; H146-T149 PolarHBondContact O-OG1 3.11Å; H146-T149 VanDerWaalsContact O-OG1 3.09Å; R147-T149 PolarHBondContact O-N 3.5Å; T149-N153 WeakPolarHBondContact O-CB 3.09Å; T149-N153 PolarHBondContact O-N 3.18Å; T149-N153 PolarHBondContact O-ND2 3.27Å; T149-N153 VanDerWaalsContact O-ND2 3.14Å
150	S	39	Very low	37.5	Very low	71 Å²	71	116 Å²	116	50%	0.497	58%	0.577	S	S	.	*	H	α-helix	trans	-62.2	-49.5	173.7	-162.3	0	0	0	0	112.1	H146 R147 I152 N153 E154	H146-S150 PolarHBondContact O-N 2.94Å; R147-S150 WeakPolarHBondContact O-CB 3.43Å; R147-S150 PolarHBondContact O-N 3.3Å; S150-I152 PolarHBondContact O-N 2.83Å; S150-N153 PolarHBondContact O-N 3.36Å; S150-E154 WeakPolarHBondContact O-CB 3.46Å; S150-E154 PolarHBondContact O-N 2.82Å
151	I	38.6	Very low	38.6	Very low	82 Å²	82	111.9 Å²	111.9	42%	0.421	56%	0.56	S	S	.	*	H	α-helix	trans	-64.7	-41.3	-179.3	-64.9	164.4	0	0	0	111.2	R147 E154 Q155	R147-I151 WeakPolarHBondContact O-CG1 3.34Å; R147-I151 PolarHBondContact O-N 3.44Å; I151-E154 PolarHBondContact O-N 3.36Å; I151-Q155 WeakPolarHBondContact O-CB 3.47Å; I151-Q155 WeakPolarHBondContact O-CG 3.41Å; I151-Q155 PolarHBondContact O-N 2.65Å
152	I	42.5	Very low	39.1	Very low	88 Å²	88	113.8 Å²	113.8	45%	0.451	57%	0.566	S	S	.	*	H	α-helix	trans	-64.6	-40.7	176.3	-69.2	169.6	0	0	0	110.9	N148 S150 E154 Q155 I156	N148-I152 WeakPolarHBondContact O-CB 2.91Å; N148-I152 WeakPolarHBondContact O-CD1 3.33Å; N148-I152 WeakPolarHBondContact O-CG1 3.34Å; N148-I152 PolarHBondContact O-N 2.9Å; S150-I152 PolarHBondContact O-N 2.83Å; I152-E154 VanDerWaalsContact C-N 3.35Å; I152-Q155 PolarHBondContact O-N 3.28Å; I152-I156 HydrophobicContact CG2-CD1 3.76Å; I152-I156 HydrophobicContact CG2-CG1 4.45Å; I152-I156 WeakPolarHBondContact O-CB 3.31Å; I152-I156 VanDerWaalsContact O-CG1 3.23Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 3.01Å
153	N	39.7	Very low	39.7	Very low	89 Å²	89	111.6 Å²	111.6	48%	0.476	56%	0.558	S	S	.	*	H	α-helix	trans	-65.9	-36.3	174.9	-73.8	-26.9	0	0	0	112.3	T149 S150 N157	T149-N153 WeakPolarHBondContact O-CB 3.09Å; T149-N153 PolarHBondContact O-N 3.18Å; T149-N153 PolarHBondContact O-ND2 3.27Å; T149-N153 VanDerWaalsContact O-ND2 3.14Å; S150-N153 PolarHBondContact O-N 3.36Å; N153-N157 VanDerWaalsContact O-CB 3.32Å; N153-N157 WeakPolarHBondContact O-CB 3.43Å; N153-N157 VanDerWaalsContact O-CG 3.26Å; N153-N157 PolarHBondContact O-N 3.33Å; N153-N157 PolarHBondContact O-ND2 3.04Å
154	E	53.9	Low	40.2	Very low	129 Å²	129	112 Å²	112	60%	0.603	55%	0.554	S	S	*	*	H	α-helix	trans	-69.1	-40.5	176.1	-172.3	165.6	-146.5	0	0	112.4	S150 I151 I152 N157 T158	S150-E154 WeakPolarHBondContact O-CB 3.46Å; S150-E154 PolarHBondContact O-N 2.82Å; I151-E154 PolarHBondContact O-N 3.36Å; I152-E154 VanDerWaalsContact C-N 3.35Å; E154-N157 PolarHBondContact O-N 3.32Å; E154-T158 PolarHBondContact O-N 2.73Å; E154-T158 PolarHBondContact O-OG1 2.81Å
155	Q	43	Very low	40.5	Very low	118 Å²	118	113.8 Å²	113.8	55%	0.551	56%	0.562	S	S	*	*	H	α-helix	trans	-65.4	-41.6	171.7	-74.2	-178.8	-18.1	0	0	112.3	I151 I152 N157 T158 Q159	I151-Q155 WeakPolarHBondContact O-CB 3.47Å; I151-Q155 WeakPolarHBondContact O-CG 3.41Å; I151-Q155 PolarHBondContact O-N 2.65Å; I152-Q155 PolarHBondContact O-N 3.28Å; Q155-N157 VanDerWaalsContact C-N 3.33Å; Q155-T158 WeakPolarHBondContact CA-OG1 3.3Å; Q155-T158 PolarHBondContact O-N 3.41Å; Q155-T158 PolarHBondContact O-OG1 3.32Å; Q155-T158 VanDerWaalsContact O-OG1 3.12Å; Q155-Q159 WeakPolarHBondContact O-CB 3.49Å; Q155-Q159 VanDerWaalsContact O-CG 3.24Å; Q155-Q159 WeakPolarHBondContact O-CG 3.41Å; Q155-Q159 PolarHBondContact O-N 3.31Å
156	I	46.1	Very low	41	Very low	96 Å²	96	109 Å²	109	49%	0.492	55%	0.549	S	S	.	.	H	α-helix	trans	-63.2	-40.9	173.1	-71.9	167.4	0	0	0	110.4	I152 Q159 L160	I152-I156 HydrophobicContact CG2-CD1 3.76Å; I152-I156 HydrophobicContact CG2-CG1 4.45Å; I152-I156 WeakPolarHBondContact O-CB 3.31Å; I152-I156 VanDerWaalsContact O-CG1 3.23Å; I152-I156 WeakPolarHBondContact O-CG1 3.32Å; I152-I156 PolarHBondContact O-N 3.01Å; I156-Q159 PolarHBondContact O-N 2.8Å; I156-L160 VanDerWaalsContact O-CB 3.23Å; I156-L160 WeakPolarHBondContact O-CB 3.42Å; I156-L160 PolarHBondContact O-N 2.78Å
157	N	46.2	Very low	41.5	Very low	94 Å²	94	108 Å²	108	50%	0.503	55%	0.548	S	S	.	.	H	α-helix	trans	-69.1	-37.1	178.3	-79	-43	0	0	0	113.1	N153 E154 Q155 L160 Q161	N153-N157 VanDerWaalsContact O-CB 3.32Å; N153-N157 WeakPolarHBondContact O-CB 3.43Å; N153-N157 VanDerWaalsContact O-CG 3.26Å; N153-N157 PolarHBondContact O-N 3.33Å; N153-N157 PolarHBondContact O-ND2 3.04Å; E154-N157 PolarHBondContact O-N 3.32Å; Q155-N157 VanDerWaalsContact C-N 3.33Å; N157-L160 PolarHBondContact O-N 2.82Å; N157-Q161 WeakPolarHBondContact O-CG 3.32Å; N157-Q161 PolarHBondContact O-N 3.29Å
158	T	47.5	Very low	42.1	Very low	75 Å²	75	102.7 Å²	102.7	46%	0.46	54%	0.537	S	S	.	.	H	α-helix	trans	-69.6	-41.3	173.6	36	0	0	0	0	111.9	E154 Q155 L160 Q161 N162	E154-T158 PolarHBondContact O-N 2.73Å; E154-T158 PolarHBondContact O-OG1 2.81Å; Q155-T158 WeakPolarHBondContact CA-OG1 3.3Å; Q155-T158 PolarHBondContact O-N 3.41Å; Q155-T158 PolarHBondContact O-OG1 3.32Å; Q155-T158 VanDerWaalsContact O-OG1 3.12Å; T158-L160 VanDerWaalsContact C-N 3.32Å; T158-L160 PolarHBondContact O-N 3.5Å; T158-Q161 PolarHBondContact O-N 3.27Å; T158-N162 WeakPolarHBondContact O-CB 3.49Å; T158-N162 PolarHBondContact O-N 3.39Å; T158-N162 PolarHBondContact O-OD1 3.44Å
159	Q	40.6	Very low	42.7	Very low	131 Å²	131	102 Å²	102	61%	0.612	53%	0.533	S	S	*	.	H	α-helix	trans	-57.3	-45.2	168.3	-72.3	-74.4	-18.3	0	0	111.2	Q155 I156 Q161 N162 T163	Q155-Q159 WeakPolarHBondContact O-CB 3.49Å; Q155-Q159 VanDerWaalsContact O-CG 3.24Å; Q155-Q159 WeakPolarHBondContact O-CG 3.41Å; Q155-Q159 PolarHBondContact O-N 3.31Å; I156-Q159 PolarHBondContact O-N 2.8Å; Q159-Q161 PolarHBondContact O-N 2.94Å; Q159-N162 PolarHBondContact O-N 3.23Å; Q159-N162 VanDerWaalsContact O-N 3.17Å; Q159-T163 WeakPolarHBondContact O-CG2 3.42Å; Q159-T163 PolarHBondContact O-N 3.27Å; Q159-T163 PolarHBondContact O-OG1 2.87Å
160	L	42.3	Very low	43.1	Very low	97 Å²	97	103.9 Å²	103.9	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-38.6	-179.3	-162.6	72.7	0	0	0	112.4	I156 N157 T158 T163 K164	I156-L160 VanDerWaalsContact O-CB 3.23Å; I156-L160 WeakPolarHBondContact O-CB 3.42Å; I156-L160 PolarHBondContact O-N 2.78Å; N157-L160 PolarHBondContact O-N 2.82Å; T158-L160 VanDerWaalsContact C-N 3.32Å; T158-L160 PolarHBondContact O-N 3.5Å; L160-T163 WeakPolarHBondContact CA-OG1 3.28Å; L160-T163 PolarHBondContact O-N 3.45Å; L160-T163 PolarHBondContact O-OG1 3.38Å; L160-K164 PolarHBondContact O-N 3.48Å
161	Q	48.2	Very low	43.6	Very low	116 Å²	116	105.8 Å²	105.8	54%	0.542	54%	0.541	S	S	.	.	H	α-helix	trans	-63.3	-44	171.6	-67.9	-82.4	56.3	0	0	110.9	N157 T158 Q159 T163 K164	N157-Q161 WeakPolarHBondContact O-CG 3.32Å; N157-Q161 PolarHBondContact O-N 3.29Å; T158-Q161 PolarHBondContact O-N 3.27Å; Q159-Q161 PolarHBondContact O-N 2.94Å; Q161-T163 VanDerWaalsContact C-N 3.31Å; Q161-T163 PolarHBondContact O-N 3.17Å; Q161-K164 WeakPolarHBondContact O-CB 3.43Å; Q161-K164 PolarHBondContact O-N 3.47Å
162	N	41.7	Very low	44.7	Very low	128 Å²	128	104.4 Å²	104.4	68%	0.684	54%	0.539	S	S	*	.	H	α-helix	trans	-66.9	-29.8	177.8	-66.3	-8.1	0	0	0	112.8	T158 Q159 K164	T158-N162 WeakPolarHBondContact O-CB 3.49Å; T158-N162 PolarHBondContact O-N 3.39Å; T158-N162 PolarHBondContact O-OD1 3.44Å; Q159-N162 PolarHBondContact O-N 3.23Å; Q159-N162 VanDerWaalsContact O-N 3.17Å; N162-K164 VanDerWaalsContact C-N 3.27Å; N162-K164 PolarHBondContact O-N 3.44Å
163	T	39.6	Very low	45.3	Very low	99 Å²	99	104.4 Å²	104.4	61%	0.607	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.5	172.3	58.1	0	0	0	0	114.2	Q159 L160 Q161 M165	Q159-T163 WeakPolarHBondContact O-CG2 3.42Å; Q159-T163 PolarHBondContact O-N 3.27Å; Q159-T163 PolarHBondContact O-OG1 2.87Å; L160-T163 WeakPolarHBondContact CA-OG1 3.28Å; L160-T163 PolarHBondContact O-N 3.45Å; L160-T163 PolarHBondContact O-OG1 3.38Å; Q161-T163 VanDerWaalsContact C-N 3.31Å; Q161-T163 PolarHBondContact O-N 3.17Å; T163-M165 PolarHBondContact O-N 3.31Å
164	K	40.2	Very low	46.3	Very low	128 Å²	128	105 Å²	105	56%	0.557	55%	0.546	S	S	*	.			trans	-79.1	73.7	165.5	-65.5	175.3	-174.1	164	0	109.9	L160 Q161 N162 N166	L160-K164 PolarHBondContact O-N 3.48Å; Q161-K164 WeakPolarHBondContact O-CB 3.43Å; Q161-K164 PolarHBondContact O-N 3.47Å; N162-K164 VanDerWaalsContact C-N 3.27Å; N162-K164 PolarHBondContact O-N 3.44Å; K164-N166 PolarHBondContact O-N 3.47Å
165	M	39.6	Very low	46.6	Very low	153 Å²	153	105 Å²	105	75%	0.754	55%	0.545	S	S	*	.			trans	-52.5	132.6	148.4	-68.8	-147.6	-54.1	0	0	107.3	T163 I167	T163-M165 PolarHBondContact O-N 3.31Å; M165-I167 PolarHBondContact O-N 3.21Å
166	N	39.5	Very low	47.8	Very low	92 Å²	92	104.5 Å²	104.5	49%	0.492	55%	0.546	S	S	.	.			trans	-63.3	145.2	-165.4	-60.2	-76.5	0	0	0	110.6	K164 T168 D169 L170	K164-N166 PolarHBondContact O-N 3.47Å; N166-T168 WeakPolarHBondContact CB-OG1 3.37Å; N166-T168 PolarHBondContact O-N 3.02Å; N166-T168 VanDerWaalsContact O-N 3.15Å; N166-D169 HydrophobicContact CB-CB 4.39Å; N166-D169 VanDerWaalsContact CB-OD2 3.28Å; N166-D169 WeakPolarHBondContact CB-OD2 3.28Å; N166-D169 PolarHBondContact N-OD2 2.86Å; N166-D169 PolarHBondContact ND2-OD2 2.78Å; N166-D169 PolarHBondContact O-N 3.12Å; N166-L170 PolarHBondContact O-N 3.39Å
167	I	42	Very low	48.3	Very low	133 Å²	133	102.7 Å²	102.7	68%	0.682	55%	0.545	S	S	*	.	H	α-helix	trans	-57.8	-29.4	170.7	-63.8	173.1	0	0	0	109.9	M165 Q171	M165-I167 PolarHBondContact O-N 3.21Å; I167-Q171 HydrophobicContact CG2-CG 4.41Å; I167-Q171 VanDerWaalsContact O-CB 3.27Å; I167-Q171 WeakPolarHBondContact O-CB 3.5Å; I167-Q171 WeakPolarHBondContact O-CG 3.38Å; I167-Q171 PolarHBondContact O-N 3.16Å
168	T	46	Very low	49	Very low	85 Å²	85	99.8 Å²	99.8	52%	0.521	54%	0.538	S	S	.	.	H	α-helix	trans	-65.9	-33.2	171.8	54.7	0	0	0	0	113.9	N166 Q171 S172	N166-T168 WeakPolarHBondContact CB-OG1 3.37Å; N166-T168 PolarHBondContact O-N 3.02Å; N166-T168 VanDerWaalsContact O-N 3.15Å; T168-Q171 PolarHBondContact O-N 2.88Å; T168-S172 WeakPolarHBondContact O-CB 3.27Å; T168-S172 PolarHBondContact O-N 2.83Å; T168-S172 PolarHBondContact O-OG 3.31Å
169	D	44.6	Very low	49.7	Very low	73 Å²	73	103 Å²	103	39%	0.39	55%	0.545	S	S	.	.	H	α-helix	trans	-79.8	-35.3	-179.7	-56	-28.9	0	0	0	110.4	N166 S172 T173	N166-D169 HydrophobicContact CB-CB 4.39Å; N166-D169 VanDerWaalsContact CB-OD2 3.28Å; N166-D169 WeakPolarHBondContact CB-OD2 3.28Å; N166-D169 PolarHBondContact N-OD2 2.86Å; N166-D169 PolarHBondContact ND2-OD2 2.78Å; N166-D169 PolarHBondContact O-N 3.12Å; D169-S172 WeakPolarHBondContact CA-OG 3.09Å; D169-S172 PolarHBondContact O-OG 3Å; D169-T173 WeakPolarHBondContact O-CB 3.26Å; D169-T173 PolarHBondContact O-N 3.04Å; D169-T173 PolarHBondContact O-OG1 2.99Å
170	L	45.3	Very low	50.5	Low	105 Å²	105	101.6 Å²	101.6	55%	0.55	54%	0.542	S	S	.	.	H	α-helix	trans	-65.6	-42.5	168.5	-156.7	75.7	0	0	0	110.8	N166 T173 I174	N166-L170 PolarHBondContact O-N 3.39Å; L170-T173 PolarHBondContact O-N 2.63Å; L170-I174 HydrophobicContact CG-CD1 4.18Å; L170-I174 WeakPolarHBondContact O-CB 3.45Å; L170-I174 WeakPolarHBondContact O-CD1 3.34Å; L170-I174 WeakPolarHBondContact O-CG1 3.45Å; L170-I174 PolarHBondContact O-N 3.2Å
171	Q	49.4	Very low	51.3	Low	110 Å²	110	99.3 Å²	99.3	51%	0.514	54%	0.537	S	S	.	.	H	α-helix	trans	-65.8	-40	176.1	-79.1	178.5	-53.9	0	0	113	I167 T168 I174 Q175	I167-Q171 HydrophobicContact CG2-CG 4.41Å; I167-Q171 VanDerWaalsContact O-CB 3.27Å; I167-Q171 WeakPolarHBondContact O-CB 3.5Å; I167-Q171 WeakPolarHBondContact O-CG 3.38Å; I167-Q171 PolarHBondContact O-N 3.16Å; T168-Q171 PolarHBondContact O-N 2.88Å; Q171-I174 PolarHBondContact O-N 2.89Å; Q171-Q175 WeakPolarHBondContact O-CB 3.44Å; Q171-Q175 WeakPolarHBondContact O-CG 3.01Å; Q171-Q175 PolarHBondContact O-N 3Å
172	S	59.9	Low	52	Low	54 Å²	54	100.4 Å²	100.4	38%	0.378	54%	0.542	S	S	.	.	H	α-helix	trans	-67.9	-39.1	177	68.3	0	0	0	0	111.4	T168 D169 Q175 L176	T168-S172 WeakPolarHBondContact O-CB 3.27Å; T168-S172 PolarHBondContact O-N 2.83Å; T168-S172 PolarHBondContact O-OG 3.31Å; D169-S172 WeakPolarHBondContact CA-OG 3.09Å; D169-S172 PolarHBondContact O-OG 3Å; S172-Q175 PolarHBondContact O-N 2.97Å; S172-L176 WeakPolarHBondContact O-CB 3.27Å; S172-L176 PolarHBondContact O-N 2.7Å
173	T	55	Low	52.6	Low	88 Å²	88	100 Å²	100	54%	0.54	54%	0.536	S	S	.	.	H	α-helix	trans	-62.3	-43.8	172.3	-55	0	0	0	0	111.5	D169 L170 L176 A177	D169-T173 WeakPolarHBondContact O-CB 3.26Å; D169-T173 PolarHBondContact O-N 3.04Å; D169-T173 PolarHBondContact O-OG1 2.99Å; L170-T173 PolarHBondContact O-N 2.63Å; T173-L176 PolarHBondContact O-N 3.19Å; T173-A177 PolarHBondContact O-N 3.39Å
174	I	61.1	Low	52.8	Low	101 Å²	101	102.1 Å²	102.1	52%	0.518	54%	0.537	S	S	.	.	H	α-helix	trans	-65.4	-39	175.9	-70.7	164.5	0	0	0	111.6	L170 Q171 A177 G178	L170-I174 HydrophobicContact CG-CD1 4.18Å; L170-I174 WeakPolarHBondContact O-CB 3.45Å; L170-I174 WeakPolarHBondContact O-CD1 3.34Å; L170-I174 WeakPolarHBondContact O-CG1 3.45Å; L170-I174 PolarHBondContact O-N 3.2Å; Q171-I174 PolarHBondContact O-N 2.89Å; I174-A177 PolarHBondContact O-N 3.18Å; I174-G178 PolarHBondContact O-N 3.12Å
175	Q	60.7	Low	53.4	Low	128 Å²	128	101 Å²	101	60%	0.598	54%	0.536	S	S	*	.	H	α-helix	trans	-66.5	-36.7	174.1	-75.9	-175.6	7.3	0	0	112.7	Q171 S172 K179	Q171-Q175 WeakPolarHBondContact O-CB 3.44Å; Q171-Q175 WeakPolarHBondContact O-CG 3.01Å; Q171-Q175 PolarHBondContact O-N 3Å; S172-Q175 PolarHBondContact O-N 2.97Å; Q175-K179 WeakPolarHBondContact O-CB 3.42Å; Q175-K179 WeakPolarHBondContact O-CG 3.11Å; Q175-K179 PolarHBondContact O-N 3.47Å
176	L	69	Low	54.1	Low	109 Å²	109	96 Å²	96	57%	0.571	52%	0.519	S	S	*	.	H	α-helix	trans	-65	-45.8	172.9	-92.6	160.3	0	0	0	111.7	S172 T173 G178 K179 L180	S172-L176 WeakPolarHBondContact O-CB 3.27Å; S172-L176 PolarHBondContact O-N 2.7Å; T173-L176 PolarHBondContact O-N 3.19Å; L176-G178 PolarHBondContact O-N 3.33Å; L176-K179 PolarHBondContact O-N 3.23Å; L176-L180 WeakPolarHBondContact O-CG 3.5Å; L176-L180 PolarHBondContact O-N 3.24Å
177	A	56	Low	54.4	Low	57 Å²	57	95.8 Å²	95.8	47%	0.471	52%	0.517	S	S	.	.	H	α-helix	trans	-60	-43.9	174.5	0	0	0	0	0	111.9	T173 I174 K179 L180 A181	T173-A177 PolarHBondContact O-N 3.39Å; I174-A177 PolarHBondContact O-N 3.18Å; A177-K179 PolarHBondContact O-N 2.81Å; A177-L180 PolarHBondContact O-N 2.86Å; A177-A181 WeakPolarHBondContact O-CB 3.45Å; A177-A181 PolarHBondContact O-N 2.95Å
178	G	61.5	Low	54.5	Low	34 Å²	34	92.5 Å²	92.5	35%	0.351	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-41.6	175.7	0	0	0	0	0	113.4	I174 L176 A181 Q182	I174-G178 PolarHBondContact O-N 3.12Å; L176-G178 PolarHBondContact O-N 3.33Å; G178-A181 PolarHBondContact O-N 3.36Å; G178-Q182 WeakPolarHBondContact O-CG 3.2Å; G178-Q182 PolarHBondContact O-N 3.4Å
179	K	61.6	Low	54.4	Low	141 Å²	141	92.6 Å²	92.6	61%	0.613	50%	0.504	S	S	*	.	H	α-helix	trans	-65.3	-40.9	174.6	-76.9	174.7	173.4	177	0	112.4	Q175 L176 A177 Q182 H183	Q175-K179 WeakPolarHBondContact O-CB 3.42Å; Q175-K179 WeakPolarHBondContact O-CG 3.11Å; Q175-K179 PolarHBondContact O-N 3.47Å; L176-K179 PolarHBondContact O-N 3.23Å; A177-K179 PolarHBondContact O-N 2.81Å; K179-Q182 PolarHBondContact O-N 3.1Å; K179-H183 WeakPolarHBondContact O-CB 3.32Å; K179-H183 PolarHBondContact O-N 3.46Å
180	L	57.7	Low	54.2	Low	102 Å²	102	94.3 Å²	94.3	53%	0.534	51%	0.513	S	S	.	.	H	α-helix	trans	-63.8	-44.5	174.9	-77.1	165.3	0	0	0	111.6	L176 A177 Q182 H183 F184	L176-L180 WeakPolarHBondContact O-CG 3.5Å; L176-L180 PolarHBondContact O-N 3.24Å; A177-L180 PolarHBondContact O-N 2.86Å; L180-Q182 PolarHBondContact O-N 2.89Å; L180-H183 WeakPolarHBondContact O-CB 3.48Å; L180-H183 PolarHBondContact O-N 2.92Å; L180-H183 VanDerWaalsContact O-N 3.12Å; L180-F184 VanDerWaalsContact O-CD2 3.28Å; L180-F184 WeakPolarHBondContact O-CD2 3.35Å; L180-F184 PolarHBondContact O-N 3.21Å
181	A	59	Low	53.7	Low	50 Å²	50	95.5 Å²	95.5	41%	0.413	52%	0.519	S	S	.	.	H	α-helix	trans	-59.9	-44.6	175.5	0	0	0	0	0	112.1	A177 G178 H183 F184 I185	A177-A181 WeakPolarHBondContact O-CB 3.45Å; A177-A181 PolarHBondContact O-N 2.95Å; G178-A181 PolarHBondContact O-N 3.36Å; A181-H183 VanDerWaalsContact C-N 3.31Å; A181-H183 PolarHBondContact O-N 3.18Å; A181-F184 PolarHBondContact O-N 3.37Å; A181-I185 VanDerWaalsContact O-CG1 3.31Å; A181-I185 WeakPolarHBondContact O-CG1 3.4Å; A181-I185 PolarHBondContact O-N 3.18Å
182	Q	62	Low	53	Low	138 Å²	138	96.2 Å²	96.2	65%	0.645	53%	0.527	S	S	*	.	H	α-helix	trans	-60.6	-38.7	173.3	-74.2	176.5	-7.5	0	0	112.3	G178 K179 L180 I185 A186	G178-Q182 WeakPolarHBondContact O-CG 3.2Å; G178-Q182 PolarHBondContact O-N 3.4Å; K179-Q182 PolarHBondContact O-N 3.1Å; L180-Q182 PolarHBondContact O-N 2.89Å; Q182-I185 PolarHBondContact O-N 3.41Å; Q182-A186 WeakPolarHBondContact O-CB 3.33Å; Q182-A186 PolarHBondContact O-N 2.92Å
183	H	55.9	Low	51.7	Low	120 Å²	120	99.9 Å²	99.9	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-67.9	-38.3	177.2	-157.3	-64.2	0	0	0	112.4	K179 L180 A181 A186 L187	K179-H183 WeakPolarHBondContact O-CB 3.32Å; K179-H183 PolarHBondContact O-N 3.46Å; L180-H183 WeakPolarHBondContact O-CB 3.48Å; L180-H183 PolarHBondContact O-N 2.92Å; L180-H183 VanDerWaalsContact O-N 3.12Å; A181-H183 VanDerWaalsContact C-N 3.31Å; A181-H183 PolarHBondContact O-N 3.18Å; H183-A186 PolarHBondContact O-N 3.15Å; H183-L187 WeakPolarHBondContact ND1-CD1 3.49Å; H183-L187 VanDerWaalsContact O-CG 3.28Å; H183-L187 WeakPolarHBondContact O-CG 3.24Å; H183-L187 PolarHBondContact O-N 2.95Å
184	F	43.7	Very low	50.6	Low	144 Å²	144	102.2 Å²	102.2	63%	0.632	55%	0.551	S	S	*	*	H	α-helix	trans	-67.8	-38.6	172.8	-81.9	-69.3	0	0	0	112.5	L180 A181 L187 S188	L180-F184 VanDerWaalsContact O-CD2 3.28Å; L180-F184 WeakPolarHBondContact O-CD2 3.35Å; L180-F184 PolarHBondContact O-N 3.21Å; A181-F184 PolarHBondContact O-N 3.37Å; F184-L187 PolarHBondContact O-N 2.87Å; F184-S188 WeakPolarHBondContact O-CB 3.32Å; F184-S188 PolarHBondContact O-N 2.75Å
185	I	52.5	Low	49.1	Very low	103 Å²	103	104.6 Å²	104.6	53%	0.528	57%	0.565	S	S	.	*	H	α-helix	trans	-65.4	-40.7	174.4	-67.9	164.9	0	0	0	110.9	A181 Q182 S188 N189	A181-I185 VanDerWaalsContact O-CG1 3.31Å; A181-I185 WeakPolarHBondContact O-CG1 3.4Å; A181-I185 PolarHBondContact O-N 3.18Å; Q182-I185 PolarHBondContact O-N 3.41Å; I185-S188 PolarHBondContact O-N 3.18Å; I185-N189 WeakPolarHBondContact O-CB 3.42Å; I185-N189 VanDerWaalsContact O-CG 3.24Å; I185-N189 PolarHBondContact O-N 3.38Å; I185-N189 PolarHBondContact O-ND2 2.97Å
186	A	53	Low	47.7	Very low	48 Å²	48	105.6 Å²	105.6	40%	0.397	58%	0.575	S	S	.	*	H	α-helix	trans	-63.3	-42.4	175.1	0	0	0	0	0	112.5	Q182 H183 N189 N190	Q182-A186 WeakPolarHBondContact O-CB 3.33Å; Q182-A186 PolarHBondContact O-N 2.92Å; H183-A186 PolarHBondContact O-N 3.15Å; A186-N189 PolarHBondContact O-N 2.8Å; A186-N190 WeakPolarHBondContact O-CB 3.49Å; A186-N190 PolarHBondContact O-N 3.11Å
187	L	47	Very low	45.9	Very low	88 Å²	88	107.9 Å²	107.9	46%	0.461	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-40	174	-71.6	168.3	0	0	0	112.2	H183 F184 N191	H183-L187 WeakPolarHBondContact ND1-CD1 3.49Å; H183-L187 VanDerWaalsContact O-CG 3.28Å; H183-L187 WeakPolarHBondContact O-CG 3.24Å; H183-L187 PolarHBondContact O-N 2.95Å; F184-L187 PolarHBondContact O-N 2.87Å; L187-N191 PolarHBondContact O-N 3.15Å
188	S	44	Very low	44.4	Very low	64 Å²	64	110.1 Å²	110.1	45%	0.448	60%	0.6	S	S	.	*	H	α-helix	trans	-62.6	-45.1	175	-169.8	0	0	0	0	112	F184 I185 N191	F184-S188 WeakPolarHBondContact O-CB 3.32Å; F184-S188 PolarHBondContact O-N 2.75Å; I185-S188 PolarHBondContact O-N 3.18Å; S188-N191 PolarHBondContact O-N 3.34Å
189	N	43	Very low	42.9	Very low	88 Å²	88	115.8 Å²	115.8	47%	0.471	62%	0.619	S	S	.	*	H	α-helix	trans	-70.5	-34.4	-178.7	-69.3	-12.7	0	0	0	112.7	I185 A186 N191 N192	I185-N189 WeakPolarHBondContact O-CB 3.42Å; I185-N189 VanDerWaalsContact O-CG 3.24Å; I185-N189 PolarHBondContact O-N 3.38Å; I185-N189 PolarHBondContact O-ND2 2.97Å; A186-N189 PolarHBondContact O-N 2.8Å; N189-N191 VanDerWaalsContact C-N 3.26Å; N189-N191 PolarHBondContact O-N 2.99Å; N189-N192 PolarHBondContact O-N 3.45Å
190	N	40.2	Very low	41.2	Very low	108 Å²	108	115.8 Å²	115.8	58%	0.578	63%	0.626	S	S	*	*	H	α-helix	trans	-65.8	-26.5	174	-78.7	-13.6	0	0	0	113.2	A186	A186-N190 WeakPolarHBondContact O-CB 3.49Å; A186-N190 PolarHBondContact O-N 3.11Å
191	N	36.5	Very low	40	Very low	130 Å²	130	115.7 Å²	115.7	70%	0.695	63%	0.633	S	S	*	*	H	α-helix	trans	-78.2	-16.2	174.5	-78.1	-20.6	0	0	0	113.8	L187 S188 N189	L187-N191 PolarHBondContact O-N 3.15Å; S188-N191 PolarHBondContact O-N 3.34Å; N189-N191 VanDerWaalsContact C-N 3.26Å; N189-N191 PolarHBondContact O-N 2.99Å
192	N	33.9	Very low	38.4	Very low	126 Å²	126	120.1 Å²	120.1	67%	0.674	65%	0.65	S	S	*	*	H	α-helix	trans	-96.8	-6.8	-177.6	-77.8	-23.1	0	0	0	114.8	N189	N189-N192 PolarHBondContact O-N 3.45Å
193	N	32.9	Very low	36.8	Very low	131 Å²	131	122.6 Å²	122.6	70%	0.701	66%	0.659	S	S	*	*	S	Bend	trans	-93.5	-11.3	177.6	-78.5	-24.1	0	0	0	114.4	N195	N193-N195 VanDerWaalsContact C-N 3.31Å; N193-N195 PolarHBondContact O-N 3.2Å; N193-N195 VanDerWaalsContact O-N 3.17Å
194	N	30.9	Very low	35.4	Very low	136 Å²	136	121.1 Å²	121.1	73%	0.727	66%	0.662	S	S	*	*	S	Bend	trans	-89.4	51.9	-179.7	-74.7	-21.6	0	0	0	112.9
195	N	31.3	Very low	34.7	Very low	151 Å²	151	120.9 Å²	120.9	81%	0.807	67%	0.667	S	S	*	*	S	Bend	trans	-155.2	39.8	175.2	-105.8	-33.1	0	0	0	113.9	N193	N193-N195 VanDerWaalsContact C-N 3.31Å; N193-N195 PolarHBondContact O-N 3.2Å; N193-N195 VanDerWaalsContact O-N 3.17Å
196	N	29.8	Very low	33.8	Very low	150 Å²	150	124.5 Å²	124.5	80%	0.802	68%	0.679	S	S	*	*			trans	-150.7	160.7	165	-90.8	-55.6	0	0	0	110.3
197	N	31.1	Very low	32.8	Very low	156 Å²	156	126.5 Å²	126.5	83%	0.834	69%	0.69	S	S	*	*			trans	67.5	79.4	172.7	-59.8	-12.8	0	0	0	117.4
198	S	25.6	Very low	32.2	Very low	104 Å²	104	128.9 Å²	128.9	73%	0.727	70%	0.703	S	S	*	*			trans	-26.2	160	133.8	-171.8	0	0	0	0	116.5
199	M	29.8	Very low	31.7	Very low	153 Å²	153	130.3 Å²	130.3	75%	0.754	71%	0.713	S	S	*	*			trans	86.3	100.9	168.4	-63.5	-71.2	177.3	0	0	119.8
200	N	26.3	Very low	31.4	Very low	142 Å²	142	132.2 Å²	132.2	76%	0.759	73%	0.728	S	S	*	*				70.6	145.5	129.7	-74.4	-21.2	0	0	0	124.3
201	S	30.7	Very low	31	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	74%	0.737	S	S	*	*			trans	70.9	106.9	152.3	52.1	0	0	0	0	121
202	N	26.3	Very low	30.8	Very low	144 Å²	144	132.1 Å²	132.1	77%	0.77	74%	0.735	S	S	*	*				38.9	117.5	121.9	-49.5	-17.8	0	0	0	119.1
203	F	28.6	Very low	30.9	Very low	189 Å²	189	134.8 Å²	134.8	83%	0.829	74%	0.744	S	S	*	*				-172.9	124.2	96	-116.2	-96.4	0	0	0	113.9
204	S	27.2	Very low	30.7	Very low	89 Å²	89	137.1 Å²	137.1	62%	0.622	76%	0.755	S	S	*	*			trans	0.3	146.9	130.4	-71.2	0	0	0	0	118.7
205	L	29.1	Very low	30.7	Very low	139 Å²	139	134 Å²	134	73%	0.728	76%	0.755	S	S	*	*			cis	-176.3	166.7	20.9	-116.7	165.8	0	0	0	111.4
206	K	33.7	Very low	30.8	Very low	179 Å²	179	134.8 Å²	134.8	78%	0.778	75%	0.754	S	S	*	*			trans	70.4	154.2	153.6	-71	165.1	-176.1	179.2	0	120.3
207	S	31.7	Very low	30.8	Very low	90 Å²	90	137.9 Å²	137.9	63%	0.629	76%	0.756	S	S	*	*			cis	-175.2	159.9	-35	52.1	0	0	0	0	110.2
208	N	34.6	Very low	30.8	Very low	138 Å²	138	139.4 Å²	139.4	74%	0.738	76%	0.757	S	S	*	*			trans	148.8	79.4	137.7	-72.6	3.3	0	0	0	115.2
209	S	32.7	Very low	31.1	Very low	95 Å²	95	141.5 Å²	141.5	66%	0.664	76%	0.755	S	S	*	*				49	145.6	115.2	64.7	0	0	0	0	124.1
210	T	35.6	Very low	31.3	Very low	127 Å²	127	143 Å²	143	78%	0.779	76%	0.76	S	S	*	*			trans	66.9	142.5	157.8	57.2	0	0	0	0	118.2
211	D	32.8	Very low	31.6	Very low	142 Å²	142	143 Å²	143	76%	0.759	76%	0.756	S	S	*	*			cis	-166.9	178.9	-22.5	-130.7	-111.6	0	0	0	106.7
212	S	33.2	Very low	31.4	Very low	94 Å²	94	148.5 Å²	148.5	66%	0.657	76%	0.762	S	S	*	*			cis	-157.8	-159.2	7.6	-156.1	0	0	0	0	110.7
213	Q	35.8	Very low	31.9	Very low	183 Å²	183	150.3 Å²	150.3	86%	0.855	77%	0.766	S	S	*	*			trans	61.9	92.2	168.4	-60.7	-171.6	1	0	0	116
214	L	28.1	Very low	32.2	Very low	180 Å²	180	150 Å²	150	94%	0.942	77%	0.767	S	S	*	*				77.7	112.3	55	-166.3	78.2	0	0	0	113.6
215	G	31.5	Very low	32.2	Very low	71 Å²	71	150.6 Å²	150.6	73%	0.732	77%	0.771	S	S	*	*			trans	176.2	24.6	179.9	0	0	0	0	0	121.7
216	Q	33.6	Very low	32.3	Very low	167 Å²	167	149.5 Å²	149.5	78%	0.78	77%	0.765	S	S	*	*			trans	44.7	115	162.1	-55.1	179	-4.8	0	0	120.7
217	Y	29.8	Very low	32.1	Very low	215 Å²	215	147.8 Å²	147.8	84%	0.843	76%	0.76	S	S	*	*				169.9	116.4	104.2	-108.4	-82.4	0	0	0	111.7
218	H	29.4	Very low	32	Very low	187 Å²	187	151.8 Å²	151.8	87%	0.866	77%	0.767	S	S	*	*			trans	-163.1	88.9	175.5	-150	-37.1	0	0	0	113.4
219	H	31.9	Very low	31.9	Very low	148 Å²	148	152.9 Å²	152.9	69%	0.685	77%	0.767	S	S	*	*			trans	-159.9	116.2	161.9	-149.8	65.1	0	0	0	115.6
220	Q	34	Very low	31.9	Very low	184 Å²	184	156.4 Å²	156.4	86%	0.86	77%	0.773	S	S	*	*				-162.5	155.6	112.4	-104.1	174.7	-3	0	0	108.9
221	Q	33.8	Very low	31.7	Very low	143 Å²	143	156.7 Å²	156.7	67%	0.668	78%	0.777	S	S	*	*			trans	-123.3	159.3	-168.2	-65.6	-164.7	25.6	0	0	114
222	R	26.7	Very low	31.4	Very low	214 Å²	214	154.6 Å²	154.6	81%	0.808	77%	0.773	S	S	*	*			trans	-26.5	142.8	158.5	-64.3	172.1	-79.1	-134	-3.3	115
223	Q	36.3	Very low	31.3	Very low	183 Å²	183	158.6 Å²	158.6	86%	0.855	79%	0.786	S	S	*	*			trans	-157.7	165.7	136.3	-121.7	170.5	80.5	0	0	112.6
224	Q	35.3	Very low	31	Very low	183 Å²	183	158.1 Å²	158.1	86%	0.855	78%	0.784	S	S	*	*			trans	71.1	97.4	173.4	-59.6	-176.5	8.2	0	0	117.9
225	S	27.3	Very low	31.1	Very low	100 Å²	100	161 Å²	161	70%	0.699	78%	0.782	S	S	*	*			trans	-82.9	160.4	148.6	52.4	0	0	0	0	110.6
226	N	30.3	Very low	31.1	Very low	116 Å²	116	162.3 Å²	162.3	62%	0.62	78%	0.778	S	S	*	*				176.2	146.3	117.5	-95.2	24.3	0	0	0	113.9
227	E	29.4	Very low	30.9	Very low	144 Å²	144	165.4 Å²	165.4	67%	0.673	78%	0.784	S	S	*	*			trans	48.1	124.6	140.2	-57.6	158	151.1	0	0	119.3
228	F	30.6	Very low	30.7	Very low	173 Å²	173	161.9 Å²	161.9	76%	0.759	78%	0.78	S	S	*	*				-158.7	166.2	70.1	-112.8	-88.9	0	0	0	115.9
229	H	32.5	Very low	30.4	Very low	162 Å²	162	157.4 Å²	157.4	75%	0.75	77%	0.769	S	S	*	*			trans	-49.6	157.3	-161.2	-55.3	-36.3	0	0	0	123.3
230	Q	31.6	Very low	30.2	Very low	169 Å²	169	159.2 Å²	159.2	79%	0.79	78%	0.778	S	S	*	*			trans	-84.8	-179.8	150	-63.5	-176	-13.4	0	0	111.2
231	P	32	Very low	30	Very low	133 Å²	133	159.5 Å²	159.5	86%	0.864	78%	0.779	S	S	*	*				-138.1	165.4	101.6	38.4	-28.5	0	0	0	114.8
232	S	27.2	Very low	29.6	Very low	97 Å²	97	160.6 Å²	160.6	68%	0.678	79%	0.788	S	S	*	*			trans	-100.8	162.8	-176.8	55.8	0	0	0	0	113.2
233	L	31.2	Very low	29.5	Very low	178 Å²	178	157.5 Å²	157.5	93%	0.932	79%	0.786	S	S	*	*			trans	-140.5	142.8	161.7	-108.9	170.8	0	0	0	110.2
234	Q	28.8	Very low	29	Very low	173 Å²	173	155 Å²	155	81%	0.808	79%	0.786	S	S	*	*			trans	-107	150.9	-168.8	-58	168.6	-33.6	0	0	111.9
235	R	30.2	Very low	28.5	Very low	240 Å²	240	150.4 Å²	150.4	91%	0.906	77%	0.774	S	S	*	*				-167.8	156.2	112.8	-102.9	171.2	-172.8	-103.5	-2	111.7
236	P	31.8	Very low	28.3	Very low	99 Å²	99	153.7 Å²	153.7	64%	0.643	78%	0.783	S	S	*	*			trans	-96.7	167.8	-173.9	39.2	-35.7	0	0	0	112.7
237	Y	29.7	Very low	28.1	Very low	232 Å²	232	154.3 Å²	154.3	91%	0.91	79%	0.791	S	S	*	*				-156.2	174.6	118	-105.7	-70.4	0	0	0	109.8
238	N	24.5	Very low	27.9	Very low	142 Å²	142	155 Å²	155	76%	0.759	80%	0.799	S	S	*	*			trans	-135.2	161.1	-152.9	-166	17.7	0	0	0	113
239	C	23.3	Very low	27.7	Very low	93 Å²	93	151.7 Å²	151.7	63%	0.628	80%	0.798	S	S	*	*			trans	53.2	104.2	164.1	-68.5	0	0	0	0	118.4
240	Q	27.6	Very low	27.3	Very low	186 Å²	186	149.9 Å²	149.9	87%	0.869	79%	0.794	S	S	*	*				176.5	161.5	104.7	-95.1	161.3	0.7	0	0	113.9
241	Q	31	Very low	27.1	Very low	190 Å²	190	149.7 Å²	149.7	89%	0.888	79%	0.792	S	S	*	*			trans	61.9	96.6	170.8	-64.1	-174.9	7.5	0	0	118.3
242	L	23.5	Very low	26.8	Very low	165 Å²	165	150.9 Å²	150.9	86%	0.864	79%	0.786	S	S	*	*			trans	-74.4	146.8	156.8	-68.5	144.2	0	0	0	110.5
243	I	24.8	Very low	26.9	Very low	149 Å²	149	153.7 Å²	153.7	76%	0.764	79%	0.791	S	S	*	*			trans	154.8	102.7	134.6	-77.5	155	0	0	0	109.3
244	P	25.8	Very low	26.7	Very low	130 Å²	130	152.5 Å²	152.5	84%	0.844	78%	0.778	S	S	*	*			trans	-132.2	98.7	150.5	30.9	-14.3	0	0	0	110
245	S	24.9	Very low	26.6	Very low	87 Å²	87	153 Å²	153	61%	0.608	79%	0.785	S	S	*	*			trans	-147.3	159.7	-178.1	57.5	0	0	0	0	112.6
246	L	24.8	Very low	26.4	Very low	169 Å²	169	148.9 Å²	148.9	89%	0.885	78%	0.78	S	S	*	*			trans	68.6	51.1	168.5	-56.6	173.6	0	0	0	118.5
247	V	25.8	Very low	26.2	Very low	130 Å²	130	151.2 Å²	151.2	79%	0.788	79%	0.787	S	S	*	*			trans	-130.3	87.3	155.1	-173.4	0	0	0	0	111
248	N	24.5	Very low	26.1	Very low	158 Å²	158	147.8 Å²	147.8	85%	0.845	78%	0.784	S	S	*	*	S	Bend	trans	152.9	87.3	148.6	-82.6	-32.6	0	0	0	112.4
249	S	25.5	Very low	26.4	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	78%	0.78	S	S	*	*			trans	-175	146.8	140.9	50	0	0	0	0	112.3
250	N	25.6	Very low	26.7	Very low	124 Å²	124	149.7 Å²	149.7	66%	0.663	79%	0.788	S	S	*	*			trans	47.2	97.5	150.9	-52.3	-20.9	0	0	0	118.7
251	H	27.2	Very low	26.9	Very low	164 Å²	164	146.6 Å²	146.6	76%	0.759	78%	0.782	S	S	*	*			trans	-107.7	34	159.2	-122.4	-19.1	0	0	0	113.7	M253	H251-M253 PolarHBondContact O-N 2.78Å
252	E	25.7	Very low	27.2	Very low	158 Å²	158	142.4 Å²	142.4	74%	0.738	77%	0.773	S	S	*	*			trans	-75.1	100.9	144.6	-75.1	-163.5	149.2	0	0	107.8	K254	E252-K254 PolarHBondContact O-N 3.15Å
253	M	28.1	Very low	27.9	Very low	157 Å²	157	140.9 Å²	140.9	77%	0.773	77%	0.766	S	S	*	*			trans	-71.6	79.4	167.6	-80	-66	-73.2	0	0	109.7	H251	H251-M253 PolarHBondContact O-N 2.78Å
254	K	28.4	Very low	28.3	Very low	153 Å²	153	137.6 Å²	137.6	67%	0.665	75%	0.749	S	S	*	*			trans	-53.1	145.4	156.8	-75.7	-178	175.5	179.3	0	108.8	E252 L256	E252-K254 PolarHBondContact O-N 3.15Å; K254-L256 PolarHBondContact O-N 3Å
255	L	25.2	Very low	29	Very low	182 Å²	182	139.7 Å²	139.7	95%	0.953	75%	0.748	S	S	*	*			trans	-62.6	96.9	169.9	-68.3	159.4	0	0	0	108.7
256	L	26.6	Very low	29.8	Very low	155 Å²	155	137.5 Å²	137.5	81%	0.812	73%	0.732	S	S	*	*			trans	-96.7	136.3	170.6	-75.8	170.5	0	0	0	109.2	K254 L258	K254-L256 PolarHBondContact O-N 3Å; L256-L258 PolarHBondContact O-N 3.29Å
257	N	27.3	Very low	30.5	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	72%	0.723	S	S	*	*			trans	-67.8	132.6	-171.7	-79.7	-41.7	0	0	0	111.9	N259	N257-N259 PolarHBondContact O-N 3.49Å; N257-N259 VanDerWaalsContact O-N 3.07Å
258	L	27.1	Very low	31.3	Very low	160 Å²	160	135.1 Å²	135.1	84%	0.838	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	100.2	161.4	-68.5	157.9	0	0	0	108.5	L256	L256-L258 PolarHBondContact O-N 3.29Å
259	N	31	Very low	32.5	Very low	128 Å²	128	132 Å²	132	68%	0.684	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.2	-31.3	166.2	-95.9	-30.8	0	0	0	113.9	N257 T261	N257-N259 PolarHBondContact O-N 3.49Å; N257-N259 VanDerWaalsContact O-N 3.07Å; N259-T261 PolarHBondContact O-N 2.95Å
260	D	30.2	Very low	33.3	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	68%	0.679	S	S	*	*			trans	-79.9	81.2	-177.3	-68.2	-39.9	0	0	0	112.7	S262	D260-S262 VanDerWaalsContact C-N 3.3Å; D260-S262 PolarHBondContact O-N 3.28Å
261	T	32.5	Very low	34.8	Very low	121 Å²	121	127.7 Å²	127.7	74%	0.742	67%	0.667	S	S	*	*			trans	-86.5	7.9	178.3	51.3	0	0	0	0	114.4	N259 N263	N259-T261 PolarHBondContact O-N 2.95Å; T261-N263 VanDerWaalsContact C-N 3.35Å; T261-N263 PolarHBondContact O-N 3.19Å
262	S	37.3	Very low	35.8	Very low	101 Å²	101	126.7 Å²	126.7	71%	0.706	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	1.4	-168.3	52.4	0	0	0	0	116.3	D260	D260-S262 VanDerWaalsContact C-N 3.3Å; D260-S262 PolarHBondContact O-N 3.28Å
263	N	36.8	Very low	36.8	Very low	133 Å²	133	124.4 Å²	124.4	71%	0.711	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	12	-166	-112.1	-16.6	0	0	0	115.7	T261	T261-N263 VanDerWaalsContact C-N 3.35Å; T261-N263 PolarHBondContact O-N 3.19Å
264	I	34.2	Very low	37.9	Very low	81 Å²	81	121 Å²	121	42%	0.415	64%	0.639	S	S	.	*			trans	-90.2	115.4	178.3	-55.4	179.1	0	0	0	108.9	Q269 L270	I264-Q269 HydrophobicContact CG2-CB 4.35Å; I264-L270 HydrophobicContact CD1-CD1 4.09Å; I264-L270 HydrophobicContact CG2-CB 4.17Å; I264-L270 HydrophobicContact CG2-CD1 4.37Å
265	Q	41.3	Very low	39.1	Very low	173 Å²	173	118.9 Å²	118.9	81%	0.808	63%	0.634	S	S	*	*			trans	-105.2	-9.3	-169.9	-69.1	-171	-13.5	0	0	114.9
266	S	41.6	Very low	39.9	Very low	41 Å²	41	116.3 Å²	116.3	29%	0.287	61%	0.613	S	S	.	*			trans	-140.3	158	169.9	83.6	0	0	0	0	113.4	D268 Q269	S266-D268 PolarHBondContact O-N 2.86Å; S266-D268 PolarHBondContact OG-N 2.88Å; S266-D268 PolarHBondContact OG-OD2 3.28Å; S266-Q269 PolarHBondContact OG-N 3.05Å
267	L	39.5	Very low	40.6	Very low	131 Å²	131	113.7 Å²	113.7	69%	0.686	60%	0.597	S	S	*	*	H	α-helix	trans	-65.2	-29.9	173.4	-174	61.4	0	0	0	111.5	L270 T271	L267-L270 PolarHBondContact O-N 2.59Å; L267-T271 WeakPolarHBondContact O-CB 3.37Å; L267-T271 PolarHBondContact O-N 3.28Å; L267-T271 PolarHBondContact O-OG1 3.22Å
268	D	42.7	Very low	41.4	Very low	119 Å²	119	112.2 Å²	112.2	64%	0.636	59%	0.585	S	S	*	*	H	α-helix	trans	-67	-43.5	-179.8	-42.7	-67.6	0	0	0	111.3	S266 L270 T271 E272	S266-D268 PolarHBondContact O-N 2.86Å; S266-D268 PolarHBondContact OG-N 2.88Å; S266-D268 PolarHBondContact OG-OD2 3.28Å; D268-L270 VanDerWaalsContact C-N 3.28Å; D268-L270 PolarHBondContact O-N 3.02Å; D268-T271 PolarHBondContact O-N 2.85Å; D268-T271 VanDerWaalsContact O-N 3.11Å; D268-E272 WeakPolarHBondContact O-CB 3.41Å; D268-E272 PolarHBondContact O-N 3.4Å
269	Q	47.9	Very low	42	Very low	93 Å²	93	111.7 Å²	111.7	44%	0.435	57%	0.573	S	S	.	*	H	α-helix	trans	-58.7	-41	174.2	-71.2	174.3	-13.9	0	0	111.6	I264 S266 L273	I264-Q269 HydrophobicContact CG2-CB 4.35Å; S266-Q269 PolarHBondContact OG-N 3.05Å; Q269-L273 WeakPolarHBondContact O-CB 3.24Å; Q269-L273 WeakPolarHBondContact O-CD1 3.32Å; Q269-L273 VanDerWaalsContact O-CG 3.26Å; Q269-L273 WeakPolarHBondContact O-CG 3.28Å; Q269-L273 PolarHBondContact O-N 3.44Å; Q269-L273 VanDerWaalsContact O-N 3.08Å
270	L	44.1	Very low	42.3	Very low	72 Å²	72	111.6 Å²	111.6	38%	0.377	56%	0.564	S	S	.	*	H	α-helix	trans	-70	-34.6	177	-166	135.8	0	0	0	111.8	I264 L267 D268 L274	I264-L270 HydrophobicContact CD1-CD1 4.09Å; I264-L270 HydrophobicContact CG2-CB 4.17Å; I264-L270 HydrophobicContact CG2-CD1 4.37Å; L267-L270 PolarHBondContact O-N 2.59Å; D268-L270 VanDerWaalsContact C-N 3.28Å; D268-L270 PolarHBondContact O-N 3.02Å; L270-L274 HydrophobicContact CD2-CD1 3.66Å; L270-L274 HydrophobicContact CD2-CG 4.43Å; L270-L274 WeakPolarHBondContact O-CB 3.39Å; L270-L274 VanDerWaalsContact O-CG 3.26Å; L270-L274 WeakPolarHBondContact O-CG 3.45Å; L270-L274 PolarHBondContact O-N 2.83Å
271	T	56.4	Low	42.6	Very low	65 Å²	65	110.4 Å²	110.4	40%	0.399	55%	0.554	S	S	.	*	H	α-helix	trans	-71.4	-42.7	177.5	-56.2	0	0	0	0	111.8	L267 D268 L274 L275	L267-T271 WeakPolarHBondContact O-CB 3.37Å; L267-T271 PolarHBondContact O-N 3.28Å; L267-T271 PolarHBondContact O-OG1 3.22Å; D268-T271 PolarHBondContact O-N 2.85Å; D268-T271 VanDerWaalsContact O-N 3.11Å; T271-L274 PolarHBondContact O-N 2.22Å; T271-L275 HydrophobicContact CG2-CD1 4.19Å; T271-L275 WeakPolarHBondContact O-CB 3.15Å; T271-L275 WeakPolarHBondContact O-CG 3.46Å; T271-L275 PolarHBondContact O-N 3.26Å
272	E	48.3	Very low	42.7	Very low	143 Å²	143	109.8 Å²	109.8	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-64.3	-42.1	175.8	-171.1	173.1	-150.1	0	0	111.3	D268 L275 Y276	D268-E272 WeakPolarHBondContact O-CB 3.41Å; D268-E272 PolarHBondContact O-N 3.4Å; E272-L275 PolarHBondContact O-N 2.66Å; E272-Y276 WeakPolarHBondContact O-CB 3.5Å; E272-Y276 PolarHBondContact O-N 3.23Å
273	L	45.3	Very low	42.6	Very low	110 Å²	110	109.5 Å²	109.5	58%	0.576	54%	0.536	S	S	*	.	H	α-helix	trans	-63.5	-40.4	173.2	-74.9	169.6	0	0	0	112.8	Q269 Y276 Q277	Q269-L273 WeakPolarHBondContact O-CB 3.24Å; Q269-L273 WeakPolarHBondContact O-CD1 3.32Å; Q269-L273 VanDerWaalsContact O-CG 3.26Å; Q269-L273 WeakPolarHBondContact O-CG 3.28Å; Q269-L273 PolarHBondContact O-N 3.44Å; Q269-L273 VanDerWaalsContact O-N 3.08Å; L273-Y276 PolarHBondContact O-N 2.61Å; L273-Q277 WeakPolarHBondContact O-CB 3.36Å; L273-Q277 PolarHBondContact O-N 3.3Å
274	L	52.5	Low	42.5	Very low	86 Å²	86	109 Å²	109	45%	0.45	53%	0.533	S	S	.	.	H	α-helix	trans	-67.2	-39.9	175.4	-76.6	172.3	0	0	0	112.2	L270 T271 Q277 Q278	L270-L274 HydrophobicContact CD2-CD1 3.66Å; L270-L274 HydrophobicContact CD2-CG 4.43Å; L270-L274 WeakPolarHBondContact O-CB 3.39Å; L270-L274 VanDerWaalsContact O-CG 3.26Å; L270-L274 WeakPolarHBondContact O-CG 3.45Å; L270-L274 PolarHBondContact O-N 2.83Å; T271-L274 PolarHBondContact O-N 2.22Å; L274-Q277 PolarHBondContact O-N 3.48Å; L274-Q278 WeakPolarHBondContact O-CB 3.4Å; L274-Q278 WeakPolarHBondContact O-CG 3.2Å; L274-Q278 PolarHBondContact O-N 3.46Å
275	L	53.4	Low	42.4	Very low	107 Å²	107	111.4 Å²	111.4	56%	0.56	55%	0.547	S	S	*	.	H	α-helix	trans	-62.2	-42.4	172.6	-78.2	164.4	0	0	0	111.4	T271 E272 Q277 Q278 Y279	T271-L275 HydrophobicContact CG2-CD1 4.19Å; T271-L275 WeakPolarHBondContact O-CB 3.15Å; T271-L275 WeakPolarHBondContact O-CG 3.46Å; T271-L275 PolarHBondContact O-N 3.26Å; E272-L275 PolarHBondContact O-N 2.66Å; L275-Q277 VanDerWaalsContact C-N 3.35Å; L275-Q277 PolarHBondContact O-N 2.89Å; L275-Q278 PolarHBondContact O-N 2.98Å; L275-Y279 WeakPolarHBondContact O-CB 3.39Å; L275-Y279 PolarHBondContact O-N 3.35Å
276	Y	41.4	Very low	41.8	Very low	129 Å²	129	109.5 Å²	109.5	51%	0.506	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-40.3	175	-157.6	-89.3	0	0	0	111.7	E272 L273 Y279 Y280	E272-Y276 WeakPolarHBondContact O-CB 3.5Å; E272-Y276 PolarHBondContact O-N 3.23Å; L273-Y276 PolarHBondContact O-N 2.61Å; Y276-Y279 PolarHBondContact O-N 2.73Å; Y276-Y280 AromaticContact CD1-CD2 3.85Å; Y276-Y280 HydrophobicContact CD1-CD2 3.85Å; Y276-Y280 AromaticContact CD1-CE2 3.96Å; Y276-Y280 HydrophobicContact CD1-CE2 3.96Å; Y276-Y280 AromaticContact CE1-CD2 3.63Å; Y276-Y280 HydrophobicContact CE1-CD2 3.63Å; Y276-Y280 AromaticContact CE1-CE2 3.27Å; Y276-Y280 HydrophobicContact CE1-CE2 3.27Å; Y276-Y280 HydrophobicContact CE2-CE2 4.36Å; Y276-Y280 AromaticContact CZ-CE2 3.52Å; Y276-Y280 WeakPolarHBondContact O-CD2 3.2Å; Y276-Y280 PolarHBondContact O-N 2.85Å; Y276-Y280 VanDerWaalsContact O-N 3.07Å
277	Q	42.4	Very low	41.1	Very low	100 Å²	100	114.7 Å²	114.7	47%	0.467	57%	0.567	S	S	.	*	H	α-helix	trans	-67.8	-42.1	176.9	-163.5	174.7	32.9	0	0	112	L273 L274 L275 Y280 Q281	L273-Q277 WeakPolarHBondContact O-CB 3.36Å; L273-Q277 PolarHBondContact O-N 3.3Å; L274-Q277 PolarHBondContact O-N 3.48Å; L275-Q277 VanDerWaalsContact C-N 3.35Å; L275-Q277 PolarHBondContact O-N 2.89Å; Q277-Y280 PolarHBondContact O-N 3.47Å; Q277-Q281 WeakPolarHBondContact O-CG 3.49Å; Q277-Q281 PolarHBondContact O-N 3.44Å
278	Q	44.4	Very low	40.6	Very low	115 Å²	115	116.8 Å²	116.8	54%	0.537	57%	0.571	S	S	.	*	H	α-helix	trans	-61.8	-42.4	171.9	-75.6	-178.3	-8.7	0	0	111.7	L274 L275 Y280 Q281 N282	L274-Q278 WeakPolarHBondContact O-CB 3.4Å; L274-Q278 WeakPolarHBondContact O-CG 3.2Å; L274-Q278 PolarHBondContact O-N 3.46Å; L275-Q278 PolarHBondContact O-N 2.98Å; Q278-Y280 VanDerWaalsContact C-N 3.34Å; Q278-Y280 PolarHBondContact O-N 3.39Å; Q278-Q281 PolarHBondContact O-N 3.47Å; Q278-N282 VanDerWaalsContact O-CB 3.3Å; Q278-N282 WeakPolarHBondContact O-CB 3.37Å; Q278-N282 VanDerWaalsContact O-CG 3.27Å; Q278-N282 PolarHBondContact O-N 3.13Å; Q278-N282 PolarHBondContact O-ND2 3.21Å
279	Y	39.3	Very low	39.9	Very low	149 Å²	149	120.5 Å²	120.5	58%	0.584	58%	0.584	S	S	*	*	H	α-helix	trans	-58.5	-43.8	176.6	-175.5	-92.7	0	0	0	111.8	L275 Y276 N283	L275-Y279 WeakPolarHBondContact O-CB 3.39Å; L275-Y279 PolarHBondContact O-N 3.35Å; Y276-Y279 PolarHBondContact O-N 2.73Å; Y279-N283 WeakPolarHBondContact O-CB 3.44Å; Y279-N283 PolarHBondContact O-N 3.17Å; Y279-N283 PolarHBondContact O-ND2 3.35Å
280	Y	36.4	Very low	38.8	Very low	127 Å²	127	122.4 Å²	122.4	50%	0.498	60%	0.596	S	S	.	*	H	α-helix	trans	-74.8	-30.9	177.5	-89.6	-94.5	0	0	0	114.2	Y276 Q277 Q278 N284	Y276-Y280 AromaticContact CD1-CD2 3.85Å; Y276-Y280 HydrophobicContact CD1-CD2 3.85Å; Y276-Y280 AromaticContact CD1-CE2 3.96Å; Y276-Y280 HydrophobicContact CD1-CE2 3.96Å; Y276-Y280 AromaticContact CE1-CD2 3.63Å; Y276-Y280 HydrophobicContact CE1-CD2 3.63Å; Y276-Y280 AromaticContact CE1-CE2 3.27Å; Y276-Y280 HydrophobicContact CE1-CE2 3.27Å; Y276-Y280 HydrophobicContact CE2-CE2 4.36Å; Y276-Y280 AromaticContact CZ-CE2 3.52Å; Y276-Y280 WeakPolarHBondContact O-CD2 3.2Å; Y276-Y280 PolarHBondContact O-N 2.85Å; Y276-Y280 VanDerWaalsContact O-N 3.07Å; Q277-Y280 PolarHBondContact O-N 3.47Å; Q278-Y280 VanDerWaalsContact C-N 3.34Å; Q278-Y280 PolarHBondContact O-N 3.39Å; Y280-N284 PolarHBondContact O-ND2 3.41Å
281	Q	36.7	Very low	38.1	Very low	123 Å²	123	126 Å²	126	58%	0.575	61%	0.613	S	S	*	*	H	α-helix	trans	-73.8	-41.8	175.1	-71.2	-172.1	14.9	0	0	112	Q277 Q278 N284	Q277-Q281 WeakPolarHBondContact O-CG 3.49Å; Q277-Q281 PolarHBondContact O-N 3.44Å; Q278-Q281 PolarHBondContact O-N 3.47Å; Q281-N284 PolarHBondContact O-N 2.06Å
282	N	34.7	Very low	36.7	Very low	107 Å²	107	127.7 Å²	127.7	57%	0.572	63%	0.626	S	S	*	*	H	α-helix	trans	-66.8	-38.8	179.1	-71.2	-24.3	0	0	0	112.6	Q278 N284	Q278-N282 VanDerWaalsContact O-CB 3.3Å; Q278-N282 WeakPolarHBondContact O-CB 3.37Å; Q278-N282 VanDerWaalsContact O-CG 3.27Å; Q278-N282 PolarHBondContact O-N 3.13Å; Q278-N282 PolarHBondContact O-ND2 3.21Å; N282-N284 PolarHBondContact O-N 3.27Å
283	N	35.4	Very low	35.6	Very low	96 Å²	96	129.5 Å²	129.5	51%	0.513	63%	0.634	S	S	.	*	H	α-helix	trans	-74.9	-16.7	-178.8	-79	-59.2	0	0	0	114.8	Y279	Y279-N283 WeakPolarHBondContact O-CB 3.44Å; Y279-N283 PolarHBondContact O-N 3.17Å; Y279-N283 PolarHBondContact O-ND2 3.35Å
284	N	34.2	Very low	34.8	Very low	122 Å²	122	130.9 Å²	130.9	65%	0.652	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-13.9	179.6	-90.1	-66.1	0	0	0	114.4	Y280 Q281 N282	Y280-N284 PolarHBondContact O-ND2 3.41Å; Q281-N284 PolarHBondContact O-N 2.06Å; N282-N284 PolarHBondContact O-N 3.27Å
285	N	33.1	Very low	33.5	Very low	132 Å²	132	133.7 Å²	133.7	71%	0.706	65%	0.652	S	S	*	*	S	Bend	trans	-92.5	-19	-176	-71.8	-33.6	0	0	0	114.5
286	N	28.6	Very low	32.3	Very low	133 Å²	133	138.8 Å²	138.8	71%	0.711	67%	0.665	S	S	*	*			trans	-108.4	102.3	-171	-80.7	-38.4	0	0	0	114.1	K288	N286-K288 VanDerWaalsContact C-N 3.29Å; N286-K288 PolarHBondContact O-N 3.22Å
287	N	25.7	Very low	31.6	Very low	150 Å²	150	140.1 Å²	140.1	80%	0.802	68%	0.676	S	S	*	*			trans	-75.6	70	171.5	-84	-78.3	0	0	0	112.4
288	K	29.9	Very low	30.9	Very low	175 Å²	175	142.8 Å²	142.8	76%	0.761	69%	0.693	S	S	*	*	S	Bend	trans	-161.6	128.8	163.6	-108.3	169.2	-174.6	178.6	0	110.1	N286 I290	N286-K288 VanDerWaalsContact C-N 3.29Å; N286-K288 PolarHBondContact O-N 3.22Å; K288-I290 HydrophobicContact CD-CD1 4.49Å; K288-I290 PolarHBondContact O-N 3.22Å
289	H	28.2	Very low	30.1	Very low	196 Å²	196	143.5 Å²	143.5	91%	0.907	71%	0.705	S	S	*	*			trans	-72.3	95	163.8	-96.1	-71.7	0	0	0	108.8
290	I	25.6	Very low	29.4	Very low	133 Å²	133	141 Å²	141	68%	0.682	71%	0.71	S	S	*	*			trans	-123.8	122.1	158	-61.5	175.4	0	0	0	104.5	K288 P292	K288-I290 HydrophobicContact CD-CD1 4.49Å; K288-I290 PolarHBondContact O-N 3.22Å; I290-P292 WeakPolarHBondContact O-CD 3.47Å
291	I	28.9	Very low	28.9	Very low	147 Å²	147	141 Å²	141	75%	0.754	72%	0.723	S	S	*	*			trans	-90.1	118.3	175.6	-62	173.4	0	0	0	106.3	E293	I291-E293 PolarHBondContact O-N 3.14Å
292	P	27.3	Very low	28.4	Very low	102 Å²	102	140.5 Å²	140.5	66%	0.662	73%	0.729	S	S	*	*			trans	-70.6	124.3	170.7	-14.6	30.6	0	0	0	109.4	I290 I294	I290-P292 WeakPolarHBondContact O-CD 3.47Å; P292-I294 PolarHBondContact O-N 2.92Å; P292-I294 VanDerWaalsContact O-N 3.13Å
293	E	24.4	Very low	28	Very low	180 Å²	180	140.8 Å²	140.8	84%	0.841	73%	0.734	S	S	*	*			trans	-79.5	90.2	176	-171.9	165.1	-139.8	0	0	109	I291 Q295	I291-E293 PolarHBondContact O-N 3.14Å; E293-Q295 PolarHBondContact O-N 3.41Å
294	I	28.4	Very low	27.5	Very low	139 Å²	139	142 Å²	142	71%	0.713	75%	0.746	S	S	*	*			trans	-75.1	99.2	178.1	-61.1	-179	0	0	0	108.9	P292 Y296	P292-I294 PolarHBondContact O-N 2.92Å; P292-I294 VanDerWaalsContact O-N 3.13Å; I294-Y296 HydrophobicContact CG2-CD2 4.23Å; I294-Y296 HydrophobicContact CG2-CE2 4.15Å; I294-Y296 PolarHBondContact O-N 2.93Å
295	Q	25.6	Very low	27.1	Very low	145 Å²	145	141.6 Å²	141.6	68%	0.678	75%	0.747	S	S	*	*			trans	-66.4	111.2	171.1	-63.5	173.3	-43.4	0	0	110	E293 H297	E293-Q295 PolarHBondContact O-N 3.41Å; Q295-H297 PolarHBondContact O-N 3.42Å
296	Y	27.8	Very low	26.7	Very low	214 Å²	214	142 Å²	142	84%	0.839	75%	0.75	S	S	*	*			trans	-83.6	104.6	158.6	-95.7	-89.8	0	0	0	108.8	I294	I294-Y296 HydrophobicContact CG2-CD2 4.23Å; I294-Y296 HydrophobicContact CG2-CE2 4.15Å; I294-Y296 PolarHBondContact O-N 2.93Å
297	H	27.6	Very low	26.6	Very low	158 Å²	158	141.6 Å²	141.6	73%	0.731	75%	0.752	S	S	*	*			trans	-69.5	141.4	173.6	-96	-97.3	0	0	0	111.1	Q295	Q295-H297 PolarHBondContact O-N 3.42Å
298	N	26.7	Very low	26.6	Very low	156 Å²	156	142 Å²	142	83%	0.834	75%	0.754	S	S	*	*			trans	-68	143.5	178.8	-58.9	-49.2	0	0	0	112
299	T	27	Very low	26.5	Very low	129 Å²	129	143.3 Å²	143.3	79%	0.791	76%	0.759	S	S	*	*			trans	-116.9	105.8	149.8	46.4	0	0	0	0	109.4
300	S	25.8	Very low	26.4	Very low	97 Å²	97	142.5 Å²	142.5	68%	0.678	76%	0.761	S	S	*	*			trans	45.3	124	130.2	66.5	0	0	0	0	118.1
301	T	25.5	Very low	26.4	Very low	127 Å²	127	141.7 Å²	141.7	78%	0.779	76%	0.758	S	S	*	*			cis	-164.6	169.8	37.2	43.9	0	0	0	0	109.4
302	T	26.2	Very low	26.2	Very low	113 Å²	113	146 Å²	146	69%	0.693	77%	0.766	S	S	*	*			cis	-158.3	162.2	-6.8	10.4	0	0	0	0	109.8
303	T	25.5	Very low	26.1	Very low	113 Å²	113	146.3 Å²	146.3	69%	0.693	76%	0.762	S	S	*	*			trans	54	98.7	152.3	52.2	0	0	0	0	119.2
304	T	25.2	Very low	26.1	Very low	122 Å²	122	144.6 Å²	144.6	75%	0.748	76%	0.757	S	S	*	*				76.4	137.9	80.6	60.1	0	0	0	0	114.4
305	T	25.4	Very low	25.9	Very low	112 Å²	112	145.7 Å²	145.7	69%	0.687	76%	0.763	S	S	*	*			cis	-158.8	172.2	14.2	-8.6	0	0	0	0	112.8
306	N	26.5	Very low	26.1	Very low	141 Å²	141	143.3 Å²	143.3	75%	0.754	76%	0.762	S	S	*	*			trans	68.4	103.3	163.4	-57.8	-9	0	0	0	116.5
307	V	25.7	Very low	25.9	Very low	125 Å²	125	141.1 Å²	141.1	76%	0.758	77%	0.766	S	S	*	*			cis	77.9	101.8	39.6	-171.5	0	0	0	0	114.2
308	N	25.7	Very low	25.8	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	77%	0.767	S	S	*	*				-168.9	159.4	126.6	-104.5	-41.1	0	0	0	112.6
309	K	27.7	Very low	25.8	Very low	203 Å²	203	142.4 Å²	142.4	88%	0.883	76%	0.764	S	S	*	*	S	Bend	trans	59	56.6	178.3	-67.4	-174.9	177.1	175.1	0	117.5
310	L	26	Very low	25.6	Very low	180 Å²	180	146.7 Å²	146.7	94%	0.942	77%	0.772	S	S	*	*			trans	-155.1	68.5	145.9	-120	177.8	0	0	0	111.6
311	N	24.9	Very low	25.6	Very low	115 Å²	115	144.3 Å²	144.3	62%	0.615	76%	0.758	S	S	*	*			trans	-150.3	106.5	173.1	-168.7	2.8	0	0	0	110.8	N313	N311-N313 PolarHBondContact OD1-N 3.12Å; N311-N313 PolarHBondContact OD1-ND2 3.33Å
312	Y	26.2	Very low	25.5	Very low	238 Å²	238	142.8 Å²	142.8	93%	0.933	75%	0.753	S	S	*	*			trans	-144	96	134.9	-120.4	-74	0	0	0	109.7
313	N	24.3	Very low	25.6	Very low	108 Å²	108	142.3 Å²	142.3	58%	0.578	75%	0.754	S	S	*	*			trans	-47.4	153.1	174	-86.4	-34.1	0	0	0	115.8	N311	N311-N313 PolarHBondContact OD1-N 3.12Å; N311-N313 PolarHBondContact OD1-ND2 3.33Å
314	I	25.1	Very low	25.5	Very low	144 Å²	144	144.2 Å²	144.2	74%	0.738	76%	0.758	S	S	*	*			trans	50.8	102.1	134.3	-53.9	164.3	0	0	0	116.8
315	I	24.4	Very low	25.5	Very low	162 Å²	162	144.8 Å²	144.8	83%	0.831	75%	0.752	S	S	*	*			trans	-174.3	163.9	133.5	-99	153.8	0	0	0	109.8
316	S	28.5	Very low	25.6	Very low	95 Å²	95	147.4 Å²	147.4	66%	0.664	76%	0.761	S	S	*	*			trans	89.3	22.6	167.2	96.2	0	0	0	0	120.5	N318	S316-N318 PolarHBondContact O-N 3.17Å
317	N	25.1	Very low	25.5	Very low	169 Å²	169	147.3 Å²	147.3	90%	0.904	76%	0.756	S	S	*	*	S	Bend	trans	-77.8	58.2	150	-118	-4.9	0	0	0	110
318	N	24.8	Very low	25.5	Very low	144 Å²	144	148.5 Å²	148.5	77%	0.77	76%	0.758	S	S	*	*			trans	170.1	99.6	169.1	-94.3	-23.6	0	0	0	108.9	S316	S316-N318 PolarHBondContact O-N 3.17Å
319	Y	25.5	Very low	25.7	Very low	197 Å²	197	149 Å²	149	77%	0.773	76%	0.76	S	S	*	*			trans	-170.2	108	149.9	-103.5	-61.5	0	0	0	111.3
320	K	24.6	Very low	25.6	Very low	218 Å²	218	146.8 Å²	146.8	95%	0.948	76%	0.758	S	S	*	*			trans	-154	37.2	157.9	-136.2	173.3	-170.1	173.4	0	114.7
321	A	23.9	Very low	25.7	Very low	48 Å²	48	146.8 Å²	146.8	40%	0.397	75%	0.753	S	S	.	*	S	Bend	trans	-149.1	111.2	169.1	0	0	0	0	0	110.2
322	S	25	Very low	26	Very low	94 Å²	94	148.6 Å²	148.6	66%	0.657	76%	0.762	S	S	*	*			trans	57.3	119.3	167.5	-45.9	0	0	0	0	118.9
323	S	27.8	Very low	26.1	Very low	104 Å²	104	143.7 Å²	143.7	73%	0.727	75%	0.752	S	S	*	*				-150.3	140.1	121.7	-153.4	0	0	0	0	111.1
324	I	23.9	Very low	26.4	Very low	152 Å²	152	144.7 Å²	144.7	78%	0.779	76%	0.757	S	S	*	*			trans	-120.7	143.4	167.9	-69.6	170.5	0	0	0	104.9
325	H	24.3	Very low	26.5	Very low	134 Å²	134	142.1 Å²	142.1	62%	0.62	75%	0.752	S	S	*	*			trans	56.1	125.9	-171.1	-72.6	-73	0	0	0	115.8	E327	H325-E327 IonicContact CE1-OE2 3.51Å; H325-E327 IonicContact ND1-OE2 3.26Å; H325-E327 PolarHBondContact ND1-OE2 3.21Å
326	L	28.2	Very low	26.8	Very low	167 Å²	167	141.8 Å²	141.8	87%	0.874	75%	0.747	S	S	*	*				-149.7	118.5	104	-136.8	74.1	0	0	0	108.9
327	E	24	Very low	26.9	Very low	139 Å²	139	146 Å²	146	65%	0.65	75%	0.754	S	S	*	*			trans	-94.7	166.2	163.6	-73.1	158.4	106.3	0	0	108.7	H325	H325-E327 IonicContact CE1-OE2 3.51Å; H325-E327 IonicContact ND1-OE2 3.26Å; H325-E327 PolarHBondContact ND1-OE2 3.21Å
328	N	26.4	Very low	27	Very low	150 Å²	150	145 Å²	145	80%	0.802	75%	0.748	S	S	*	*			trans	70.5	128.5	-169.2	-39.2	-70.5	0	0	0	111.8
329	L	30.2	Very low	27.3	Very low	168 Å²	168	146.2 Å²	146.2	88%	0.88	75%	0.749	S	S	*	*			cis	-134.5	144.4	28.6	-74.4	154.4	0	0	0	112.7
330	N	24.8	Very low	27.3	Very low	156 Å²	156	142.3 Å²	142.3	83%	0.834	75%	0.746	S	S	*	*			trans	-90.1	171.4	162.9	-87.3	-37.3	0	0	0	110.8
331	Q	27.5	Very low	27.4	Very low	180 Å²	180	138.7 Å²	138.7	84%	0.841	74%	0.735	S	S	*	*			trans	107.4	132.6	156	-55.7	-174.2	12.1	0	0	118
332	L	30.8	Very low	27.6	Very low	153 Å²	153	145.1 Å²	145.1	80%	0.801	76%	0.757	S	S	*	*			trans	86.1	94.7	160	-60.1	159.5	0	0	0	119.7
333	D	29	Very low	27.6	Very low	135 Å²	135	150 Å²	150	72%	0.722	77%	0.767	S	S	*	*				33.3	145.9	101.1	-74.2	28	0	0	0	119.6
334	N	30.3	Very low	27.5	Very low	129 Å²	129	151.9 Å²	151.9	69%	0.69	78%	0.775	S	S	*	*			cis	-158.8	170.3	12.5	-129.8	-40.4	0	0	0	113.3
335	S	28.1	Very low	27.9	Very low	90 Å²	90	150.3 Å²	150.3	63%	0.629	77%	0.774	S	S	*	*			trans	17.6	150.7	150.9	68.1	0	0	0	0	122.5
336	H	30.8	Very low	28.1	Very low	156 Å²	156	151.6 Å²	151.6	72%	0.722	79%	0.785	S	S	*	*			cis	-175.7	149.9	39.5	-145.3	48	0	0	0	113.6
337	F	30.9	Very low	28.2	Very low	184 Å²	184	151.4 Å²	151.4	81%	0.807	78%	0.779	S	S	*	*			trans	77.9	168	146.5	-90.1	-126.3	0	0	0	124.2
338	D	25.9	Very low	28.2	Very low	148 Å²	148	150 Å²	150	79%	0.791	78%	0.784	S	S	*	*				-155.1	-165.8	-125.8	-150.9	-21.4	0	0	0	115
339	E	31.4	Very low	28.3	Very low	168 Å²	168	147.5 Å²	147.5	79%	0.785	78%	0.779	S	S	*	*			trans	78.7	119.2	171.2	-59.6	-167.9	152.3	0	0	117
340	T	25.9	Very low	28.1	Very low	115 Å²	115	145.9 Å²	145.9	71%	0.706	77%	0.771	S	S	*	*				80.2	136.9	61.1	71.9	0	0	0	0	114.1
341	I	27.4	Very low	28.2	Very low	142 Å²	142	146.1 Å²	146.1	73%	0.728	77%	0.767	S	S	*	*				-165.2	141.4	55.8	-86.4	-173.5	0	0	0	114.7
342	Q	26.7	Very low	28.2	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	77%	0.767	S	S	*	*			trans	61.1	178.9	148.5	-68.1	180	10.8	0	0	126.3
343	F	25.3	Very low	28	Very low	196 Å²	196	144.3 Å²	144.3	86%	0.86	77%	0.767	S	S	*	*			trans	-134.2	161.3	-153.1	-80.8	-106.7	0	0	0	114
344	T	26.6	Very low	28.1	Very low	145 Å²	145	141.4 Å²	141.4	89%	0.89	77%	0.769	S	S	*	*				178.5	147.8	120.1	24.2	0	0	0	0	114
345	P	31.8	Very low	27.9	Very low	118 Å²	118	141.2 Å²	141.2	77%	0.766	78%	0.776	S	S	*	*			trans	-129.6	157.6	176.2	41.3	-28.6	0	0	0	116.9
346	L	28.5	Very low	27.9	Very low	162 Å²	162	144.5 Å²	144.5	85%	0.848	79%	0.785	S	S	*	*			trans	-157.1	166.9	169.3	-85.7	164.7	0	0	0	109.2
347	Q	28.9	Very low	27.7	Very low	163 Å²	163	143.8 Å²	143.8	76%	0.762	79%	0.786	S	S	*	*				-171.6	145.7	-60.1	173.1	171.7	-15.3	0	0	108.9
348	S	25.7	Very low	27.7	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	79%	0.787	S	S	*	*			trans	72.5	162.2	173.4	90	0	0	0	0	116.1
349	S	27.9	Very low	27.9	Very low	99 Å²	99	139.9 Å²	139.9	69%	0.692	78%	0.781	S	S	*	*			cis	-146.6	156.6	8.4	-75.9	0	0	0	0	114
350	L	26.3	Very low	27.8	Very low	133 Å²	133	142.4 Å²	142.4	70%	0.696	79%	0.785	S	S	*	*			trans	14.5	133.2	149.7	-77.2	60.8	0	0	0	123.4
351	E	25.4	Very low	28	Very low	161 Å²	161	144 Å²	144	75%	0.752	79%	0.789	S	S	*	*				66.4	157.2	124	-62.9	158.4	-169.5	0	0	120
352	E	27.6	Very low	28.1	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	78%	0.784	S	S	*	*			cis	-146	-166.3	8.3	-144.3	174.7	-166.8	0	0	112.7
353	S	28.3	Very low	28.3	Very low	114 Å²	114	137.2 Å²	137.2	80%	0.797	78%	0.784	S	S	*	*			trans	-86.7	159.2	-162.9	58.6	0	0	0	0	118.9
354	G	29.3	Very low	28.4	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	78%	0.779	S	S	*	*			trans	-172.3	138.1	161	0	0	0	0	0	114.3
355	C	26.1	Very low	28.7	Very low	125 Å²	125	136.4 Å²	136.4	85%	0.845	77%	0.774	S	S	*	*			trans	-134.6	-170.6	-173.7	-67.3	0	0	0	0	112.7
356	I	28.3	Very low	28.5	Very low	160 Å²	160	136.5 Å²	136.5	82%	0.821	77%	0.773	S	S	*	*			trans	94.1	110.6	-178.6	-55.4	160.4	0	0	0	111
357	D	28.1	Very low	28.6	Very low	140 Å²	140	134.8 Å²	134.8	75%	0.749	77%	0.774	S	S	*	*			cis	93.3	134	40.2	-174.6	40.5	0	0	0	114
358	L	30	Very low	28.5	Very low	155 Å²	155	133.4 Å²	133.4	81%	0.812	78%	0.777	S	S	*	*			trans	169	148.2	139.7	-90.6	168.8	0	0	0	112.6
359	S	29.4	Very low	28.8	Very low	95 Å²	95	136.1 Å²	136.1	66%	0.664	78%	0.783	S	S	*	*			trans	-103.8	173.7	-171.7	61.1	0	0	0	0	114.2
360	Y	30.6	Very low	28.9	Very low	222 Å²	222	139 Å²	139	87%	0.871	79%	0.786	S	S	*	*			trans	-160.3	161	140.4	-129.1	-93.3	0	0	0	115.3
361	N	29	Very low	28.9	Very low	148 Å²	148	139.4 Å²	139.4	79%	0.791	79%	0.789	S	S	*	*			trans	-91.7	173.8	-178.1	-66.8	-68.6	0	0	0	112.7
362	G	29.9	Very low	29.1	Very low	61 Å²	61	141.1 Å²	141.1	63%	0.629	79%	0.794	S	S	*	*			cis	151.5	-171.1	0.2	0	0	0	0	0	111.8
363	S	30.7	Very low	29.1	Very low	121 Å²	121	141.3 Å²	141.3	85%	0.846	80%	0.795	S	S	*	*			trans	72.6	156.9	180	-41.7	0	0	0	0	115.5
364	N	28.5	Very low	29.2	Very low	142 Å²	142	143.1 Å²	143.1	76%	0.759	80%	0.801	S	S	*	*			cis	-155.1	-170.4	0.8	-132.8	-40.1	0	0	0	107.1
365	K	33.2	Very low	29	Very low	183 Å²	183	145.1 Å²	145.1	80%	0.796	80%	0.803	S	S	*	*			cis	-154.4	-152.2	8.9	-146.6	170	-175.8	176.7	0	110.8
366	T	25.9	Very low	29.2	Very low	120 Å²	120	147.5 Å²	147.5	74%	0.736	81%	0.807	S	S	*	*			trans	-125.9	157.1	-170	53.3	0	0	0	0	114.9
367	S	32.3	Very low	29.2	Very low	126 Å²	126	146.4 Å²	146.4	88%	0.881	80%	0.803	S	S	*	*			trans	-163.8	150.6	144.3	-82.7	0	0	0	0	112.4
368	T	26.6	Very low	29.3	Very low	134 Å²	134	145.7 Å²	145.7	82%	0.822	81%	0.806	S	S	*	*			trans	-131.4	154.6	-176.5	49.8	0	0	0	0	111.8
369	N	31	Very low	29.2	Very low	165 Å²	165	142.8 Å²	142.8	88%	0.882	80%	0.798	S	S	*	*			trans	-156.5	166.1	150.5	-124	-37.2	0	0	0	112.9
370	Q	29.8	Very low	29.1	Very low	158 Å²	158	145.2 Å²	145.2	74%	0.738	80%	0.804	S	S	*	*			trans	-123.3	171.9	-160.4	-64.3	179.6	-19.1	0	0	114.7
371	N	26.8	Very low	29.1	Very low	143 Å²	143	142.4 Å²	142.4	77%	0.765	80%	0.804	S	S	*	*			trans	81	151.8	164	-53.6	-59.8	0	0	0	115.6
372	K	30.4	Very low	28.9	Very low	197 Å²	197	142.8 Å²	142.8	86%	0.857	80%	0.804	S	S	*	*			cis	-146.4	155.9	15.8	-150.8	168.7	-171.8	177.2	0	111.9
373	Q	27.6	Very low	28.8	Very low	185 Å²	185	146.7 Å²	146.7	86%	0.864	82%	0.815	S	S	*	*			trans	-88.6	146.3	171.7	-67.7	176.7	-19.2	0	0	111.9
374	T	28.9	Very low	28.5	Very low	152 Å²	152	145.4 Å²	145.4	93%	0.933	81%	0.806	S	S	*	*			trans	-149.3	142.1	146.7	9.7	0	0	0	0	109.3
375	S	26.1	Very low	28.3	Very low	115 Å²	115	143 Å²	143	80%	0.804	80%	0.801	S	S	*	*			trans	-119.8	147.4	175.3	58	0	0	0	0	110
376	L	29.7	Very low	27.8	Very low	176 Å²	176	141.6 Å²	141.6	92%	0.921	80%	0.802	S	S	*	*			trans	-162.3	149.4	160.7	-108.6	164.5	0	0	0	108.9
377	N	28.8	Very low	27.7	Very low	137 Å²	137	141.7 Å²	141.7	73%	0.733	80%	0.802	S	S	*	*			trans	-156.8	133.7	-173.5	-168.1	52.6	0	0	0	108.6
378	P	30.8	Very low	27.4	Very low	125 Å²	125	147.3 Å²	147.3	81%	0.812	81%	0.806	S	S	*	*			trans	-127.8	158.6	155.7	35.6	-23.2	0	0	0	112.9
379	S	27.5	Very low	27.6	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	79%	0.792	S	S	*	*			trans	-108.7	173.8	-174.6	-51.9	0	0	0	0	112.5
380	N	27	Very low	27.7	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	77%	0.767	S	S	*	*			trans	83	114.5	159.9	-51.3	-13.8	0	0	0	117.5
381	N	31.3	Very low	27.9	Very low	163 Å²	163	137 Å²	137	87%	0.872	76%	0.757	S	S	*	*				-151.4	153.3	103.8	-107.1	-23.5	0	0	0	111.3
382	I	23.6	Very low	28.4	Very low	155 Å²	155	136.3 Å²	136.3	80%	0.795	75%	0.753	S	S	*	*			trans	-116.9	127.4	176.5	-64.6	169.9	0	0	0	107.6
383	V	28.5	Very low	29	Very low	143 Å²	143	129 Å²	129	87%	0.867	73%	0.725	S	S	*	*			trans	-134.1	143.6	160.5	-177.8	0	0	0	0	107.7
384	S	24.2	Very low	30	Very low	94 Å²	94	123.8 Å²	123.8	66%	0.657	70%	0.703	S	S	*	*			trans	-86.9	172.2	-166.1	-55.2	0	0	0	0	114.4
385	S	23.8	Very low	30.8	Very low	93 Å²	93	120.9 Å²	120.9	65%	0.65	68%	0.682	S	S	*	*			trans	67.3	120.4	154.9	38.4	0	0	0	0	119.4
386	D	23.4	Very low	32	Very low	153 Å²	153	117.9 Å²	117.9	82%	0.818	66%	0.661	S	S	*	*			trans	61.4	74.8	133.5	-47.3	-27.3	0	0	0	119.6
387	T	24.8	Very low	33	Very low	121 Å²	121	110.4 Å²	110.4	74%	0.742	62%	0.622	S	S	*	*			trans	-169.1	75	147.2	13.5	0	0	0	0	113.4	S389	T387-S389 PolarHBondContact O-N 2.94Å
388	Y	25.3	Very low	34.3	Very low	244 Å²	244	107.8 Å²	107.8	96%	0.957	61%	0.608	S	S	*	*			trans	-83.1	98.7	173.2	-101.5	-88	0	0	0	112.3
389	S	31.3	Very low	35.4	Very low	75 Å²	75	106.3 Å²	106.3	52%	0.524	59%	0.593	S	S	.	*	S	Bend		-177	-27.5	127.9	-162.4	0	0	0	0	115.5	T387	T387-S389 PolarHBondContact O-N 2.94Å
390	N	32.2	Very low	36.7	Very low	66 Å²	66	104.3 Å²	104.3	35%	0.353	57%	0.574	S	S	.	*	S	Bend	trans	-88.6	-42.7	-166.8	-72.7	-3.5	0	0	0	114.7	N392 V393 N394	N390-N392 PolarHBondContact O-N 3.4Å; N390-V393 PolarHBondContact O-N 3.47Å; N390-N394 PolarHBondContact O-N 3.26Å
391	N	34	Very low	38	Very low	101 Å²	101	101.9 Å²	101.9	54%	0.54	56%	0.558	S	S	.	*	H	α-helix	trans	-60.2	-28.2	-169.3	-59	1.3	0	0	0	113.6	V393 N394 N395	N391-V393 VanDerWaalsContact C-N 3.3Å; N391-V393 PolarHBondContact O-N 2.95Å; N391-N394 PolarHBondContact O-N 3.32Å; N391-N395 WeakPolarHBondContact O-CB 3.48Å; N391-N395 VanDerWaalsContact O-CG 3.27Å; N391-N395 PolarHBondContact O-N 3.42Å; N391-N395 PolarHBondContact O-OD1 3.06Å
392	N	36.5	Very low	39.3	Very low	128 Å²	128	100.5 Å²	100.5	68%	0.684	55%	0.547	S	S	*	.	H	α-helix	trans	-73.8	-19.7	179	-154.7	35.7	0	0	0	113.3	N390 S396	N390-N392 PolarHBondContact O-N 3.4Å; N392-S396 PolarHBondContact O-N 2.97Å; N392-S396 PolarHBondContact O-OG 2.91Å
393	V	43.4	Very low	40.5	Very low	44 Å²	44	99.2 Å²	99.2	27%	0.267	54%	0.537	S	S	.	.	H	α-helix	trans	-80.8	-46.2	172.7	-178.4	0	0	0	0	109.8	N390 N391 S396 I397	N390-V393 PolarHBondContact O-N 3.47Å; N391-V393 VanDerWaalsContact C-N 3.3Å; N391-V393 PolarHBondContact O-N 2.95Å; V393-S396 WeakPolarHBondContact O-CA 3.5Å; V393-S396 WeakPolarHBondContact O-CB 3.47Å; V393-S396 PolarHBondContact O-N 3.38Å; V393-I397 HydrophobicContact CG1-CD1 4.17Å; V393-I397 WeakPolarHBondContact O-CG1 3.37Å; V393-I397 PolarHBondContact O-N 2.88Å
394	N	49.2	Very low	41.4	Very low	75 Å²	75	93.8 Å²	93.8	40%	0.401	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-50.5	178.6	-64.3	7.9	0	0	0	111	N390 N391 S396 I397 D398	N390-N394 PolarHBondContact O-N 3.26Å; N391-N394 PolarHBondContact O-N 3.32Å; N394-S396 PolarHBondContact O-N 2.95Å; N394-I397 WeakPolarHBondContact O-CA 3.39Å; N394-I397 WeakPolarHBondContact O-CB 3.47Å; N394-I397 PolarHBondContact O-N 3.2Å; N394-D398 VanDerWaalsContact O-CG 3.25Å; N394-D398 PolarHBondContact O-N 2.74Å
395	N	46	Very low	42.6	Very low	90 Å²	90	94.1 Å²	94.1	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-57.8	-25.8	174.1	-68.9	16.1	0	0	0	113	N391 N399	N391-N395 WeakPolarHBondContact O-CB 3.48Å; N391-N395 VanDerWaalsContact O-CG 3.27Å; N391-N395 PolarHBondContact O-N 3.42Å; N391-N395 PolarHBondContact O-OD1 3.06Å; N395-N399 PolarHBondContact O-N 3.48Å; N395-N399 PolarHBondContact O-ND2 2.73Å
396	S	50	Low	43.7	Very low	53 Å²	53	97.3 Å²	97.3	37%	0.371	51%	0.514	S	S	.	.	H	α-helix	trans	-77.1	-34.8	173.8	-61.4	0	0	0	0	112	N392 V393 N394 I400	N392-S396 PolarHBondContact O-N 2.97Å; N392-S396 PolarHBondContact O-OG 2.91Å; V393-S396 WeakPolarHBondContact O-CA 3.5Å; V393-S396 WeakPolarHBondContact O-CB 3.47Å; V393-S396 PolarHBondContact O-N 3.38Å; N394-S396 PolarHBondContact O-N 2.95Å; S396-I400 WeakPolarHBondContact O-CB 3.28Å; S396-I400 WeakPolarHBondContact O-CD1 3.48Å; S396-I400 WeakPolarHBondContact O-CG1 3.44Å; S396-I400 PolarHBondContact O-N 3.39Å; S396-I400 VanDerWaalsContact O-N 3.16Å
397	I	50.6	Low	44.8	Very low	18 Å²	18	91 Å²	91	9%	0.092	48%	0.482	C	S	.	.	H	α-helix	trans	-66.9	-48.9	174.4	-67.2	166.2	0	0	0	109.8	V393 N394 N399 I400 E401 Q423	V393-I397 HydrophobicContact CG1-CD1 4.17Å; V393-I397 WeakPolarHBondContact O-CG1 3.37Å; V393-I397 PolarHBondContact O-N 2.88Å; N394-I397 WeakPolarHBondContact O-CA 3.39Å; N394-I397 WeakPolarHBondContact O-CB 3.47Å; N394-I397 PolarHBondContact O-N 3.2Å; I397-N399 VanDerWaalsContact C-N 3.28Å; I397-N399 PolarHBondContact O-N 3.26Å; I397-I400 CarbonylContact O-C 3.57Å; I397-I400 WeakPolarHBondContact O-CA 3.38Å; I397-I400 PolarHBondContact O-N 3.45Å; I397-E401 HydrophobicContact CG2-CG 4.28Å; I397-E401 WeakPolarHBondContact CG2-OE1 3.24Å; I397-E401 PolarHBondContact O-N 3.5Å; I397-Q423 HydrophobicContact CD1-CG 4.18Å
398	D	57.3	Low	45.8	Very low	82 Å²	82	91.6 Å²	91.6	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-56.2	-40.8	-179.4	-53.3	-33.2	0	0	0	112.3	N394 Q402	N394-D398 VanDerWaalsContact O-CG 3.25Å; N394-D398 PolarHBondContact O-N 2.74Å; D398-Q402 PolarHBondContact O-N 2.87Å; D398-Q402 VanDerWaalsContact O-N 3.08Å
399	N	53.2	Low	46.9	Very low	94 Å²	94	86.5 Å²	86.5	50%	0.503	47%	0.466	S	S	.	.	H	α-helix	trans	-72.9	-30.8	176.2	-79.8	-81.3	0	0	0	113	N395 I397 H403	N395-N399 PolarHBondContact O-N 3.48Å; N395-N399 PolarHBondContact O-ND2 2.73Å; I397-N399 VanDerWaalsContact C-N 3.28Å; I397-N399 PolarHBondContact O-N 3.26Å; N399-H403 PolarHBondContact O-CD2 3.17Å; N399-H403 PolarHBondContact O-N 3.25Å; N399-H403 VanDerWaalsContact O-N 3.15Å
400	I	54.8	Low	47.5	Very low	51 Å²	51	90.6 Å²	90.6	26%	0.262	48%	0.481	S	S	.	.	H	α-helix	trans	-73.7	-35.2	174.9	-71.3	166.7	0	0	0	110.6	S396 I397 H403 A404 I415 I419 L422	S396-I400 WeakPolarHBondContact O-CB 3.28Å; S396-I400 WeakPolarHBondContact O-CD1 3.48Å; S396-I400 WeakPolarHBondContact O-CG1 3.44Å; S396-I400 PolarHBondContact O-N 3.39Å; S396-I400 VanDerWaalsContact O-N 3.16Å; I397-I400 CarbonylContact O-C 3.57Å; I397-I400 WeakPolarHBondContact O-CA 3.38Å; I397-I400 PolarHBondContact O-N 3.45Å; I400-H403 PolarHBondContact O-N 2.88Å; I400-A404 WeakPolarHBondContact O-CB 3.49Å; I400-A404 PolarHBondContact O-N 2.94Å; I400-I415 HydrophobicContact CG2-CG2 3.9Å; I400-I419 HydrophobicContact CG2-CD1 4.03Å; I400-I419 HydrophobicContact CG2-CG1 3.69Å; I400-L422 HydrophobicContact CD1-CD1 3.63Å
401	E	54.6	Low	48.1	Very low	97 Å²	97	89.3 Å²	89.3	45%	0.453	48%	0.477	S	S	.	.	H	α-helix	trans	-67.5	-41	173.8	-71	-176.6	-176.3	0	0	111.6	I397 H403 A404 S405 I419	I397-E401 HydrophobicContact CG2-CG 4.28Å; I397-E401 WeakPolarHBondContact CG2-OE1 3.24Å; I397-E401 PolarHBondContact O-N 3.5Å; E401-H403 PolarHBondContact O-N 3.35Å; E401-A404 WeakPolarHBondContact O-CB 3.47Å; E401-A404 PolarHBondContact O-N 3.45Å; E401-A404 VanDerWaalsContact O-N 3.11Å; E401-S405 PolarHBondContact O-N 3.12Å; E401-S405 PolarHBondContact O-OG 3.46Å; E401-I419 HydrophobicContact CG-CD1 4.22Å
402	Q	59.7	Low	49.3	Very low	134 Å²	134	89.1 Å²	89.1	63%	0.626	47%	0.471	S	S	*	.	H	α-helix	trans	-60.1	-43.1	171.3	-75	-173.3	-5.4	0	0	112.6	D398 A404 S405	D398-Q402 PolarHBondContact O-N 2.87Å; D398-Q402 VanDerWaalsContact O-N 3.08Å; Q402-A404 VanDerWaalsContact C-N 3.31Å; Q402-A404 PolarHBondContact O-N 3.47Å; Q402-S405 PolarHBondContact O-N 3.41Å; Q402-S405 PolarHBondContact O-OG 3.4Å
403	H	48.3	Very low	50.2	Low	127 Å²	127	87 Å²	87	59%	0.588	47%	0.465	S	S	*	.	H	α-helix	trans	-71.2	-21.5	174	-80.9	-47.5	0	0	0	114.1	N399 I400 E401 E406	N399-H403 PolarHBondContact O-CD2 3.17Å; N399-H403 PolarHBondContact O-N 3.25Å; N399-H403 VanDerWaalsContact O-N 3.15Å; I400-H403 PolarHBondContact O-N 2.88Å; E401-H403 PolarHBondContact O-N 3.35Å; H403-E406 IonicContact ND1-OE2 3.01Å; H403-E406 PolarHBondContact O-N 3.46Å
404	A	47.4	Very low	50.3	Low	29 Å²	29	90.5 Å²	90.5	24%	0.24	48%	0.481	C	S	.	.	H	α-helix	trans	-66.2	-37.9	173.2	0	0	0	0	0	111.7	I400 E401 Q402 E406 S407 I415	I400-A404 WeakPolarHBondContact O-CB 3.49Å; I400-A404 PolarHBondContact O-N 2.94Å; E401-A404 WeakPolarHBondContact O-CB 3.47Å; E401-A404 PolarHBondContact O-N 3.45Å; E401-A404 VanDerWaalsContact O-N 3.11Å; Q402-A404 VanDerWaalsContact C-N 3.31Å; Q402-A404 PolarHBondContact O-N 3.47Å; A404-E406 VanDerWaalsContact C-N 3.26Å; A404-E406 PolarHBondContact O-N 2.92Å; A404-S407 WeakPolarHBondContact O-CB 3.49Å; A404-S407 PolarHBondContact O-N 3.12Å; A404-S407 PolarHBondContact O-OG 3.29Å; A404-I415 HydrophobicContact CB-CG2 3.92Å
405	S	49.7	Very low	50.9	Low	101 Å²	101	88.7 Å²	88.7	71%	0.706	47%	0.471	S	S	*	.	H	α-helix	trans	-61.9	-28	177.3	9.3	0	0	0	0	114.5	E401 Q402	E401-S405 PolarHBondContact O-N 3.12Å; E401-S405 PolarHBondContact O-OG 3.46Å; Q402-S405 PolarHBondContact O-N 3.41Å; Q402-S405 PolarHBondContact O-OG 3.4Å
406	E	46.4	Very low	51.9	Low	161 Å²	161	89 Å²	89	75%	0.752	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	1.1	-179.6	-58.4	-175	140.6	0	0	112.9	H403 A404	H403-E406 IonicContact ND1-OE2 3.01Å; H403-E406 PolarHBondContact O-N 3.46Å; A404-E406 VanDerWaalsContact C-N 3.26Å; A404-E406 PolarHBondContact O-N 2.92Å
407	S	46.7	Very low	52.8	Low	21 Å²	21	92.6 Å²	92.6	15%	0.147	48%	0.479	C	S	.	.	S	Bend	trans	-91.1	138.9	-166.9	76.4	0	0	0	0	114	A404 S411 I415	A404-S407 WeakPolarHBondContact O-CB 3.49Å; A404-S407 PolarHBondContact O-N 3.12Å; A404-S407 PolarHBondContact O-OG 3.29Å; S407-S411 WeakPolarHBondContact CB-OG 3.49Å; S407-I415 WeakPolarHBondContact OG-CD1 3.46Å
408	N	45.2	Very low	52.7	Low	133 Å²	133	94.7 Å²	94.7	71%	0.711	50%	0.495	S	S	*	.			trans	-65.8	144.1	180	-159.4	-3.6	0	0	0	110.6	L410 S411	N408-L410 PolarHBondContact O-N 3.02Å; N408-S411 PolarHBondContact N-OG 3.43Å; N408-S411 WeakPolarHBondContact O-CB 3.28Å; N408-S411 PolarHBondContact O-N 3.37Å; N408-S411 PolarHBondContact O-OG 3.01Å
409	E	48.5	Very low	52.9	Low	137 Å²	137	91 Å²	91	64%	0.64	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-46.6	-43	-166.6	-72	-102	98.1	0	0	114.2	S411 K412	E409-S411 PolarHBondContact O-N 3.4Å; E409-S411 VanDerWaalsContact O-N 3.13Å; E409-K412 PolarHBondContact O-N 3.37Å; E409-K412 IonicContact OE1-NZ 2.67Å; E409-K412 PolarHBondContact OE1-NZ 3.47Å
410	L	42.9	Very low	53.4	Low	161 Å²	161	90.6 Å²	90.6	84%	0.843	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-63.8	-17.1	-178.4	-151.7	73.2	0	0	0	114.3	N408	N408-L410 PolarHBondContact O-N 3.02Å
411	S	45.7	Very low	53.4	Low	38 Å²	38	93.2 Å²	93.2	27%	0.266	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-99.1	-22.4	-177.3	65.6	0	0	0	0	114.3	S407 N408 E409 L414 I415	S407-S411 WeakPolarHBondContact CB-OG 3.49Å; N408-S411 PolarHBondContact N-OG 3.43Å; N408-S411 WeakPolarHBondContact O-CB 3.28Å; N408-S411 PolarHBondContact O-N 3.37Å; N408-S411 PolarHBondContact O-OG 3.01Å; E409-S411 PolarHBondContact O-N 3.4Å; E409-S411 VanDerWaalsContact O-N 3.13Å; S411-L414 WeakPolarHBondContact O-CB 3.38Å; S411-L414 PolarHBondContact O-N 3.32Å; S411-I415 WeakPolarHBondContact O-CG1 3.46Å; S411-I415 PolarHBondContact O-N 2.89Å
412	K	59.4	Low	53.3	Low	97 Å²	97	91.5 Å²	91.5	42%	0.422	48%	0.478	S	S	.	.	H	α-helix	trans	-47.5	-47.9	176.3	-63.9	177.7	-179.5	175.4	0	114.1	E409 L414 I415 Q416	E409-K412 PolarHBondContact O-N 3.37Å; E409-K412 IonicContact OE1-NZ 2.67Å; E409-K412 PolarHBondContact OE1-NZ 3.47Å; K412-L414 VanDerWaalsContact C-N 3.34Å; K412-L414 PolarHBondContact O-N 2.85Å; K412-I415 PolarHBondContact O-N 3.38Å; K412-Q416 PolarHBondContact O-N 2.97Å
413	P	54.8	Low	53.1	Low	85 Å²	85	89.3 Å²	89.3	55%	0.552	47%	0.467	S	S	*	.	H	α-helix	trans	-68.9	-27.8	179.6	26.3	-35.1	0	0	0	114.1	K417	P413-K417 WeakPolarHBondContact O-CB 3.35Å; P413-K417 PolarHBondContact O-N 3.06Å
414	L	45.2	Very low	53.5	Low	116 Å²	116	89.1 Å²	89.1	61%	0.607	47%	0.467	S	S	*	.	H	α-helix	trans	-74	-37.7	175.4	-67.9	169.3	0	0	0	111.3	S411 K412 S418	S411-L414 WeakPolarHBondContact O-CB 3.38Å; S411-L414 PolarHBondContact O-N 3.32Å; K412-L414 VanDerWaalsContact C-N 3.34Å; K412-L414 PolarHBondContact O-N 2.85Å; L414-S418 PolarHBondContact O-N 3.43Å; L414-S418 VanDerWaalsContact O-N 3.15Å; L414-S418 PolarHBondContact O-OG 3.03Å
415	I	62.2	Low	53.2	Low	38 Å²	38	95.9 Å²	95.9	20%	0.195	49%	0.487	C	S	.	.	H	α-helix	trans	-65.9	-47.9	173.9	-63.8	164.9	0	0	0	109.7	I400 A404 S407 S411 K412 K417 S418 I419	I400-I415 HydrophobicContact CG2-CG2 3.9Å; A404-I415 HydrophobicContact CB-CG2 3.92Å; S407-I415 WeakPolarHBondContact OG-CD1 3.46Å; S411-I415 WeakPolarHBondContact O-CG1 3.46Å; S411-I415 PolarHBondContact O-N 2.89Å; K412-I415 PolarHBondContact O-N 3.38Å; I415-K417 VanDerWaalsContact C-N 3.34Å; I415-K417 PolarHBondContact O-N 3.44Å; I415-S418 WeakPolarHBondContact O-CA 3.48Å; I415-S418 WeakPolarHBondContact O-CB 3.36Å; I415-S418 PolarHBondContact O-N 2.82Å; I415-I419 HydrophobicContact CG2-CD1 4.07Å; I415-I419 WeakPolarHBondContact O-CG1 3.28Å; I415-I419 PolarHBondContact O-N 3.3Å
416	Q	68.1	Low	53	Low	97 Å²	97	92.5 Å²	92.5	45%	0.453	46%	0.463	S	S	.	.	H	α-helix	trans	-59.3	-41.7	177.1	-170.4	63.3	58.3	0	0	112.7	K412 S418 I419 N420	K412-Q416 PolarHBondContact O-N 2.97Å; Q416-S418 VanDerWaalsContact C-N 3.27Å; Q416-S418 PolarHBondContact O-N 2.73Å; Q416-I419 PolarHBondContact O-N 3.05Å; Q416-N420 PolarHBondContact NE2-OD1 3.47Å; Q416-N420 VanDerWaalsContact O-CG 3.22Å; Q416-N420 PolarHBondContact O-N 3.03Å; Q416-N420 PolarHBondContact O-OD1 3.31Å; Q416-N420 VanDerWaalsContact O-OD1 3.07Å
417	K	67.4	Low	53.1	Low	127 Å²	127	88.3 Å²	88.3	55%	0.552	45%	0.452	S	S	*	.	H	α-helix	trans	-59.1	-40.5	174.2	-175.1	177.7	176.9	-178	0	111.8	P413 I415 N420 E421	P413-K417 WeakPolarHBondContact O-CB 3.35Å; P413-K417 PolarHBondContact O-N 3.06Å; I415-K417 VanDerWaalsContact C-N 3.34Å; I415-K417 PolarHBondContact O-N 3.44Å; K417-N420 PolarHBondContact O-N 3.32Å; K417-E421 WeakPolarHBondContact CE-OE1 3.4Å; K417-E421 PolarHBondContact O-N 3.32Å
418	S	49	Very low	52.9	Low	62 Å²	62	91.2 Å²	91.2	43%	0.434	47%	0.465	S	S	.	.	H	α-helix	trans	-67.1	-39.7	178.4	-53.6	0	0	0	0	112.2	L414 I415 Q416 E421 L422	L414-S418 PolarHBondContact O-N 3.43Å; L414-S418 VanDerWaalsContact O-N 3.15Å; L414-S418 PolarHBondContact O-OG 3.03Å; I415-S418 WeakPolarHBondContact O-CA 3.48Å; I415-S418 WeakPolarHBondContact O-CB 3.36Å; I415-S418 PolarHBondContact O-N 2.82Å; Q416-S418 VanDerWaalsContact C-N 3.27Å; Q416-S418 PolarHBondContact O-N 2.73Å; S418-E421 PolarHBondContact O-N 2.9Å; S418-L422 WeakPolarHBondContact O-CG 3.13Å; S418-L422 PolarHBondContact O-N 3.48Å
419	I	61.3	Low	52.4	Low	6 Å²	6	86.5 Å²	86.5	3%	0.031	44%	0.442	C	S	.	.	H	α-helix	trans	-60.8	-48.5	172.8	-66.3	167.9	0	0	0	110.3	I400 E401 I415 Q416 E421 L422 Q423	I400-I419 HydrophobicContact CG2-CD1 4.03Å; I400-I419 HydrophobicContact CG2-CG1 3.69Å; E401-I419 HydrophobicContact CG-CD1 4.22Å; I415-I419 HydrophobicContact CG2-CD1 4.07Å; I415-I419 WeakPolarHBondContact O-CG1 3.28Å; I415-I419 PolarHBondContact O-N 3.3Å; Q416-I419 PolarHBondContact O-N 3.05Å; I419-E421 VanDerWaalsContact C-N 3.35Å; I419-E421 PolarHBondContact O-N 2.83Å; I419-L422 PolarHBondContact O-N 3.3Å; I419-L422 VanDerWaalsContact O-N 3.16Å; I419-Q423 HydrophobicContact CG2-CG 4.3Å; I419-Q423 WeakPolarHBondContact O-CG 3.35Å; I419-Q423 PolarHBondContact O-N 2.99Å
420	N	63.4	Low	52.3	Low	85 Å²	85	82.6 Å²	82.6	46%	0.455	43%	0.43	S	S	.	.	H	α-helix	trans	-61.3	-41.3	-179.5	-65.8	8.6	0	0	0	112	Q416 K417 H424	Q416-N420 PolarHBondContact NE2-OD1 3.47Å; Q416-N420 VanDerWaalsContact O-CG 3.22Å; Q416-N420 PolarHBondContact O-N 3.03Å; Q416-N420 PolarHBondContact O-OD1 3.31Å; Q416-N420 VanDerWaalsContact O-OD1 3.07Å; K417-N420 PolarHBondContact O-N 3.32Å; N420-H424 WeakPolarHBondContact O-CB 3.39Å; N420-H424 PolarHBondContact O-N 2.93Å; N420-H424 VanDerWaalsContact O-N 3.08Å
421	E	55.7	Low	52.2	Low	106 Å²	106	82.2 Å²	82.2	50%	0.495	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-41	174.8	-73.6	-176	-152.8	0	0	111.9	K417 S418 I419 H424 Y425	K417-E421 WeakPolarHBondContact CE-OE1 3.4Å; K417-E421 PolarHBondContact O-N 3.32Å; S418-E421 PolarHBondContact O-N 2.9Å; I419-E421 VanDerWaalsContact C-N 3.35Å; I419-E421 PolarHBondContact O-N 2.83Å; E421-H424 WeakPolarHBondContact O-CB 3.49Å; E421-H424 PolarHBondContact O-N 3.43Å; E421-Y425 WeakPolarHBondContact O-CD2 3.31Å; E421-Y425 PolarHBondContact O-N 2.96Å
422	L	52.1	Low	51.6	Low	61 Å²	61	85.2 Å²	85.2	32%	0.319	43%	0.434	S	S	.	.	H	α-helix	trans	-66.5	-42.9	177.1	-73.9	168.5	0	0	0	113	I400 S418 I419 H424 Y425 S426	I400-L422 HydrophobicContact CD1-CD1 3.63Å; S418-L422 WeakPolarHBondContact O-CG 3.13Å; S418-L422 PolarHBondContact O-N 3.48Å; I419-L422 PolarHBondContact O-N 3.3Å; I419-L422 VanDerWaalsContact O-N 3.16Å; L422-H424 VanDerWaalsContact C-N 3.26Å; L422-H424 PolarHBondContact O-N 2.94Å; L422-Y425 PolarHBondContact O-N 3.14Å; L422-S426 PolarHBondContact O-N 2.9Å; L422-S426 VanDerWaalsContact O-N 3.12Å
423	Q	56.8	Low	50.7	Low	87 Å²	87	83.9 Å²	83.9	41%	0.407	44%	0.435	S	S	.	.	H	α-helix	trans	-59	-39.4	172.9	-72.5	177.1	-7.6	0	0	111.1	I397 I419 Y425 S426 S427	I397-Q423 HydrophobicContact CD1-CG 4.18Å; I419-Q423 HydrophobicContact CG2-CG 4.3Å; I419-Q423 WeakPolarHBondContact O-CG 3.35Å; I419-Q423 PolarHBondContact O-N 2.99Å; Q423-Y425 VanDerWaalsContact C-N 3.33Å; Q423-Y425 PolarHBondContact O-N 3.46Å; Q423-S426 WeakPolarHBondContact O-CB 3.32Å; Q423-S426 PolarHBondContact O-N 3.46Å; Q423-S426 VanDerWaalsContact O-N 3.13Å; Q423-S427 PolarHBondContact O-N 3.46Å; Q423-S427 PolarHBondContact O-OG 3.2Å
424	H	54.8	Low	50.1	Low	124 Å²	124	83.1 Å²	83.1	57%	0.574	43%	0.431	S	S	*	.	H	α-helix	trans	-64.9	-33.2	177.6	-157.3	-35.7	0	0	0	113.1	N420 E421 L422 I428	N420-H424 WeakPolarHBondContact O-CB 3.39Å; N420-H424 PolarHBondContact O-N 2.93Å; N420-H424 VanDerWaalsContact O-N 3.08Å; E421-H424 WeakPolarHBondContact O-CB 3.49Å; E421-H424 PolarHBondContact O-N 3.43Å; L422-H424 VanDerWaalsContact C-N 3.26Å; L422-H424 PolarHBondContact O-N 2.94Å; H424-I428 WeakPolarHBondContact O-CD1 3.41Å; H424-I428 WeakPolarHBondContact O-CG1 3.42Å; H424-I428 PolarHBondContact O-N 2.87Å
425	Y	42.2	Very low	49.9	Very low	171 Å²	171	81.1 Å²	81.1	67%	0.671	42%	0.424	S	S	*	.	H	α-helix	trans	-69.9	-36.8	171.1	-78.7	-74.3	0	0	0	112.6	E421 L422 Q423 I428 S429	E421-Y425 WeakPolarHBondContact O-CD2 3.31Å; E421-Y425 PolarHBondContact O-N 2.96Å; L422-Y425 PolarHBondContact O-N 3.14Å; Q423-Y425 VanDerWaalsContact C-N 3.33Å; Q423-Y425 PolarHBondContact O-N 3.46Å; Y425-I428 PolarHBondContact O-N 3.13Å; Y425-S429 PolarHBondContact O-N 2.78Å; Y425-S429 VanDerWaalsContact O-N 3.1Å
426	S	45.6	Very low	48.4	Very low	29 Å²	29	84.9 Å²	84.9	20%	0.203	44%	0.444	C	S	.	.	H	α-helix	trans	-59.7	-49.3	174.8	-169.2	0	0	0	0	111.5	L422 Q423 I428 S429 S430	L422-S426 PolarHBondContact O-N 2.9Å; L422-S426 VanDerWaalsContact O-N 3.12Å; Q423-S426 WeakPolarHBondContact O-CB 3.32Å; Q423-S426 PolarHBondContact O-N 3.46Å; Q423-S426 VanDerWaalsContact O-N 3.13Å; S426-I428 VanDerWaalsContact C-N 3.29Å; S426-I428 PolarHBondContact O-N 3.19Å; S426-S429 WeakPolarHBondContact O-CB 3.33Å; S426-S429 PolarHBondContact O-N 3.09Å; S426-S430 PolarHBondContact O-N 2.76Å; S426-S430 VanDerWaalsContact O-N 3.09Å; S426-S430 PolarHBondContact O-OG 3.45Å
427	S	47.7	Very low	47.1	Very low	73 Å²	73	84.6 Å²	84.6	51%	0.51	45%	0.449	S	S	.	.	H	α-helix	trans	-62.4	-30.5	178.9	-59.2	0	0	0	0	114.1	Q423 S430 F431	Q423-S427 PolarHBondContact O-N 3.46Å; Q423-S427 PolarHBondContact O-OG 3.2Å; S427-S430 PolarHBondContact O-OG 2.86Å; S427-S430 VanDerWaalsContact O-OG 3.11Å; S427-F431 PolarHBondContact O-N 3.31Å
428	I	42.3	Very low	45.8	Very low	82 Å²	82	82.9 Å²	82.9	42%	0.421	45%	0.449	S	S	.	.	H	α-helix	trans	-75.5	-35.8	174.4	-68.1	167.2	0	0	0	111	H424 Y425 S426 L432	H424-I428 WeakPolarHBondContact O-CD1 3.41Å; H424-I428 WeakPolarHBondContact O-CG1 3.42Å; H424-I428 PolarHBondContact O-N 2.87Å; Y425-I428 PolarHBondContact O-N 3.13Å; S426-I428 VanDerWaalsContact C-N 3.29Å; S426-I428 PolarHBondContact O-N 3.19Å; I428-L432 HydrophobicContact CG2-CD1 3.87Å; I428-L432 HydrophobicContact CG2-CG 4.45Å; I428-L432 WeakPolarHBondContact O-CB 3.42Å; I428-L432 WeakPolarHBondContact O-CG 3.07Å; I428-L432 PolarHBondContact O-N 3.31Å; I428-L432 VanDerWaalsContact O-N 3.1Å
429	S	36	Very low	45.1	Very low	34 Å²	34	82.5 Å²	82.5	24%	0.238	46%	0.455	C	S	.	.	H	α-helix	trans	-63.8	-46.3	177.5	-171.4	0	0	0	0	112.2	Y425 S426 L432 T433	Y425-S429 PolarHBondContact O-N 2.78Å; Y425-S429 VanDerWaalsContact O-N 3.1Å; S426-S429 WeakPolarHBondContact O-CB 3.33Å; S426-S429 PolarHBondContact O-N 3.09Å; S429-L432 PolarHBondContact O-N 3.4Å; S429-T433 PolarHBondContact O-N 3.09Å; S429-T433 PolarHBondContact O-OG1 2.83Å
430	S	45.4	Very low	43.8	Very low	55 Å²	55	87.2 Å²	87.2	39%	0.385	48%	0.484	S	S	.	.	H	α-helix	trans	-65.2	-39.2	178.3	58.4	0	0	0	0	112.6	S426 S427 T433 S434	S426-S430 PolarHBondContact O-N 2.76Å; S426-S430 VanDerWaalsContact O-N 3.09Å; S426-S430 PolarHBondContact O-OG 3.45Å; S427-S430 PolarHBondContact O-OG 2.86Å; S427-S430 VanDerWaalsContact O-OG 3.11Å; S430-T433 WeakPolarHBondContact CA-OG1 3.38Å; S430-T433 PolarHBondContact O-OG1 3.37Å; S430-T433 VanDerWaalsContact O-OG1 3.09Å; S430-S434 WeakPolarHBondContact O-CB 3.5Å; S430-S434 PolarHBondContact O-N 3.19Å
431	F	40.9	Very low	42.3	Very low	154 Å²	154	91 Å²	91	68%	0.675	50%	0.501	S	S	*	.	H	α-helix	trans	-66	-43.3	177.3	-142.1	-84.9	0	0	0	112.2	S427 T435	S427-F431 PolarHBondContact O-N 3.31Å; F431-T435 HydrophobicContact CD1-CG2 4.4Å; F431-T435 PolarHBondContact O-N 3.22Å; F431-T435 VanDerWaalsContact O-N 3.13Å; F431-T435 PolarHBondContact O-OG1 3.11Å; F431-T435 VanDerWaalsContact O-OG1 3.13Å
432	L	33	Very low	41.3	Very low	100 Å²	100	94 Å²	94	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-66.9	-41.5	178.2	-73.2	171.4	0	0	0	112.4	I428 S429 T435 L436	I428-L432 HydrophobicContact CG2-CD1 3.87Å; I428-L432 HydrophobicContact CG2-CG 4.45Å; I428-L432 WeakPolarHBondContact O-CB 3.42Å; I428-L432 WeakPolarHBondContact O-CG 3.07Å; I428-L432 PolarHBondContact O-N 3.31Å; I428-L432 VanDerWaalsContact O-N 3.1Å; S429-L432 PolarHBondContact O-N 3.4Å; L432-T435 PolarHBondContact O-N 3.42Å; L432-T435 PolarHBondContact O-OG1 2.88Å; L432-L436 WeakPolarHBondContact O-CB 3.04Å; L432-L436 WeakPolarHBondContact O-CG 3.46Å; L432-L436 PolarHBondContact O-N 3.09Å
433	T	40.2	Very low	40.2	Very low	70 Å²	70	99.2 Å²	99.2	43%	0.429	54%	0.542	S	S	.	.	H	α-helix	trans	-66.3	-40.3	177.9	43.7	0	0	0	0	112.5	S429 S430 L436 T437	S429-T433 PolarHBondContact O-N 3.09Å; S429-T433 PolarHBondContact O-OG1 2.83Å; S430-T433 WeakPolarHBondContact CA-OG1 3.38Å; S430-T433 PolarHBondContact O-OG1 3.37Å; S430-T433 VanDerWaalsContact O-OG1 3.09Å; T433-L436 PolarHBondContact O-N 3.17Å; T433-T437 PolarHBondContact O-N 2.77Å; T433-T437 VanDerWaalsContact O-N 3.08Å; T433-T437 PolarHBondContact O-OG1 3.26Å
434	S	42.1	Very low	39	Very low	69 Å²	69	100.7 Å²	100.7	48%	0.483	56%	0.557	S	S	.	*	H	α-helix	trans	-60.3	-43.8	173.1	-179.2	0	0	0	0	113.1	S430 L436 T437 T438	S430-S434 WeakPolarHBondContact O-CB 3.5Å; S430-S434 PolarHBondContact O-N 3.19Å; S434-L436 VanDerWaalsContact C-N 3.34Å; S434-L436 PolarHBondContact O-N 3.38Å; S434-T437 PolarHBondContact O-OG1 3.17Å; S434-T438 PolarHBondContact O-N 3.43Å; S434-T438 PolarHBondContact O-OG1 3.22Å
435	T	41.1	Very low	37.7	Very low	74 Å²	74	100.7 Å²	100.7	45%	0.454	57%	0.566	S	S	.	*	H	α-helix	trans	-72.6	-23.1	177.5	55	0	0	0	0	114.2	F431 L432 T438 G439	F431-T435 HydrophobicContact CD1-CG2 4.4Å; F431-T435 PolarHBondContact O-N 3.22Å; F431-T435 VanDerWaalsContact O-N 3.13Å; F431-T435 PolarHBondContact O-OG1 3.11Å; F431-T435 VanDerWaalsContact O-OG1 3.13Å; L432-T435 PolarHBondContact O-N 3.42Å; L432-T435 PolarHBondContact O-OG1 2.88Å; T435-T438 PolarHBondContact O-OG1 3.13Å; T435-G439 PolarHBondContact O-N 3.45Å
436	L	32.4	Very low	37.3	Very low	116 Å²	116	101.9 Å²	101.9	61%	0.607	58%	0.578	S	S	*	*	H	α-helix	trans	-83	-33	176.7	-83.4	163.8	0	0	0	113.3	L432 T433 S434 T440	L432-L436 WeakPolarHBondContact O-CB 3.04Å; L432-L436 WeakPolarHBondContact O-CG 3.46Å; L432-L436 PolarHBondContact O-N 3.09Å; T433-L436 PolarHBondContact O-N 3.17Å; S434-L436 VanDerWaalsContact C-N 3.34Å; S434-L436 PolarHBondContact O-N 3.38Å; L436-T440 WeakPolarHBondContact O-CG2 3.31Å; L436-T440 PolarHBondContact O-OG1 2.82Å
437	T	39	Very low	36.6	Very low	91 Å²	91	106.4 Å²	106.4	56%	0.558	61%	0.605	S	S	*	*	H	α-helix	trans	-76.6	-33.6	176.2	50.5	0	0	0	0	112.9	T433 S434 T440	T433-T437 PolarHBondContact O-N 2.77Å; T433-T437 VanDerWaalsContact O-N 3.08Å; T433-T437 PolarHBondContact O-OG1 3.26Å; S434-T437 PolarHBondContact O-OG1 3.17Å; T437-T440 PolarHBondContact O-OG1 3.18Å
438	T	40.5	Very low	35.8	Very low	91 Å²	91	109 Å²	109	56%	0.558	62%	0.62	S	S	*	*	H	α-helix	trans	-70.9	-35.2	172.6	44.9	0	0	0	0	112.3	S434 T435 T440	S434-T438 PolarHBondContact O-N 3.43Å; S434-T438 PolarHBondContact O-OG1 3.22Å; T435-T438 PolarHBondContact O-OG1 3.13Å; T438-T440 VanDerWaalsContact C-N 3.32Å; T438-T440 PolarHBondContact O-N 3.3Å
439	G	34.1	Very low	35.3	Very low	54 Å²	54	111.7 Å²	111.7	56%	0.557	64%	0.64	S	S	*	*	H	α-helix	trans	-69.5	-18.4	178.5	0	0	0	0	0	115.8	T435	T435-G439 PolarHBondContact O-N 3.45Å
440	T	34.7	Very low	34.8	Very low	106 Å²	106	116.7 Å²	116.7	65%	0.65	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-9.3	-176.2	47.1	0	0	0	0	115	L436 T437 T438	L436-T440 WeakPolarHBondContact O-CG2 3.31Å; L436-T440 PolarHBondContact O-OG1 2.82Å; T437-T440 PolarHBondContact O-OG1 3.18Å; T438-T440 VanDerWaalsContact C-N 3.32Å; T438-T440 PolarHBondContact O-N 3.3Å
441	M	32.7	Very low	34.3	Very low	165 Å²	165	122.2 Å²	122.2	81%	0.813	69%	0.693	S	S	*	*	S	Bend	trans	-90.9	-0.1	-178.1	-77.7	-168	158	0	0	115.6
442	M	33.9	Very low	33.7	Very low	168 Å²	168	119.3 Å²	119.3	83%	0.828	69%	0.692	S	S	*	*	S	Bend	trans	-103.2	18.8	-175.8	-67.7	-168.8	170.6	0	0	115.1
443	M	28.1	Very low	33.5	Very low	170 Å²	170	120.6 Å²	120.6	84%	0.837	71%	0.706	S	S	*	*			trans	-129.4	41.8	-171.2	-72.8	-70.4	172	0	0	114.3
444	T	31.4	Very low	33.1	Very low	118 Å²	118	123 Å²	123	72%	0.724	72%	0.721	S	S	*	*			trans	-135.9	114.9	173.2	51.4	0	0	0	0	113.3
445	T	28	Very low	32.5	Very low	125 Å²	125	124.6 Å²	124.6	77%	0.767	73%	0.732	S	S	*	*			trans	49.4	105.2	149.5	58.6	0	0	0	0	119.7
446	Q	35.3	Very low	32	Very low	195 Å²	195	131.2 Å²	131.2	91%	0.911	76%	0.755	S	S	*	*				-163.5	158.9	116.2	-104.6	158.2	58.1	0	0	111.6
447	T	30.9	Very low	31.8	Very low	125 Å²	125	130.2 Å²	130.2	77%	0.767	76%	0.757	S	S	*	*			trans	-89.2	148.2	-168.5	46.2	0	0	0	0	113.3
448	P	29.4	Very low	31.3	Very low	128 Å²	128	131.8 Å²	131.8	83%	0.831	77%	0.767	S	S	*	*			trans	-78	136.7	178.8	32.1	-34.5	0	0	0	112.4
449	T	32.7	Very low	30.8	Very low	137 Å²	137	134.8 Å²	134.8	84%	0.84	78%	0.777	S	S	*	*			trans	-130.1	148.9	159.8	46.5	0	0	0	0	109.7
450	T	25.9	Very low	30.7	Very low	140 Å²	140	137.8 Å²	137.8	86%	0.859	78%	0.784	S	S	*	*			trans	-99.3	120.7	-160.7	49.1	0	0	0	0	113.2
451	I	34	Very low	30.6	Very low	170 Å²	170	139.3 Å²	139.3	87%	0.872	79%	0.794	S	S	*	*			trans	-137	137.1	161.2	-57.1	-177.6	0	0	0	108.9
452	S	27.5	Very low	30.5	Very low	94 Å²	94	138.4 Å²	138.4	66%	0.657	79%	0.79	S	S	*	*			trans	-86.3	149	-176.9	50.7	0	0	0	0	113.5
453	P	29.7	Very low	30.4	Very low	127 Å²	127	136.5 Å²	136.5	83%	0.825	79%	0.791	S	S	*	*			trans	-85.3	132.4	174.6	33.6	-32.6	0	0	0	112.4
454	T	32.2	Very low	30.5	Very low	121 Å²	121	133.4 Å²	133.4	74%	0.742	78%	0.781	S	S	*	*			trans	-139	131	167.7	49.2	0	0	0	0	111.4
455	S	29.6	Very low	30.4	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	78%	0.781	S	S	*	*			trans	47.5	109.4	157.9	61.1	0	0	0	0	119.5
456	F	30.3	Very low	30.7	Very low	214 Å²	214	134.6 Å²	134.6	94%	0.939	78%	0.783	S	S	*	*				-141.3	153.2	122.2	-118.1	-82.4	0	0	0	109.5
457	S	27.4	Very low	30.4	Very low	95 Å²	95	133.3 Å²	133.3	66%	0.664	78%	0.777	S	S	*	*			trans	-154.6	172.3	-169.3	-61.9	0	0	0	0	112.9
458	T	29.2	Very low	30.5	Very low	124 Å²	124	135.7 Å²	135.7	76%	0.761	78%	0.783	S	S	*	*			trans	94.6	160	165.2	74.9	0	0	0	0	118.5
459	M	30.6	Very low	30.3	Very low	154 Å²	154	136 Å²	136	76%	0.759	78%	0.778	S	S	*	*			trans	74.4	84.3	-170.6	-51.4	-54.5	151.4	0	0	114.8
460	T	31	Very low	30	Very low	117 Å²	117	137.6 Å²	137.6	72%	0.718	77%	0.773	S	S	*	*				73.3	133.8	80.6	61.8	0	0	0	0	113.6
461	T	32.9	Very low	30.1	Very low	138 Å²	138	137.6 Å²	137.6	85%	0.847	77%	0.768	S	S	*	*			cis	-152.4	176.1	19.2	-16.6	0	0	0	0	113
462	I	30	Very low	29.8	Very low	145 Å²	145	135.1 Å²	135.1	74%	0.744	77%	0.765	S	S	*	*			trans	-116.1	145.1	-168.1	-73.2	161.6	0	0	0	109.4	T464	I462-T464 HydrophobicContact CG2-CG2 4.47Å
463	P	32.8	Very low	29.9	Very low	128 Å²	128	139 Å²	139	83%	0.831	78%	0.778	S	S	*	*				-149.5	-176	95.4	38.3	-16.6	0	0	0	117
464	T	29.5	Very low	29.9	Very low	105 Å²	105	137.2 Å²	137.2	64%	0.644	77%	0.767	S	S	*	*			trans	-136.5	173.9	-153	47.7	0	0	0	0	115.5	I462	I462-T464 HydrophobicContact CG2-CG2 4.47Å
465	Q	29.3	Very low	29.7	Very low	154 Å²	154	140.9 Å²	140.9	72%	0.72	77%	0.772	S	S	*	*			trans	76	112.6	150.4	-77.3	155.7	-73.7	0	0	122.8
466	S	33.9	Very low	29.8	Very low	114 Å²	114	142 Å²	142	80%	0.797	78%	0.777	S	S	*	*				-166.5	111.4	120.1	51.4	0	0	0	0	108.2
467	E	30.4	Very low	29.5	Very low	168 Å²	168	139.5 Å²	139.5	79%	0.785	77%	0.773	S	S	*	*				60.4	92.1	74.6	-72.2	-175.8	-165.3	0	0	115.1
468	I	31.8	Very low	29.4	Very low	176 Å²	176	141.7 Å²	141.7	90%	0.903	78%	0.777	S	S	*	*			trans	-141.8	140.8	152.4	-61.7	-174.1	0	0	0	107.3
469	D	26.5	Very low	29.3	Very low	135 Å²	135	141.6 Å²	141.6	72%	0.722	78%	0.777	S	S	*	*			trans	-112	133.4	-155.7	-133.2	42.1	0	0	0	115.2
470	F	25.4	Very low	29	Very low	170 Å²	170	141.5 Å²	141.5	75%	0.746	78%	0.779	S	S	*	*			trans	51.6	156.1	141.7	-85.3	-102.4	0	0	0	125.2
471	N	27.3	Very low	28.9	Very low	140 Å²	140	143.9 Å²	143.9	75%	0.749	79%	0.786	S	S	*	*			trans	76	80.6	155.2	-61.4	-33.6	0	0	0	120.4
472	S	28.9	Very low	28.6	Very low	117 Å²	117	144.4 Å²	144.4	82%	0.818	78%	0.784	S	S	*	*	S	Bend	trans	-158.8	116.8	135.3	-87.7	0	0	0	0	114.2
473	L	29.3	Very low	28.4	Very low	175 Å²	175	146 Å²	146	92%	0.916	79%	0.793	S	S	*	*			trans	68.5	153.2	161.7	-62.1	165.7	0	0	0	118.9
474	P	28.9	Very low	28	Very low	91 Å²	91	144.4 Å²	144.4	59%	0.591	79%	0.785	S	S	*	*			trans	-116.5	147.7	-159.8	39	-26.9	0	0	0	115.6
475	F	29.6	Very low	27.9	Very low	197 Å²	197	144.5 Å²	144.5	86%	0.864	79%	0.79	S	S	*	*				171.2	141.2	111.8	-89	-63	0	0	0	110.1
476	P	30.2	Very low	27.8	Very low	124 Å²	124	146.6 Å²	146.6	81%	0.805	79%	0.792	S	S	*	*			trans	-86.1	143.6	-166.3	33.3	-34.9	0	0	0	114.4
477	L	24.6	Very low	27.6	Very low	162 Å²	162	147.1 Å²	147.1	85%	0.848	79%	0.793	S	S	*	*			trans	-104.5	118.8	158.2	-93.9	166.6	0	0	0	108.9
478	N	25.5	Very low	27.5	Very low	141 Å²	141	142.8 Å²	142.8	75%	0.754	79%	0.793	S	S	*	*			trans	152	134.4	138.3	-79.3	-11.8	0	0	0	111.8
479	T	27.3	Very low	27.4	Very low	123 Å²	123	138.4 Å²	138.4	76%	0.755	78%	0.775	S	S	*	*				-174.2	107.8	119.6	30.6	0	0	0	0	109.2
480	D	24.5	Very low	27.6	Very low	151 Å²	151	139.3 Å²	139.3	81%	0.807	78%	0.779	S	S	*	*			trans	24.7	104	139.8	-43.7	-45.1	0	0	0	118.6
481	I	28.5	Very low	28.2	Very low	167 Å²	167	137.9 Å²	137.9	86%	0.856	78%	0.78	S	S	*	*			trans	-131.7	136.3	159.1	-61.6	-176.4	0	0	0	109.7
482	N	25.9	Very low	28.4	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	77%	0.773	S	S	*	*			trans	-61.9	142.3	-168.3	-131	-50.8	0	0	0	114.3	S484	N482-S484 PolarHBondContact O-N 2.99Å
483	L	25.9	Very low	28.4	Very low	179 Å²	179	139 Å²	139	94%	0.937	76%	0.764	S	S	*	*			trans	-95.1	62.8	-171.4	-163.3	75.9	0	0	0	112.9
484	S	25.1	Very low	28.6	Very low	94 Å²	94	134 Å²	134	66%	0.657	74%	0.743	S	S	*	*			trans	-139.6	142.3	172.4	58.8	0	0	0	0	112.4	N482	N482-S484 PolarHBondContact O-N 2.99Å
485	S	27.4	Very low	28.8	Very low	107 Å²	107	133 Å²	133	75%	0.748	74%	0.739	S	S	*	*	S	Bend	trans	87.3	53.3	177.1	-48.5	0	0	0	0	119.7
486	Y	27.6	Very low	28.9	Very low	197 Å²	197	127.3 Å²	127.3	77%	0.773	72%	0.717	S	S	*	*			trans	-150	111.6	155.9	-97.4	-66.9	0	0	0	115.1
487	P	28.8	Very low	29.2	Very low	126 Å²	126	126.8 Å²	126.8	82%	0.818	71%	0.706	S	S	*	*			trans	-99.3	141.5	167	34.8	-30.1	0	0	0	113.4
488	G	28	Very low	29.7	Very low	76 Å²	76	126 Å²	126	78%	0.784	70%	0.696	S	S	*	*			trans	106.2	81	156.5	0	0	0	0	0	118.1
489	T	30	Very low	30	Very low	84 Å²	84	125 Å²	125	52%	0.515	69%	0.69	S	S	.	*			trans	-140.6	56.8	179.3	50.1	0	0	0	0	115.3	D491 F492	T489-D491 PolarHBondContact O-N 3.19Å; T489-D491 VanDerWaalsContact O-N 3.09Å; T489-F492 PolarHBondContact O-N 3.04Å
490	N	31.7	Very low	30.2	Very low	154 Å²	154	125.9 Å²	125.9	82%	0.824	68%	0.683	S	S	*	*	H	α-helix	trans	-59.3	-21.6	174.9	-76.1	-7.9	0	0	0	114.5
491	D	37.8	Very low	30.8	Very low	141 Å²	141	122.9 Å²	122.9	75%	0.754	67%	0.667	S	S	*	*	H	α-helix	trans	-84.3	-15.4	177.1	-64	-41.1	0	0	0	113.6	T489	T489-D491 PolarHBondContact O-N 3.19Å; T489-D491 VanDerWaalsContact O-N 3.09Å
492	F	30.9	Very low	31.1	Very low	139 Å²	139	117.4 Å²	117.4	61%	0.61	64%	0.643	S	S	*	*	H	α-helix	trans	-81.7	-40.7	-177.5	-153	-93.7	0	0	0	111.6	T489 S494 S495 L496	T489-F492 PolarHBondContact O-N 3.04Å; F492-S494 VanDerWaalsContact C-N 3.26Å; F492-S494 PolarHBondContact O-N 3.27Å; F492-S495 PolarHBondContact O-N 3.14Å; F492-L496 HydrophobicContact CE1-CD1 4.24Å; F492-L496 PolarHBondContact O-N 3.49Å
493	F	29	Very low	31.6	Very low	142 Å²	142	114.2 Å²	114.2	62%	0.623	63%	0.629	S	S	*	*	H	α-helix	trans	-58.2	-35	174.1	-76.4	-82.6	0	0	0	112.9	S495 L496 L497	F493-S495 PolarHBondContact O-N 2.99Å; F493-L496 PolarHBondContact O-N 3.26Å; F493-L497 VanDerWaalsContact O-CB 3.31Å; F493-L497 WeakPolarHBondContact O-CB 3.49Å; F493-L497 PolarHBondContact O-N 3.36Å
494	S	33	Very low	32	Very low	68 Å²	68	108.1 Å²	108.1	48%	0.476	60%	0.604	S	S	.	*	H	α-helix	trans	-67.7	-21.5	177.7	-160.1	0	0	0	0	113.7	F492 K498	F492-S494 VanDerWaalsContact C-N 3.26Å; F492-S494 PolarHBondContact O-N 3.27Å; S494-K498 VanDerWaalsContact O-CD 3.28Å; S494-K498 WeakPolarHBondContact O-CD 3.35Å; S494-K498 WeakPolarHBondContact O-CE 3.47Å; S494-K498 WeakPolarHBondContact O-CG 3.38Å
495	S	33.9	Very low	32.4	Very low	72 Å²	72	108.5 Å²	108.5	50%	0.503	60%	0.599	S	S	.	*	H	α-helix	trans	-87.8	-41.7	170.7	-62.3	0	0	0	0	111.6	F492 F493 L497 K498 L499	F492-S495 PolarHBondContact O-N 3.14Å; F493-S495 PolarHBondContact O-N 2.99Å; S495-L497 VanDerWaalsContact C-N 3.34Å; S495-L497 PolarHBondContact O-N 3.45Å; S495-K498 PolarHBondContact O-N 3.02Å; S495-L499 PolarHBondContact O-N 2.87Å; S495-L499 VanDerWaalsContact O-N 3.14Å
496	L	32.1	Very low	33	Very low	76 Å²	76	108.3 Å²	108.3	40%	0.398	59%	0.585	S	S	.	*	H	α-helix	trans	-64.4	-37.3	179.8	-145.3	80.8	0	0	0	112.4	F492 F493 L499 K500	F492-L496 HydrophobicContact CE1-CD1 4.24Å; F492-L496 PolarHBondContact O-N 3.49Å; F493-L496 PolarHBondContact O-N 3.26Å; L496-L499 PolarHBondContact O-N 2.81Å; L496-K500 PolarHBondContact O-N 2.86Å
497	L	35	Very low	33.3	Very low	113 Å²	113	104.3 Å²	104.3	59%	0.592	58%	0.576	S	S	*	*	H	α-helix	trans	-67.7	-38	177.5	-156.8	75.4	0	0	0	111.8	F493 S495 L499 K500 I501	F493-L497 VanDerWaalsContact O-CB 3.31Å; F493-L497 WeakPolarHBondContact O-CB 3.49Å; F493-L497 PolarHBondContact O-N 3.36Å; S495-L497 VanDerWaalsContact C-N 3.34Å; S495-L497 PolarHBondContact O-N 3.45Å; L497-L499 VanDerWaalsContact C-N 3.33Å; L497-L499 PolarHBondContact O-N 3.31Å; L497-K500 PolarHBondContact O-N 3.44Å; L497-I501 HydrophobicContact CD2-CD1 4.46Å; L497-I501 HydrophobicContact CG-CD1 4.13Å; L497-I501 WeakPolarHBondContact O-CD1 3.43Å; L497-I501 VanDerWaalsContact O-CG1 3.27Å; L497-I501 WeakPolarHBondContact O-CG1 3.44Å; L497-I501 PolarHBondContact O-N 2.94Å
498	K	36.6	Very low	33.5	Very low	146 Å²	146	103.8 Å²	103.8	64%	0.635	57%	0.567	S	S	*	*	H	α-helix	trans	-66.9	-34.1	175.6	-70.2	173.6	-172.5	172.5	0	112.5	S494 S495 S502	S494-K498 VanDerWaalsContact O-CD 3.28Å; S494-K498 WeakPolarHBondContact O-CD 3.35Å; S494-K498 WeakPolarHBondContact O-CE 3.47Å; S494-K498 WeakPolarHBondContact O-CG 3.38Å; S495-K498 PolarHBondContact O-N 3.02Å; K498-S502 PolarHBondContact O-N 3.5Å
499	L	31.3	Very low	33.8	Very low	120 Å²	120	106.8 Å²	106.8	63%	0.628	56%	0.56	S	S	*	*	H	α-helix	trans	-67.6	-47.3	170.8	-82.1	160.1	0	0	0	111.5	S495 L496 L497 I501 S502 T503	S495-L499 PolarHBondContact O-N 2.87Å; S495-L499 VanDerWaalsContact O-N 3.14Å; L496-L499 PolarHBondContact O-N 2.81Å; L497-L499 VanDerWaalsContact C-N 3.33Å; L497-L499 PolarHBondContact O-N 3.31Å; L499-I501 PolarHBondContact O-N 3.39Å; L499-S502 PolarHBondContact O-N 2.9Å; L499-T503 PolarHBondContact O-N 2.99Å; L499-T503 PolarHBondContact O-OG1 3.44Å
500	K	31.8	Very low	34.1	Very low	141 Å²	141	108.3 Å²	108.3	61%	0.613	56%	0.564	S	S	*	*	H	α-helix	trans	-65	-36.3	-179.8	-78	-165.4	171.2	-167.4	0	114.1	L496 L497 T503 A504	L496-K500 PolarHBondContact O-N 2.86Å; L497-K500 PolarHBondContact O-N 3.44Å; K500-T503 WeakPolarHBondContact CA-OG1 3.41Å; K500-T503 PolarHBondContact O-N 3.41Å; K500-T503 PolarHBondContact O-OG1 2.9Å; K500-A504 PolarHBondContact O-N 3.31Å; K500-A504 VanDerWaalsContact O-N 3.13Å
501	I	36.1	Very low	34.1	Very low	89 Å²	89	108.8 Å²	108.8	46%	0.456	56%	0.559	S	S	.	*	H	α-helix	trans	-65.1	-49.4	175.5	-68.2	163.3	0	0	0	109.9	L497 L499 T503 A504 D505	L497-I501 HydrophobicContact CD2-CD1 4.46Å; L497-I501 HydrophobicContact CG-CD1 4.13Å; L497-I501 WeakPolarHBondContact O-CD1 3.43Å; L497-I501 VanDerWaalsContact O-CG1 3.27Å; L497-I501 WeakPolarHBondContact O-CG1 3.44Å; L497-I501 PolarHBondContact O-N 2.94Å; L499-I501 PolarHBondContact O-N 3.39Å; I501-T503 PolarHBondContact O-N 3.49Å; I501-A504 PolarHBondContact O-N 2.89Å; I501-D505 PolarHBondContact O-N 2.89Å; I501-D505 VanDerWaalsContact O-N 3.14Å
502	S	34.4	Very low	34	Very low	52 Å²	52	107 Å²	107	36%	0.364	55%	0.553	S	S	.	*	H	α-helix	trans	-61.1	-17.4	178	-175.6	0	0	0	0	114.7	K498 L499	K498-S502 PolarHBondContact O-N 3.5Å; L499-S502 PolarHBondContact O-N 2.9Å
503	T	37	Very low	34	Very low	83 Å²	83	106.2 Å²	106.2	51%	0.509	56%	0.555	S	S	.	*	H	α-helix	trans	-92	-24.8	171.3	49.7	0	0	0	0	113.8	L499 K500 I501 L507	L499-T503 PolarHBondContact O-N 2.99Å; L499-T503 PolarHBondContact O-OG1 3.44Å; K500-T503 WeakPolarHBondContact CA-OG1 3.41Å; K500-T503 PolarHBondContact O-N 3.41Å; K500-T503 PolarHBondContact O-OG1 2.9Å; I501-T503 PolarHBondContact O-N 3.49Å; T503-L507 WeakPolarHBondContact O-CD1 3.39Å; T503-L507 WeakPolarHBondContact O-CG 3.18Å; T503-L507 PolarHBondContact O-N 2.97Å
504	A	34	Very low	34.1	Very low	50 Å²	50	104.3 Å²	104.3	41%	0.413	56%	0.555	S	S	.	*	H	α-helix	trans	-73.6	-44.5	176.2	0	0	0	0	0	111.2	K500 I501 K506 L507 N508	K500-A504 PolarHBondContact O-N 3.31Å; K500-A504 VanDerWaalsContact O-N 3.13Å; I501-A504 PolarHBondContact O-N 2.89Å; A504-K506 VanDerWaalsContact C-N 3.3Å; A504-K506 PolarHBondContact O-N 2.91Å; A504-L507 PolarHBondContact O-N 2.88Å; A504-N508 PolarHBondContact O-N 3.32Å; A504-N508 VanDerWaalsContact O-N 3.16Å
505	D	34.6	Very low	33.9	Very low	102 Å²	102	104.7 Å²	104.7	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-58.5	-42.6	-179.9	-57.8	-32.2	0	0	0	111.3	I501 L507 E509	I501-D505 PolarHBondContact O-N 2.89Å; I501-D505 VanDerWaalsContact O-N 3.14Å; D505-L507 VanDerWaalsContact C-N 3.31Å; D505-L507 PolarHBondContact O-N 2.9Å; D505-E509 PolarHBondContact O-N 3.04Å
506	K	38.6	Very low	33.6	Very low	103 Å²	103	107.4 Å²	107.4	45%	0.448	58%	0.576	S	S	.	*	H	α-helix	trans	-72.4	-14	176.5	-73.4	-164.5	171.6	-167.4	0	115.1	A504 I510	A504-K506 VanDerWaalsContact C-N 3.3Å; A504-K506 PolarHBondContact O-N 2.91Å; K506-I510 WeakPolarHBondContact O-CD1 3.38Å; K506-I510 WeakPolarHBondContact O-CG1 3.23Å
507	L	34.3	Very low	33.4	Very low	113 Å²	113	108.1 Å²	108.1	59%	0.592	59%	0.593	S	S	*	*	H	α-helix	trans	-88.9	-36.8	174.7	-75.4	169.2	0	0	0	111.5	T503 A504 D505 E509 I510 F511	T503-L507 WeakPolarHBondContact O-CD1 3.39Å; T503-L507 WeakPolarHBondContact O-CG 3.18Å; T503-L507 PolarHBondContact O-N 2.97Å; A504-L507 PolarHBondContact O-N 2.88Å; D505-L507 VanDerWaalsContact C-N 3.31Å; D505-L507 PolarHBondContact O-N 2.9Å; L507-E509 VanDerWaalsContact C-N 3.33Å; L507-E509 PolarHBondContact O-N 2.88Å; L507-I510 PolarHBondContact O-N 2.86Å; L507-F511 PolarHBondContact O-N 2.92Å
508	N	34.3	Very low	33	Very low	116 Å²	116	108.8 Å²	108.8	62%	0.62	60%	0.602	S	S	*	*	H	α-helix	trans	-63.3	-38.4	172.4	-88.7	-4.6	0	0	0	112.3	A504 I510 F511 V512	A504-N508 PolarHBondContact O-N 3.32Å; A504-N508 VanDerWaalsContact O-N 3.16Å; N508-I510 PolarHBondContact O-N 3.49Å; N508-F511 PolarHBondContact O-N 2.86Å; N508-V512 WeakPolarHBondContact O-CG2 3.34Å; N508-V512 PolarHBondContact O-N 3.15Å; N508-V512 VanDerWaalsContact O-N 3.09Å
509	E	34	Very low	32.5	Very low	138 Å²	138	108 Å²	108	65%	0.645	61%	0.609	S	S	*	*	H	α-helix	trans	-64.8	-24.6	178	-160.9	168.2	-137.7	0	0	112.9	D505 L507 N513	D505-E509 PolarHBondContact O-N 3.04Å; L507-E509 VanDerWaalsContact C-N 3.33Å; L507-E509 PolarHBondContact O-N 2.88Å; E509-N513 PolarHBondContact O-ND2 3.46Å
510	I	36	Very low	32.5	Very low	116 Å²	116	110.5 Å²	110.5	60%	0.595	62%	0.623	S	S	*	*	H	α-helix	trans	-85.3	-37.9	173.9	-65.2	172	0	0	0	111.2	K506 L507 N508	K506-I510 WeakPolarHBondContact O-CD1 3.38Å; K506-I510 WeakPolarHBondContact O-CG1 3.23Å; L507-I510 PolarHBondContact O-N 2.86Å; N508-I510 PolarHBondContact O-N 3.49Å
511	F	30.5	Very low	32.3	Very low	165 Å²	165	109.3 Å²	109.3	72%	0.724	63%	0.633	S	S	*	*	H	α-helix	trans	-77.5	-22	-175	-146.4	-96.4	0	0	0	114.3	L507 N508 T514	L507-F511 PolarHBondContact O-N 2.92Å; N508-F511 PolarHBondContact O-N 2.86Å; F511-T514 PolarHBondContact O-OG1 2.91Å
512	V	35.7	Very low	32.1	Very low	102 Å²	102	110.4 Å²	110.4	62%	0.618	65%	0.649	S	S	*	*	S	Bend	trans	-82.3	-29	178.6	171.5	0	0	0	0	112.5	N508 T514	N508-V512 WeakPolarHBondContact O-CG2 3.34Å; N508-V512 PolarHBondContact O-N 3.15Å; N508-V512 VanDerWaalsContact O-N 3.09Å; V512-T514 VanDerWaalsContact C-N 3.3Å; V512-T514 PolarHBondContact O-N 3.37Å
513	N	31.3	Very low	32	Very low	123 Å²	123	112.6 Å²	112.6	66%	0.658	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	4.8	-176.2	-73.1	-59.6	0	0	0	114.5	E509	E509-N513 PolarHBondContact O-ND2 3.46Å
514	T	30.8	Very low	31.8	Very low	103 Å²	103	115 Å²	115	63%	0.632	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	5.7	177.8	50.2	0	0	0	0	114.1	F511 V512	F511-T514 PolarHBondContact O-OG1 2.91Å; V512-T514 VanDerWaalsContact C-N 3.3Å; V512-T514 PolarHBondContact O-N 3.37Å
515	A	29.3	Very low	31.7	Very low	75 Å²	75	118.8 Å²	118.8	62%	0.62	69%	0.687	S	S	*	*	S	Bend	trans	-97.7	-2.9	-172.5	0	0	0	0	0	115.3
516	T	28	Very low	31.5	Very low	129 Å²	129	120.8 Å²	120.8	79%	0.791	70%	0.698	S	S	*	*	S	Bend	trans	-126.5	46.9	-167.1	58.1	0	0	0	0	113.6
517	A	28.3	Very low	31.2	Very low	91 Å²	91	120 Å²	120	75%	0.752	71%	0.705	S	S	*	*	S	Bend	trans	-145.7	11.2	-178.7	0	0	0	0	0	115.8
518	T	25.7	Very low	31	Very low	127 Å²	127	121.5 Å²	121.5	78%	0.779	71%	0.714	S	S	*	*			trans	-135.7	51.9	-168	57.3	0	0	0	0	114.9
519	T	27.6	Very low	30.7	Very low	129 Å²	129	121 Å²	121	79%	0.791	72%	0.715	S	S	*	*			trans	-139.8	87.2	167	54.4	0	0	0	0	111.7
520	N	30.3	Very low	30.7	Very low	173 Å²	173	122.1 Å²	122.1	93%	0.925	72%	0.72	S	S	*	*			trans	-172	89.6	148.9	-98.2	-18.9	0	0	0	110
521	S	28	Very low	30.4	Very low	116 Å²	116	122.3 Å²	122.3	81%	0.811	72%	0.722	S	S	*	*			trans	-80.2	135.3	174.9	-43.4	0	0	0	0	110.8
522	S	32.5	Very low	30.6	Very low	113 Å²	113	120.3 Å²	120.3	79%	0.79	72%	0.718	S	S	*	*			trans	169.1	134.6	134.9	-77.7	0	0	0	0	113.2
523	S	32	Very low	30.5	Very low	98 Å²	98	124.2 Å²	124.2	69%	0.685	73%	0.727	S	S	*	*			trans	20.4	132.2	146.3	61.7	0	0	0	0	119.8
524	N	33	Very low	30.4	Very low	134 Å²	134	122 Å²	122	72%	0.717	72%	0.721	S	S	*	*			cis	-170.5	150.6	41.8	-109.5	-25.4	0	0	0	113
525	N	30.5	Very low	30.6	Very low	129 Å²	129	123.4 Å²	123.4	69%	0.69	73%	0.725	S	S	*	*			trans	20.8	127.6	132.5	-54.4	-8.9	0	0	0	118.2
526	N	31.8	Very low	30.7	Very low	143 Å²	143	125.8 Å²	125.8	77%	0.765	73%	0.727	S	S	*	*				-178.9	152.1	51.7	-112.1	-11.2	0	0	0	114.5
527	S	30.4	Very low	30.9	Very low	88 Å²	88	126 Å²	126	62%	0.615	72%	0.724	S	S	*	*			trans	38	123	136.1	-46.3	0	0	0	0	124.2
528	N	31.9	Very low	30.9	Very low	143 Å²	143	127.8 Å²	127.8	77%	0.765	72%	0.719	S	S	*	*				148.3	108.7	126.8	-76.8	-19.6	0	0	0	111.2
529	T	28.1	Very low	31.1	Very low	106 Å²	106	129 Å²	129	65%	0.65	72%	0.721	S	S	*	*				93	140.2	58.2	57.3	0	0	0	0	114.4
530	H	32.8	Very low	31.2	Very low	162 Å²	162	127 Å²	127	75%	0.75	72%	0.718	S	S	*	*			trans	71.9	147.9	170.7	-65.6	-65.9	0	0	0	117.1
531	N	30.2	Very low	31.2	Very low	120 Å²	120	124.2 Å²	124.2	64%	0.642	71%	0.712	S	S	*	*			cis	-161.1	163.3	1.8	-128	-10.9	0	0	0	115.1
532	L	33.7	Very low	31.3	Very low	122 Å²	122	126 Å²	126	64%	0.639	71%	0.712	S	S	*	*			trans	67.4	118.2	151.5	-61.8	165.1	0	0	0	118
533	K	33.8	Very low	31.2	Very low	184 Å²	184	128.5 Å²	128.5	80%	0.8	72%	0.717	S	S	*	*				79.9	146.6	69.2	-80.3	-164.3	-160	170.7	0	113.9
534	S	30.4	Very low	31.1	Very low	77 Å²	77	132.1 Å²	132.1	54%	0.538	72%	0.72	S	S	.	*			cis	178.8	167.6	-12.2	52.9	0	0	0	0	111
535	N	33.5	Very low	31	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	72%	0.723	S	S	*	*			trans	74.3	155	154.6	-61.1	-8.1	0	0	0	118.4
536	N	32.4	Very low	30.9	Very low	124 Å²	124	133.1 Å²	133.1	66%	0.663	72%	0.724	S	S	*	*			cis	-169.4	163.4	-26.1	-102.8	-11	0	0	0	110.7
537	N	31.2	Very low	30.7	Very low	134 Å²	134	132.9 Å²	132.9	72%	0.717	72%	0.723	S	S	*	*			trans	68.7	160.9	152.7	-69.2	6.3	0	0	0	119.4
538	I	29.1	Very low	30.5	Very low	129 Å²	129	135.6 Å²	135.6	66%	0.662	73%	0.73	S	S	*	*			cis	163.3	153.5	-35.6	-96.1	166.1	0	0	0	107.6
539	N	30.8	Very low	30.3	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	73%	0.729	S	S	*	*			trans	78.4	129.5	-177.6	-54.7	-35.1	0	0	0	114.9
540	A	28	Very low	30.5	Very low	89 Å²	89	133.8 Å²	133.8	74%	0.736	73%	0.733	S	S	*	*			cis	104.4	151.6	11.6	0	0	0	0	0	116.2
541	S	32.2	Very low	30.5	Very low	113 Å²	113	134.5 Å²	134.5	79%	0.79	74%	0.738	S	S	*	*			trans	88	113.3	175.4	-55.6	0	0	0	0	118.1
542	N	28.6	Very low	30.5	Very low	153 Å²	153	132 Å²	132	82%	0.818	74%	0.741	S	S	*	*			trans	17.3	135.6	139.8	-50.1	-21	0	0	0	119.8
543	D	31.9	Very low	30.4	Very low	167 Å²	167	134.9 Å²	134.9	89%	0.893	75%	0.751	S	S	*	*				-155.8	173.5	105.2	-124.2	-32.8	0	0	0	113.8
544	K	30	Very low	30.2	Very low	173 Å²	173	133.3 Å²	133.3	75%	0.752	75%	0.747	S	S	*	*			trans	-119.8	156.9	-179.5	-73.5	-175.7	176.3	178.4	0	113.8
545	H	29	Very low	30.1	Very low	170 Å²	170	139.7 Å²	139.7	79%	0.787	76%	0.76	S	S	*	*			trans	77.4	157	157.7	-72.1	-73.4	0	0	0	119.8
546	T	29.3	Very low	29.6	Very low	115 Å²	115	138.5 Å²	138.5	71%	0.706	76%	0.762	S	S	*	*			trans	75.2	106	164.2	53.9	0	0	0	0	120.7
547	N	27.4	Very low	29.4	Very low	138 Å²	138	141.3 Å²	141.3	74%	0.738	77%	0.771	S	S	*	*				93.9	124.8	113.6	-69.8	0	0	0	0	123.2
548	L	26.9	Very low	29.2	Very low	145 Å²	145	143.3 Å²	143.3	76%	0.759	78%	0.776	S	S	*	*			trans	82.5	106.3	134.2	-91.5	70.7	0	0	0	121.9
549	S	27.2	Very low	29.2	Very low	106 Å²	106	144.6 Å²	144.6	74%	0.741	78%	0.784	S	S	*	*				94.2	143.9	115.9	-66	0	0	0	0	122.4
550	S	32.1	Very low	29.2	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	77%	0.771	S	S	*	*			trans	70.3	128.9	167.6	-155.6	0	0	0	0	115.5
551	M	32.2	Very low	29.2	Very low	177 Å²	177	146.6 Å²	146.6	87%	0.872	77%	0.774	S	S	*	*			cis	-156.4	175.1	-9.3	-108.5	170.9	-177.9	0	0	105.6
552	G	31	Very low	29	Very low	68 Å²	68	147.6 Å²	147.6	70%	0.701	77%	0.771	S	S	*	*			cis	157.2	150.8	6	0	0	0	0	0	106.5
553	E	32.2	Very low	29.4	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	76%	0.758	S	S	*	*			cis	-140.3	-176.2	3.1	-70.1	178.4	138.2	0	0	110.2
554	E	28.7	Very low	29.4	Very low	151 Å²	151	147.3 Å²	147.3	71%	0.706	75%	0.752	S	S	*	*			trans	-18.6	145.3	170.6	-44.7	-179.6	159.4	0	0	118
555	Y	27.8	Very low	29.6	Very low	210 Å²	210	146.6 Å²	146.6	82%	0.824	76%	0.755	S	S	*	*			cis	-139.3	154	36	-94.4	-101.8	0	0	0	113.7
556	S	24	Very low	29.8	Very low	108 Å²	108	145.7 Å²	145.7	76%	0.755	75%	0.751	S	S	*	*			trans	-128.4	144.3	169.8	55.9	0	0	0	0	111.6
557	H	29	Very low	29.8	Very low	183 Å²	183	146.5 Å²	146.5	85%	0.847	75%	0.751	S	S	*	*			trans	-155.3	135.5	152.4	-136.8	-74.3	0	0	0	112.1
558	E	26.7	Very low	30.1	Very low	176 Å²	176	148.4 Å²	148.4	82%	0.822	76%	0.756	S	S	*	*			trans	-83.2	143.3	172.8	-51.7	167.6	124.7	0	0	109.9
559	L	29	Very low	30.1	Very low	157 Å²	157	147.3 Å²	147.3	82%	0.822	74%	0.742	S	S	*	*			trans	-157.5	163	153.1	-88.8	-163.3	0	0	0	111.7
560	S	30.9	Very low	30.2	Very low	77 Å²	77	146.9 Å²	146.9	54%	0.538	73%	0.732	S	S	.	*			trans	-70.9	158.4	-168.4	-166.8	0	0	0	0	115.1	D562	S560-D562 WeakPolarHBondContact CB-OD2 3.23Å; S560-D562 PolarHBondContact O-N 3.38Å; S560-D562 PolarHBondContact OG-OD2 3.21Å
561	Y	27.6	Very low	30.1	Very low	204 Å²	204	148.4 Å²	148.4	80%	0.8	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-73.8	-2.5	174.7	-157.5	-101.7	0	0	0	114.1	E563	Y561-E563 VanDerWaalsContact C-N 3.27Å; Y561-E563 PolarHBondContact O-N 3.14Å
562	D	28.5	Very low	29.9	Very low	135 Å²	135	147.3 Å²	147.3	72%	0.722	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-70.4	-15.6	-177.1	-64.1	-64.6	0	0	0	114.5	S560	S560-D562 WeakPolarHBondContact CB-OD2 3.23Å; S560-D562 PolarHBondContact O-N 3.38Å; S560-D562 PolarHBondContact OG-OD2 3.21Å
563	E	35.7	Very low	29.9	Very low	115 Å²	115	153.1 Å²	153.1	54%	0.537	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-88.6	-13.6	-169.7	-143.8	169.7	179.5	0	0	114.4	Y561 I565 Q566	Y561-E563 VanDerWaalsContact C-N 3.27Å; Y561-E563 PolarHBondContact O-N 3.14Å; E563-I565 PolarHBondContact O-N 3.49Å; E563-Q566 PolarHBondContact O-N 3.37Å
564	Y	32.1	Very low	29.8	Very low	198 Å²	198	150 Å²	150	78%	0.776	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-68.9	-5.2	-173.6	-163.8	-106.3	0	0	0	115
565	I	34.1	Very low	30	Very low	158 Å²	158	149.6 Å²	149.6	81%	0.81	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-94.9	-14	179.5	-68.5	-68.2	0	0	0	113.2	E563	E563-I565 PolarHBondContact O-N 3.49Å
566	Q	32.8	Very low	30.1	Very low	151 Å²	151	146.4 Å²	146.4	71%	0.706	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-29.6	-172.6	-60.9	-160.8	8.1	0	0	115.3	E563 Q568	E563-Q566 PolarHBondContact O-N 3.37Å; Q566-Q568 PolarHBondContact O-N 3.39Å
567	N	29.3	Very low	30.5	Very low	132 Å²	132	145.8 Å²	145.8	71%	0.706	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	49.9	-166.5	-100.8	-34.4	0	0	0	116.2
568	Q	34.5	Very low	30.4	Very low	179 Å²	179	142 Å²	142	84%	0.836	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.5	14.3	168.9	-82.7	-72.9	-62.1	0	0	113.2	Q566	Q566-Q568 PolarHBondContact O-N 3.39Å
569	Y	27.9	Very low	30.5	Very low	121 Å²	121	139.1 Å²	139.1	48%	0.475	72%	0.723	S	S	.	*	S	Bend	trans	-132.4	131.5	175	-79.8	-100.7	0	0	0	110.2	N10	N10-Y569 HydrophobicContact CB-CE1 3.93Å; N10-Y569 WeakPolarHBondContact ND2-CE1 3.36Å; N10-Y569 PolarHBondContact ND2-OH 2.98Å; N10-Y569 VanDerWaalsContact ND2-OH 3.1Å
570	N	27.9	Very low	30.6	Very low	98 Å²	98	136.1 Å²	136.1	52%	0.524	72%	0.716	S	S	.	*			trans	68.2	94.9	175.8	-60.5	2.7	0	0	0	116.6	K12	K12-N570 PolarHBondContact O-ND2 3.08Å
571	T	29.6	Very low	30.6	Very low	136 Å²	136	139.4 Å²	139.4	83%	0.834	73%	0.727	S	S	*	*				-172.3	122.3	113.9	25.6	0	0	0	0	110.3
572	N	28.9	Very low	30.6	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	73%	0.729	S	S	*	*			trans	175.8	84.1	147.7	-98.1	-25.3	0	0	0	109.8
573	H	31.3	Very low	30.8	Very low	189 Å²	189	132.7 Å²	132.7	88%	0.875	73%	0.733	S	S	*	*			trans	-153.6	68.1	161.8	-111	-58.3	0	0	0	110
574	T	30.2	Very low	30.6	Very low	117 Å²	117	133.2 Å²	133.2	72%	0.718	75%	0.749	S	S	*	*			trans	-84.2	153.3	141.4	50.4	0	0	0	0	106.6
575	L	32.1	Very low	30.4	Very low	142 Å²	142	127.1 Å²	127.1	74%	0.743	75%	0.746	S	S	*	*			cis	-144.1	161.9	35.6	-76.9	159.5	0	0	0	112.4
576	N	29.7	Very low	30.3	Very low	143 Å²	143	127.7 Å²	127.7	77%	0.765	75%	0.749	S	S	*	*			trans	67.9	141.5	155.7	-59.1	-9.1	0	0	0	119.4
577	S	32	Very low	30	Very low	96 Å²	96	125 Å²	125	67%	0.671	75%	0.747	S	S	*	*			cis	-168.3	136	-18.9	46.4	0	0	0	0	110.8
578	S	28.2	Very low	30	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	75%	0.754	S	S	*	*			trans	36.8	118.9	150.2	59.4	0	0	0	0	120.9
579	C	28.9	Very low	29.8	Very low	116 Å²	116	127.3 Å²	127.3	78%	0.784	76%	0.756	S	S	*	*				-175.2	131.9	102.2	-101.1	0	0	0	0	115.5
580	S	31.6	Very low	29.9	Very low	94 Å²	94	127 Å²	127	66%	0.657	77%	0.772	S	S	*	*			trans	64.2	106.8	135.9	-52.9	0	0	0	0	123.2
581	N	30.1	Very low	29.9	Very low	145 Å²	145	131 Å²	131	78%	0.775	79%	0.787	S	S	*	*				89.3	117.1	122.2	-64	-3.1	0	0	0	123
582	S	28	Very low	29.8	Very low	120 Å²	120	136.1 Å²	136.1	84%	0.839	79%	0.791	S	S	*	*			trans	61.5	120.6	136.4	62.2	0	0	0	0	120.8
583	G	31.3	Very low	29.6	Very low	78 Å²	78	135.8 Å²	135.8	80%	0.804	79%	0.789	S	S	*	*			trans	-168.9	49	173.8	0	0	0	0	0	113.9	G585	G583-G585 PolarHBondContact O-N 3.13Å
584	S	32.6	Very low	29.5	Very low	126 Å²	126	134 Å²	134	88%	0.881	78%	0.784	S	S	*	*			trans	-76.3	92.4	-171.3	-60.8	0	0	0	0	114.9
585	G	28.7	Very low	29.4	Very low	70 Å²	70	132.5 Å²	132.5	72%	0.722	78%	0.779	S	S	*	*			trans	72.8	-164.7	141.9	0	0	0	0	0	119.3	G583	G583-G585 PolarHBondContact O-N 3.13Å
586	I	30.6	Very low	29.1	Very low	170 Å²	170	132.1 Å²	132.1	87%	0.872	78%	0.777	S	S	*	*			trans	66.5	98.9	-179.9	-50.7	-178.6	0	0	0	115.6
587	S	27	Very low	29.1	Very low	95 Å²	95	134.4 Å²	134.4	66%	0.664	78%	0.781	S	S	*	*			trans	-63.4	147.4	159	54	0	0	0	0	112.5
588	N	29.6	Very low	28.8	Very low	159 Å²	159	134.9 Å²	134.9	85%	0.85	78%	0.784	S	S	*	*				-162.5	160.4	117.6	-110	-42.8	0	0	0	114.8
589	K	29.5	Very low	29	Very low	200 Å²	200	141.8 Å²	141.8	87%	0.87	79%	0.794	S	S	*	*			trans	-76.2	137.6	176.2	-60.8	168.6	179.7	172.8	0	110.5
590	S	30.1	Very low	28.9	Very low	116 Å²	116	144.3 Å²	144.3	81%	0.811	79%	0.794	S	S	*	*			trans	-147.2	133.3	149.2	61.5	0	0	0	0	110.6
591	H	27.6	Very low	28.7	Very low	182 Å²	182	146.5 Å²	146.5	84%	0.843	79%	0.794	S	S	*	*			trans	-72.8	138.7	174.9	-75.3	-114.5	0	0	0	110.2
592	R	28	Very low	28.6	Very low	242 Å²	242	147.7 Å²	147.7	91%	0.913	79%	0.794	S	S	*	*			trans	-154	101	147.7	-108.7	165.6	-161.9	-176.4	4.9	110.8
593	N	25.7	Very low	28.9	Very low	149 Å²	149	149.2 Å²	149.2	80%	0.797	79%	0.792	S	S	*	*			trans	-60.4	145.2	143.9	-68.2	-21.7	0	0	0	107.6
594	I	29	Very low	28.8	Very low	150 Å²	150	152.8 Å²	152.8	77%	0.769	79%	0.788	S	S	*	*			trans	175.8	103.6	141.5	-92.2	153.3	0	0	0	110.7
595	S	26.4	Very low	28.6	Very low	86 Å²	86	155.4 Å²	155.4	60%	0.601	79%	0.786	S	S	*	*			trans	61.8	158.4	139.1	79.2	0	0	0	0	124.1
596	N	27.3	Very low	28.7	Very low	134 Å²	134	160.9 Å²	160.9	72%	0.717	79%	0.793	S	S	*	*			trans	78.1	117.5	157.1	-57.8	-30.2	0	0	0	117
597	K	28.2	Very low	28.5	Very low	192 Å²	192	161.7 Å²	161.7	84%	0.835	80%	0.795	S	S	*	*				74.5	122.1	61.6	-83.4	-171.8	169.1	179.3	0	114.1
598	S	27.6	Very low	28.5	Very low	105 Å²	105	162.6 Å²	162.6	73%	0.734	80%	0.796	S	S	*	*			trans	56.4	93.6	151.8	-57.1	0	0	0	0	119.9
599	R	30.5	Very low	28.4	Very low	248 Å²	248	162.3 Å²	162.3	94%	0.936	80%	0.795	S	S	*	*			trans	-153.1	112.8	136.1	-99.9	170.1	177.7	131.8	-1.8	104.9
600	H	27.8	Very low	28.4	Very low	169 Å²	169	161 Å²	161	78%	0.782	80%	0.797	S	S	*	*			cis	65.2	86.5	32.5	-114.2	-72.5	0	0	0	113.6
601	H	27	Very low	28.3	Very low	140 Å²	140	163.4 Å²	163.4	65%	0.648	80%	0.801	S	S	*	*				76.6	62.4	127.4	-155.7	-74.3	0	0	0	120.4
602	H	28.8	Very low	28.3	Very low	171 Å²	171	160.6 Å²	160.6	79%	0.792	80%	0.796	S	S	*	*			trans	-162.4	139.4	146.9	-113.6	36.2	0	0	0	108.4
603	L	34.1	Very low	28.3	Very low	152 Å²	152	160.8 Å²	160.8	80%	0.796	80%	0.797	S	S	*	*			cis	-122.4	162.1	-1.7	-90.2	159.5	0	0	0	111.1
604	Q	27.9	Very low	28.8	Very low	153 Å²	153	158 Å²	158	72%	0.715	79%	0.794	S	S	*	*			trans	-123.2	114.9	-171.5	165.9	-173.9	-19.2	0	0	109.5
605	E	28.5	Very low	28.8	Very low	181 Å²	181	160.2 Å²	160.2	85%	0.846	80%	0.799	S	S	*	*			trans	-173.6	162.9	152.2	-107.3	156.7	-148.9	0	0	110.4
606	H	30.7	Very low	29	Very low	185 Å²	185	163.6 Å²	163.6	86%	0.856	81%	0.81	S	S	*	*	S	Bend	trans	74.5	10.8	-175.5	-74.2	-76.7	0	0	0	120.2	T608	H606-T608 VanDerWaalsContact C-N 3.34Å
607	M	26.8	Very low	29.1	Very low	187 Å²	187	169.4 Å²	169.4	92%	0.921	82%	0.822	S	S	*	*	S	Bend	trans	-93.6	29.9	165.3	-86.5	-80	-80.1	0	0	114.1
608	T	27	Very low	29.2	Very low	113 Å²	113	170.4 Å²	170.4	69%	0.693	83%	0.826	S	S	*	*	S	Bend	trans	-151.8	101.9	171.8	48.3	0	0	0	0	111.1	H606	H606-T608 VanDerWaalsContact C-N 3.34Å
609	N	28.2	Very low	29.2	Very low	153 Å²	153	171.4 Å²	171.4	82%	0.818	83%	0.833	S	S	*	*	S	Bend	trans	161.3	52.6	148.2	-84.2	-20.8	0	0	0	114.2
610	D	29.8	Very low	29.2	Very low	172 Å²	172	163 Å²	163	92%	0.92	82%	0.823	S	S	*	*	S	Bend	trans	-138.3	24.5	164.3	-112.6	-32.2	0	0	0	113
611	L	28	Very low	29.2	Very low	168 Å²	168	165.3 Å²	165.3	88%	0.88	83%	0.831	S	S	*	*	S	Bend	trans	-113.1	6.4	-175.9	-107	163.4	0	0	0	114.6
612	T	27.7	Very low	29.3	Very low	122 Å²	122	167.1 Å²	167.1	75%	0.748	84%	0.84	S	S	*	*	S	Bend	trans	-148.8	54.4	179.4	46.4	0	0	0	0	116.3
613	R	27.9	Very low	29.4	Very low	247 Å²	247	164.4 Å²	164.4	93%	0.932	84%	0.837	S	S	*	*	S	Bend	trans	-150.4	148.3	150.1	-126.3	165.8	-174.4	145.7	3.7	113.6
614	A	35.3	Very low	29	Very low	90 Å²	90	160.5 Å²	160.5	74%	0.744	83%	0.834	S	S	*	*			trans	40.3	81.5	179	0	0	0	0	0	115.3	N616	A614-N616 VanDerWaalsContact C-N 3.35Å
615	K	29.6	Very low	29.2	Very low	197 Å²	197	159.8 Å²	159.8	86%	0.857	84%	0.84	S	S	*	*			cis	43.3	50.7	33.8	-78.1	-165.9	175.8	-177.3	0	113.5
616	N	29.4	Very low	29.1	Very low	157 Å²	157	157 Å²	157	84%	0.84	84%	0.836	S	S	*	*			trans	-169.8	75.7	150.2	-99.5	-14.4	0	0	0	112.9	A614	A614-N616 VanDerWaalsContact C-N 3.35Å
617	R	30.6	Very low	29.1	Very low	256 Å²	256	152.2 Å²	152.2	97%	0.966	82%	0.819	S	S	*	*			trans	179	60.9	156.3	-100.3	159.4	-171.9	177.1	4.5	110.7
618	K	29.2	Very low	29.1	Very low	213 Å²	213	147 Å²	147	93%	0.926	81%	0.814	S	S	*	*			trans	-138.2	77	173.4	-101.8	-164	176	-174.4	0	110.4
619	S	28.5	Very low	29.3	Very low	126 Å²	126	149.5 Å²	149.5	88%	0.881	81%	0.811	S	S	*	*			trans	-167.9	138.7	167	44.7	0	0	0	0	108.7
620	G	30.2	Very low	29.4	Very low	70 Å²	70	148.4 Å²	148.4	72%	0.722	81%	0.811	S	S	*	*			cis	-155.2	121.3	-15.1	0	0	0	0	0	110.5	Q622	G620-Q622 PolarHBondContact O-N 3.33Å
621	F	28.7	Very low	29.3	Very low	218 Å²	218	150.7 Å²	150.7	96%	0.956	81%	0.808	S	S	*	*			trans	-82.7	103	167.9	-127.5	-93.8	0	0	0	107.1	P623	F621-P623 WeakPolarHBondContact O-CD 3.47Å
622	Q	29.7	Very low	29.2	Very low	179 Å²	179	149.5 Å²	149.5	84%	0.836	80%	0.803	S	S	*	*			trans	-90.3	116	178.1	-86.8	-84.2	-20.5	0	0	109.7	G620	G620-Q622 PolarHBondContact O-N 3.33Å
623	P	29.1	Very low	29.1	Very low	113 Å²	113	147.8 Å²	147.8	73%	0.734	80%	0.8	S	S	*	*			trans	-92.6	112.5	173.4	33.8	-27.8	0	0	0	110.4	F621	F621-P623 WeakPolarHBondContact O-CD 3.47Å
624	G	27.2	Very low	29.1	Very low	71 Å²	71	145 Å²	145	73%	0.732	80%	0.796	S	S	*	*			trans	161	77.4	172.2	0	0	0	0	0	117
625	V	31.7	Very low	28.7	Very low	137 Å²	137	150.3 Å²	150.3	83%	0.83	80%	0.802	S	S	*	*			trans	-138.3	110.5	147.9	-171.5	0	0	0	0	108.2	V627	V625-V627 HydrophobicContact CG1-CG2 3.93Å
626	T	25.8	Very low	28.7	Very low	123 Å²	123	148.3 Å²	148.3	76%	0.755	80%	0.799	S	S	*	*			trans	-84	117.1	170.8	44.9	0	0	0	0	109.6
627	V	31	Very low	28.7	Very low	85 Å²	85	146 Å²	146	52%	0.515	80%	0.795	S	S	.	*			trans	-123.7	111.5	166.8	-170.3	0	0	0	0	108	V625 Y629	V625-V627 HydrophobicContact CG1-CG2 3.93Å; V627-Y629 HydrophobicContact CB-CE2 3.83Å; V627-Y629 HydrophobicContact CG1-CD2 4.24Å; V627-Y629 HydrophobicContact CG1-CE1 4.29Å; V627-Y629 HydrophobicContact CG1-CE2 3.56Å; V627-Y629 WeakPolarHBondContact O-CD2 3.31Å
628	G	26.6	Very low	28.6	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	78%	0.783	S	S	*	*			trans	-76.2	135.7	173.2	0	0	0	0	0	110.5
629	Y	31.6	Very low	28.6	Very low	164 Å²	164	133.3 Å²	133.3	64%	0.643	77%	0.773	S	S	*	*			trans	-121	112.8	175.1	-72	-80.9	0	0	0	109.9	V627	V627-Y629 HydrophobicContact CB-CE2 3.83Å; V627-Y629 HydrophobicContact CG1-CD2 4.24Å; V627-Y629 HydrophobicContact CG1-CE1 4.29Å; V627-Y629 HydrophobicContact CG1-CE2 3.56Å; V627-Y629 WeakPolarHBondContact O-CD2 3.31Å
630	T	30.2	Very low	28.6	Very low	131 Å²	131	137.1 Å²	137.1	80%	0.804	77%	0.768	S	S	*	*			trans	-70.4	136.2	167.6	45.5	0	0	0	0	109.7	D632	T630-D632 PolarHBondContact O-N 3.45Å
631	Y	26.6	Very low	28.7	Very low	219 Å²	219	139.3 Å²	139.3	86%	0.859	77%	0.772	S	S	*	*			trans	-86.7	99.5	178	-92.8	-98.5	0	0	0	110.8
632	D	26.8	Very low	28.8	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	77%	0.766	S	S	*	*			trans	-96.1	125.5	158.5	-77.4	-53.8	0	0	0	109.5	T630	T630-D632 PolarHBondContact O-N 3.45Å
633	A	26.2	Very low	28.7	Very low	85 Å²	85	140.6 Å²	140.6	70%	0.702	77%	0.769	S	S	*	*			trans	-91.8	111.2	-167.4	0	0	0	0	0	112.8
634	F	28.1	Very low	28.6	Very low	190 Å²	190	146.9 Å²	146.9	83%	0.833	78%	0.778	S	S	*	*			trans	-123.5	110.4	163.7	-85.6	-85.4	0	0	0	111.3	I636	F634-I636 PolarHBondContact O-N 3.43Å
635	F	26.3	Very low	28.7	Very low	200 Å²	200	148.8 Å²	148.8	88%	0.877	78%	0.775	S	S	*	*			trans	-71	108.9	169.9	-83.9	-105.8	0	0	0	109.8
636	I	30.1	Very low	28.7	Very low	156 Å²	156	151.8 Å²	151.8	80%	0.8	78%	0.777	S	S	*	*			trans	-108.8	100	165.7	-58.4	-177.4	0	0	0	108.2	F634	F634-I636 PolarHBondContact O-N 3.43Å
637	S	29	Very low	28.9	Very low	107 Å²	107	152.3 Å²	152.3	75%	0.748	78%	0.775	S	S	*	*			trans	-66	143.4	171.9	48.2	0	0	0	0	110.8	G639	S637-G639 VanDerWaalsContact C-N 3.34Å; S637-G639 PolarHBondContact O-N 3.14Å
638	D	28.2	Very low	28.9	Very low	135 Å²	135	154.1 Å²	154.1	72%	0.722	79%	0.791	S	S	*	*			trans	-69.5	79.7	-165.6	-161.8	-11.1	0	0	0	112.9	R640	D638-R640 PolarHBondContact O-N 3.38Å
639	G	29.5	Very low	29.1	Very low	69 Å²	69	157.9 Å²	157.9	71%	0.711	79%	0.788	S	S	*	*			trans	-74	68.8	-163.8	0	0	0	0	0	116.2	S637 S641	S637-G639 VanDerWaalsContact C-N 3.34Å; S637-G639 PolarHBondContact O-N 3.14Å; G639-S641 PolarHBondContact O-N 3.36Å
640	R	28.7	Very low	29	Very low	206 Å²	206	156 Å²	156	78%	0.777	79%	0.788	S	S	*	*			trans	-75.7	63.2	173.8	-75.1	-171.4	172	177.6	0.1	114.3	D638	D638-R640 PolarHBondContact O-N 3.38Å
641	S	31	Very low	29.1	Very low	116 Å²	116	158.5 Å²	158.5	81%	0.811	79%	0.787	S	S	*	*			trans	-99.9	144.4	168.1	-80.9	0	0	0	0	112.1	G639	G639-S641 PolarHBondContact O-N 3.36Å
642	R	30.6	Very low	29.4	Very low	217 Å²	217	155.8 Å²	155.8	82%	0.819	78%	0.783	S	S	*	*			trans	-67.2	128.8	-167.6	-67.3	164.7	166.7	155.7	-10.5	111.9	R644	R642-R644 PolarHBondContact O-N 2.91Å; R642-R644 VanDerWaalsContact O-N 3.14Å
643	K	28.5	Very low	29.5	Very low	207 Å²	207	153.1 Å²	153.1	90%	0.9	78%	0.775	S	S	*	*			trans	-58.6	115.9	160.3	-81.1	-169.1	175.5	-172.7	0	109.2
644	R	27	Very low	29.9	Very low	245 Å²	245	157.8 Å²	157.8	93%	0.925	78%	0.78	S	S	*	*			trans	-145.1	61.5	160.2	-153.6	-177.8	-157.3	-171.5	5.7	110.6	R642	R642-R644 PolarHBondContact O-N 2.91Å; R642-R644 VanDerWaalsContact O-N 3.14Å
645	V	28.1	Very low	29.9	Very low	110 Å²	110	155.3 Å²	155.3	67%	0.667	77%	0.774	S	S	*	*			trans	-92.4	124.7	170.3	179.9	0	0	0	0	108.4	N647	V645-N647 WeakPolarHBondContact CG1-OD1 3.42Å
646	K	33.7	Very low	30.1	Very low	201 Å²	201	153.4 Å²	153.4	87%	0.874	77%	0.768	S	S	*	*			trans	-120.6	124.1	148.8	-95.7	-164.4	169.7	-167.3	0	106.1
647	N	28.7	Very low	30.2	Very low	133 Å²	133	155 Å²	155	71%	0.711	77%	0.769	S	S	*	*			trans	-76.7	142.5	179	-65.5	-20.3	0	0	0	110.6	V645	V645-N647 WeakPolarHBondContact CG1-OD1 3.42Å
648	S	32.2	Very low	30.2	Very low	123 Å²	123	160.6 Å²	160.6	86%	0.86	77%	0.774	S	S	*	*			trans	-143.2	137.7	133.3	57.2	0	0	0	0	108
649	H	30.8	Very low	30.5	Very low	158 Å²	158	162.4 Å²	162.4	73%	0.731	78%	0.778	S	S	*	*			trans	-135.6	138.6	-168.5	-110.4	-61	0	0	0	110
650	I	28.8	Very low	30.5	Very low	125 Å²	125	162.8 Å²	162.8	64%	0.641	77%	0.77	S	S	*	*			trans	65.9	113.1	147.3	-54.5	160.6	0	0	0	117.8	Q652	I650-Q652 HydrophobicContact CG2-CG 4.45Å
651	K	32.4	Very low	30.5	Very low	183 Å²	183	162.2 Å²	162.2	80%	0.796	77%	0.769	S	S	*	*				-163.2	122.6	111.1	-97.2	162	-170.9	176.4	0	107.6
652	Q	32.5	Very low	30.6	Very low	162 Å²	162	164.8 Å²	164.8	76%	0.757	77%	0.768	S	S	*	*				61.4	134.5	84.1	-68.4	179.8	-7.3	0	0	112.8	I650	I650-Q652 HydrophobicContact CG2-CG 4.45Å
653	S	29.7	Very low	30.4	Very low	88 Å²	88	158.2 Å²	158.2	62%	0.615	76%	0.755	S	S	*	*			cis	-174.4	-175.7	-1.2	51.2	0	0	0	0	109.8
654	K	33.4	Very low	30.3	Very low	183 Å²	183	155.2 Å²	155.2	80%	0.796	75%	0.749	S	S	*	*			trans	79.8	149.2	167.7	-56.7	168.2	-174	176.5	0	115.4
655	L	29.5	Very low	30.4	Very low	138 Å²	138	149.9 Å²	149.9	72%	0.723	74%	0.739	S	S	*	*			cis	-152	169.9	-9	-119.7	168.7	0	0	0	112.1
656	Q	29.1	Very low	30.4	Very low	160 Å²	160	151.8 Å²	151.8	75%	0.748	75%	0.745	S	S	*	*			trans	-58.1	153.9	-176.3	-56.4	147.5	-19.8	0	0	115.5
657	K	32.7	Very low	30.3	Very low	188 Å²	188	149.8 Å²	149.8	82%	0.817	74%	0.744	S	S	*	*				-176.6	131.2	111.9	-97	157	-174.7	176.4	0	112.9
658	R	29.1	Very low	30.3	Very low	225 Å²	225	149.6 Å²	149.6	85%	0.849	75%	0.748	S	S	*	*			trans	39.8	147.5	136.3	-49.8	173.4	139.5	-168.5	-6.6	119.4
659	Q	35.2	Very low	30.3	Very low	173 Å²	173	149.6 Å²	149.6	81%	0.808	75%	0.748	S	S	*	*			cis	-147.1	170.4	35.4	-77.8	178.7	-29.7	0	0	114.3
660	S	27.7	Very low	30.1	Very low	78 Å²	78	150.1 Å²	150.1	55%	0.545	76%	0.755	S	S	.	*			trans	-49.4	160.9	169.1	46.6	0	0	0	0	115.3
661	Y	30.5	Very low	30.2	Very low	193 Å²	193	153 Å²	153	76%	0.757	77%	0.766	S	S	*	*				-163.8	159.3	60.8	-91.9	-74.6	0	0	0	116
662	H	32	Very low	29.9	Very low	171 Å²	171	152.3 Å²	152.3	79%	0.792	77%	0.77	S	S	*	*			trans	27.7	149.3	147.8	-72	-46.8	0	0	0	121.6
663	S	26.5	Very low	29.7	Very low	78 Å²	78	152.2 Å²	152.2	55%	0.545	77%	0.773	S	S	.	*			cis	158.7	115.8	-3.3	164.5	0	0	0	0	106.1
664	N	26.3	Very low	29.5	Very low	144 Å²	144	152.9 Å²	152.9	77%	0.77	78%	0.778	S	S	*	*			trans	74.8	151.4	143.8	-62	8.9	0	0	0	122.7
665	N	29.8	Very low	29.4	Very low	134 Å²	134	150.3 Å²	150.3	72%	0.717	78%	0.78	S	S	*	*			trans	72.5	104.3	160.6	-62.4	9.2	0	0	0	118.7
666	D	28.1	Very low	29.4	Very low	150 Å²	150	152.1 Å²	152.1	80%	0.802	79%	0.785	S	S	*	*				36	110	115.2	-47.4	-18.7	0	0	0	117.8
667	D	32.4	Very low	29.5	Very low	159 Å²	159	149 Å²	149	85%	0.85	78%	0.781	S	S	*	*				-151.7	152.1	121.5	-136.8	-30.5	0	0	0	112.8
668	T	28.1	Very low	29.3	Very low	129 Å²	129	147.2 Å²	147.2	79%	0.791	78%	0.78	S	S	*	*			trans	-87.5	126.3	-179.1	46.7	0	0	0	0	112.2
669	S	32.4	Very low	29.2	Very low	122 Å²	122	142 Å²	142	85%	0.853	77%	0.768	S	S	*	*			trans	-150.4	111.9	167.3	-83.2	0	0	0	0	111.6
670	L	25.6	Very low	28.9	Very low	170 Å²	170	140.1 Å²	140.1	89%	0.89	77%	0.768	S	S	*	*			trans	-77.8	125.6	175.5	-70	165.1	0	0	0	110.4
671	Q	31.7	Very low	28.8	Very low	184 Å²	184	142.2 Å²	142.2	86%	0.86	77%	0.773	S	S	*	*			trans	-131.7	131.1	153.6	-71.8	-159.3	-2.9	0	0	110.4
672	L	24.7	Very low	28.6	Very low	169 Å²	169	139.8 Å²	139.8	89%	0.885	78%	0.779	S	S	*	*			trans	-88.5	126	-179	-59.1	93.7	0	0	0	110
673	I	28.7	Very low	28.5	Very low	160 Å²	160	136.7 Å²	136.7	82%	0.821	78%	0.776	S	S	*	*			trans	-134.1	133.3	162.5	-58.2	-176.8	0	0	0	108.8
674	S	26.1	Very low	28.5	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	79%	0.787	S	S	*	*			trans	-80.2	146	-164.8	-46.5	0	0	0	0	114.5	Q676	S674-Q676 PolarHBondContact O-N 3.06Å
675	P	31.7	Very low	28.7	Very low	129 Å²	129	139.1 Å²	139.1	84%	0.838	77%	0.774	S	S	*	*			trans	-78.4	111.6	171.4	31.1	-32.5	0	0	0	111.5
676	Q	29	Very low	28.6	Very low	176 Å²	176	138 Å²	138	82%	0.822	78%	0.775	S	S	*	*			trans	-80.4	117.7	169.1	-71.1	-176.6	-19.2	0	0	110.9	S674 N678	S674-Q676 PolarHBondContact O-N 3.06Å; Q676-N678 PolarHBondContact O-N 2.6Å
677	S	30.7	Very low	28.8	Very low	95 Å²	95	134.8 Å²	134.8	66%	0.664	76%	0.764	S	S	*	*			trans	-92.2	93	179.3	57.4	0	0	0	0	112.6	I679	S677-I679 PolarHBondContact O-N 3.21Å
678	N	28.9	Very low	28.8	Very low	149 Å²	149	132.2 Å²	132.2	80%	0.797	75%	0.75	S	S	*	*			trans	-87.8	101.3	171.7	-87.7	-39.7	0	0	0	111.4	Q676	Q676-N678 PolarHBondContact O-N 2.6Å
679	I	26.6	Very low	29	Very low	116 Å²	116	132.2 Å²	132.2	60%	0.595	75%	0.745	S	S	*	*			trans	-91.6	119.6	173.5	-59.4	174.2	0	0	0	109.2	S677 L728	S677-I679 PolarHBondContact O-N 3.21Å; I679-L728 HydrophobicContact CD1-CD2 3.89Å
680	T	29	Very low	29.1	Very low	134 Å²	134	129.4 Å²	129.4	82%	0.822	72%	0.721	S	S	*	*			trans	-113.7	126.9	172.4	49.4	0	0	0	0	111.5
681	N	25.2	Very low	29.5	Very low	121 Å²	121	126.9 Å²	126.9	65%	0.647	71%	0.708	S	S	*	*			trans	-80	139.7	-168.8	-74.6	-64.8	0	0	0	113.2
682	T	28.3	Very low	29.6	Very low	143 Å²	143	122.6 Å²	122.6	88%	0.877	70%	0.698	S	S	*	*			trans	-121.6	124.3	156.2	57.6	0	0	0	0	110.4
683	S	28	Very low	30	Very low	105 Å²	105	118.7 Å²	118.7	73%	0.734	68%	0.678	S	S	*	*			trans	-96.5	122.9	-159	52.9	0	0	0	0	114.3
684	R	27.7	Very low	30.1	Very low	202 Å²	202	114.4 Å²	114.4	76%	0.762	66%	0.661	S	S	*	*			trans	-135.8	122.5	154	-83	-172.2	169.8	156.6	-2	110.1	C686	R684-C686 PolarHBondContact O-N 2.9Å
685	S	30.1	Very low	30.5	Very low	72 Å²	72	114 Å²	114	50%	0.503	65%	0.654	S	S	.	*	P	Polyproline II helix	trans	-78.9	116.2	-174	54.4	0	0	0	0	112.6	N750	S685-N750 PolarHBondContact OG-ND2 3.27Å
686	C	27.9	Very low	30.6	Very low	111 Å²	111	110.4 Å²	110.4	75%	0.75	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-83.8	158	154.7	-64.3	0	0	0	0	110	R684	R684-C686 PolarHBondContact O-N 2.9Å
687	S	31.6	Very low	30.9	Very low	81 Å²	81	108.8 Å²	108.8	57%	0.566	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-77	151	173.2	-62.7	0	0	0	0	110.7	D689 D690	S687-D689 WeakPolarHBondContact CB-OD2 3.45Å; S687-D689 PolarHBondContact O-N 2.8Å; S687-D689 VanDerWaalsContact O-N 3.09Å; S687-D690 PolarHBondContact O-N 3.21Å
688	L	33.1	Very low	31	Very low	105 Å²	105	110.5 Å²	110.5	55%	0.55	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-68.9	-4.2	-178.5	-81	152.9	0	0	0	114.4	D690 L691	L688-D690 PolarHBondContact O-N 3.4Å; L688-L691 HydrophobicContact CD2-CD1 4.09Å
689	D	32.2	Very low	31.2	Very low	130 Å²	130	111.2 Å²	111.2	70%	0.695	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-73.1	-9.5	177.6	-46.3	-59.5	0	0	0	113.6	S687	S687-D689 WeakPolarHBondContact CB-OD2 3.45Å; S687-D689 PolarHBondContact O-N 2.8Å; S687-D689 VanDerWaalsContact O-N 3.09Å
690	D	34.1	Very low	31.7	Very low	63 Å²	63	110.6 Å²	110.6	34%	0.337	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-89.9	-4	-176.7	-78.6	-39.2	0	0	0	114.9	S687 L688 S692 N693 R837	S687-D690 PolarHBondContact O-N 3.21Å; L688-D690 PolarHBondContact O-N 3.4Å; D690-S692 PolarHBondContact O-N 2.92Å; D690-N693 WeakPolarHBondContact O-CB 3.32Å; D690-N693 PolarHBondContact O-N 3.42Å; D690-R837 IonicContact OD1-CZ 2.73Å; D690-R837 VanDerWaalsContact OD1-CZ 3.25Å; D690-R837 IonicContact OD1-NH1 3.25Å; D690-R837 PolarHBondContact OD1-NH1 3.29Å; D690-R837 IonicContact OD1-NH2 3.41Å; D690-R837 PolarHBondContact OD1-NH2 3.04Å
691	L	34	Very low	32.1	Very low	117 Å²	117	109.5 Å²	109.5	61%	0.613	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-67.4	-17.9	-179.1	-89.4	75.6	0	0	0	114.4	L688 N693 C694	L688-L691 HydrophobicContact CD2-CD1 4.09Å; L691-N693 PolarHBondContact O-N 3.33Å; L691-C694 PolarHBondContact O-N 2.96Å
692	S	33.8	Very low	32.4	Very low	94 Å²	94	108.3 Å²	108.3	66%	0.657	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-68.4	4.9	175.3	63.7	0	0	0	0	114.5	D690	D690-S692 PolarHBondContact O-N 2.92Å
693	N	34.4	Very low	32.7	Very low	86 Å²	86	107.1 Å²	107.1	46%	0.46	58%	0.581	S	S	.	*	G	3₁₀ helix	trans	-110.7	-4	-176.1	-113.9	100.8	0	0	0	114.1	D690 L691 R837	D690-N693 WeakPolarHBondContact O-CB 3.32Å; D690-N693 PolarHBondContact O-N 3.42Å; L691-N693 PolarHBondContact O-N 3.33Å; N693-R837 PolarHBondContact OD1-NH2 3.41Å
694	C	29.3	Very low	33	Very low	71 Å²	71	107.4 Å²	107.4	48%	0.48	58%	0.578	S	S	.	*			trans	-92	-15.8	-169.9	-65.4	0	0	0	0	115.6	L691 N696 E697	L691-C694 PolarHBondContact O-N 2.96Å; C694-N696 PolarHBondContact O-N 3.48Å; C694-E697 PolarHBondContact O-N 3.48Å
695	T	34.1	Very low	33.3	Very low	93 Å²	93	103 Å²	103	57%	0.571	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	12.4	-170.9	55.7	0	0	0	0	116
696	N	33.7	Very low	33.5	Very low	54 Å²	54	104.9 Å²	104.9	29%	0.289	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.4	-19.1	178.8	-81.5	-29.3	0	0	0	113.9	C694 R699	C694-N696 PolarHBondContact O-N 3.48Å; N696-R699 PolarHBondContact O-N 2.88Å
697	E	35.4	Very low	33.7	Very low	143 Å²	143	106.4 Å²	106.4	67%	0.668	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-34.1	176.6	-67.7	-179.7	153.9	0	0	110.9	C694 R699 V700	C694-E697 PolarHBondContact O-N 3.48Å; E697-R699 PolarHBondContact O-N 2.82Å; E697-V700 PolarHBondContact O-N 2.91Å; E697-V700 VanDerWaalsContact O-N 3.15Å
698	E	34.3	Very low	33.6	Very low	130 Å²	130	108.5 Å²	108.5	61%	0.607	58%	0.579	S	S	*	*	H	α-helix	trans	-61.2	-22.4	171.4	-61.5	179.4	137	0	0	113.4	N702	E698-N702 PolarHBondContact O-N 2.89Å; E698-N702 PolarHBondContact O-ND2 3.33Å
699	R	33.3	Very low	33.5	Very low	165 Å²	165	108.6 Å²	108.6	62%	0.623	59%	0.589	S	S	*	*	H	α-helix	trans	-81.6	-18	177.6	-86.5	180	162.9	160.7	-4.9	114.2	N696 E697	N696-R699 PolarHBondContact O-N 2.88Å; E697-R699 PolarHBondContact O-N 2.82Å
700	V	36.7	Very low	33.5	Very low	102 Å²	102	105.8 Å²	105.8	62%	0.618	58%	0.579	S	S	*	*	H	α-helix	trans	-73.3	-42.6	173.6	-177.6	0	0	0	0	110.1	E697 N702 N703 T704	E697-V700 PolarHBondContact O-N 2.91Å; E697-V700 VanDerWaalsContact O-N 3.15Å; V700-N702 PolarHBondContact O-N 3.35Å; V700-N703 PolarHBondContact O-N 2.8Å; V700-T704 PolarHBondContact O-N 3.07Å; V700-T704 PolarHBondContact O-OG1 3.07Å
701	I	36.2	Very low	33.5	Very low	112 Å²	112	111 Å²	111	57%	0.574	60%	0.599	S	S	*	*	H	α-helix	trans	-63.9	-38.9	179.2	-58.6	174.9	0	0	0	111.6	N703 T704	I701-N703 VanDerWaalsContact C-N 3.32Å; I701-N703 PolarHBondContact O-N 3.09Å; I701-T704 PolarHBondContact O-OG1 3.45Å
702	N	33.4	Very low	33.4	Very low	95 Å²	95	109.7 Å²	109.7	51%	0.508	60%	0.6	S	S	.	*	H	α-helix	trans	-71.8	-22.3	179.4	-78.7	-68	0	0	0	113.9	E698 V700 N706	E698-N702 PolarHBondContact O-N 2.89Å; E698-N702 PolarHBondContact O-ND2 3.33Å; V700-N702 PolarHBondContact O-N 3.35Å; N702-N706 PolarHBondContact O-ND2 3.26Å
703	N	32.9	Very low	33.3	Very low	118 Å²	118	111.9 Å²	111.9	63%	0.631	60%	0.599	S	S	*	*	H	α-helix	trans	-84.5	-27.3	179.3	-78.3	-12.3	0	0	0	113.3	V700 I701 L705	V700-N703 PolarHBondContact O-N 2.8Å; I701-N703 VanDerWaalsContact C-N 3.32Å; I701-N703 PolarHBondContact O-N 3.09Å; N703-L705 PolarHBondContact O-N 3.39Å
704	T	34.7	Very low	33.2	Very low	111 Å²	111	112 Å²	112	68%	0.681	60%	0.599	S	S	*	*	H	α-helix	trans	-71.6	-16.3	171.5	23.3	0	0	0	0	113.7	V700 I701	V700-T704 PolarHBondContact O-N 3.07Å; V700-T704 PolarHBondContact O-OG1 3.07Å; I701-T704 PolarHBondContact O-OG1 3.45Å
705	L	35	Very low	33.4	Very low	111 Å²	111	112.4 Å²	112.4	58%	0.581	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-6.1	-179.4	-71.5	168.8	0	0	0	114.8	N703 L714	N703-L705 PolarHBondContact O-N 3.39Å; L705-L714 HydrophobicContact CD2-CD2 4.42Å
706	N	33.2	Very low	33.3	Very low	111 Å²	111	112.4 Å²	112.4	59%	0.594	61%	0.607	S	S	*	*			trans	-93.6	-2.6	-172	-86.4	-41	0	0	0	115.9	N702 N708	N702-N706 PolarHBondContact O-ND2 3.26Å; N706-N708 PolarHBondContact O-ND2 3.24Å
707	N	32.6	Very low	33.4	Very low	142 Å²	142	114.4 Å²	114.4	76%	0.759	62%	0.616	S	S	*	*	S	Bend	trans	-82.3	123.2	176.4	-78.1	-21.8	0	0	0	111.4	S709	N707-S709 PolarHBondContact O-N 3.31Å
708	N	29	Very low	33.4	Very low	126 Å²	126	111.6 Å²	111.6	67%	0.674	61%	0.609	S	S	*	*	S	Bend	trans	-83.8	100.1	-166	-72.6	-85.6	0	0	0	113.1	N706 K711	N706-N708 PolarHBondContact O-ND2 3.24Å; N708-K711 WeakPolarHBondContact OD1-CE 3.2Å; N708-K711 PolarHBondContact OD1-NZ 2.94Å
709	S	31	Very low	33.4	Very low	107 Å²	107	109.3 Å²	109.3	75%	0.748	61%	0.608	S	S	*	*	S	Bend	trans	-151.3	-26.4	166	50.5	0	0	0	0	116.3	N707	N707-S709 PolarHBondContact O-N 3.31Å
710	S	32.9	Very low	33.6	Very low	71 Å²	71	105.3 Å²	105.3	50%	0.497	61%	0.605	S	S	.	*			trans	-114.4	32.8	-168	-53.3	0	0	0	0	116	S712 H713	S710-S712 PolarHBondContact O-N 2.78Å; S710-S712 VanDerWaalsContact O-N 3.08Å; S710-H713 PolarHBondContact O-N 3.09Å
711	K	34.6	Very low	33.6	Very low	173 Å²	173	102.9 Å²	102.9	75%	0.752	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-10.9	-172	-88.7	173	169.9	163.5	0	116.3	N708	N708-K711 WeakPolarHBondContact OD1-CE 3.2Å; N708-K711 PolarHBondContact OD1-NZ 2.94Å
712	S	32.1	Very low	33.8	Very low	89 Å²	89	101.6 Å²	101.6	62%	0.622	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-21.3	-179.9	50.2	0	0	0	0	115.3	S710	S710-S712 PolarHBondContact O-N 2.78Å; S710-S712 VanDerWaalsContact O-N 3.08Å
713	H	31.6	Very low	33.8	Very low	140 Å²	140	100.9 Å²	100.9	65%	0.648	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-16.3	-170.6	-78.6	-83.7	0	0	0	115.5	S710	S710-H713 PolarHBondContact O-N 3.09Å
714	L	31.5	Very low	34	Very low	87 Å²	87	101.1 Å²	101.1	46%	0.455	59%	0.593	S	S	.	*	S	Bend	trans	-81.7	-22.4	-175.6	-89.2	71.9	0	0	0	114.2	L705 S716 I717 T718	L705-L714 HydrophobicContact CD2-CD2 4.42Å; L714-S716 VanDerWaalsContact C-N 3.26Å; L714-S716 PolarHBondContact O-N 2.84Å; L714-I717 PolarHBondContact O-N 2.78Å; L714-I717 VanDerWaalsContact O-N 3.14Å; L714-T718 PolarHBondContact O-N 2.81Å; L714-T718 PolarHBondContact O-OG1 3.35Å
715	S	32.8	Very low	34	Very low	81 Å²	81	101.8 Å²	101.8	57%	0.566	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-34.1	-179.9	45.5	0	0	0	0	113.4	T718	S715-T718 PolarHBondContact O-OG1 2.93Å
716	S	33.1	Very low	34.1	Very low	93 Å²	93	101.9 Å²	101.9	65%	0.65	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-10.4	179.8	-51.5	0	0	0	0	114.3	L714	L714-S716 VanDerWaalsContact C-N 3.26Å; L714-S716 PolarHBondContact O-N 2.84Å
717	I	34.5	Very low	34.1	Very low	95 Å²	95	101.1 Å²	101.1	49%	0.487	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.3	-33.7	-174.7	-59.1	175.7	0	0	0	110.7	L714 S719 S720 S721	L714-I717 PolarHBondContact O-N 2.78Å; L714-I717 VanDerWaalsContact O-N 3.14Å; I717-S719 VanDerWaalsContact C-N 3.28Å; I717-S719 PolarHBondContact O-N 2.92Å; I717-S720 PolarHBondContact O-N 3.1Å; I717-S721 PolarHBondContact O-N 3.41Å; I717-S721 PolarHBondContact O-OG 3Å
718	T	36.9	Very low	34.3	Very low	85 Å²	85	99.3 Å²	99.3	52%	0.521	59%	0.586	S	S	.	*	H	α-helix	trans	-65.6	-21.5	-175.4	40.2	0	0	0	0	115.4	L714 S715 T722	L714-T718 PolarHBondContact O-N 2.81Å; L714-T718 PolarHBondContact O-OG1 3.35Å; S715-T718 PolarHBondContact O-OG1 2.93Å; T718-T722 WeakPolarHBondContact O-CG2 3.43Å; T718-T722 PolarHBondContact O-OG1 3.22Å
719	S	34.6	Very low	34.4	Very low	82 Å²	82	100.6 Å²	100.6	57%	0.573	59%	0.593	S	S	*	*	H	α-helix	trans	-76.9	-35.7	175.6	47.9	0	0	0	0	113.4	I717 T722	I717-S719 VanDerWaalsContact C-N 3.28Å; I717-S719 PolarHBondContact O-N 2.92Å; S719-T722 PolarHBondContact O-OG1 3.24Å
720	S	36.5	Very low	34.7	Very low	81 Å²	81	103.6 Å²	103.6	57%	0.566	60%	0.595	S	S	*	*	H	α-helix	trans	-88.4	-36	-176.8	-60	0	0	0	0	112.8	I717 T722	I717-S720 PolarHBondContact O-N 3.1Å; S720-T722 PolarHBondContact O-N 2.88Å
721	S	37.3	Very low	35	Very low	51 Å²	51	104.9 Å²	104.9	36%	0.357	60%	0.6	S	S	.	*	H	α-helix	trans	-72.5	-27.2	-177.4	-59.7	0	0	0	0	113.9	I717 L724 L725	I717-S721 PolarHBondContact O-N 3.41Å; I717-S721 PolarHBondContact O-OG 3Å; S721-L724 PolarHBondContact O-N 3.47Å; S721-L725 WeakPolarHBondContact O-CG 3.21Å; S721-L725 PolarHBondContact O-N 3.38Å
722	T	39	Very low	35.5	Very low	84 Å²	84	105.4 Å²	105.4	52%	0.515	61%	0.605	S	S	.	*	H	α-helix	trans	-69.1	-33.4	-180	40.5	0	0	0	0	112.7	T718 S719 S720 V726	T718-T722 WeakPolarHBondContact O-CG2 3.43Å; T718-T722 PolarHBondContact O-OG1 3.22Å; S719-T722 PolarHBondContact O-OG1 3.24Å; S720-T722 PolarHBondContact O-N 2.88Å; T722-V726 WeakPolarHBondContact O-CG2 3.42Å; T722-V726 PolarHBondContact O-N 3.08Å
723	S	34.7	Very low	36.3	Very low	80 Å²	80	105 Å²	105	56%	0.559	60%	0.599	S	S	*	*	H	α-helix	trans	-62.5	-42.7	173	-173.4	0	0	0	0	112.3	T727	S723-T727 PolarHBondContact O-OG1 2.89Å
724	L	36	Very low	37.5	Very low	123 Å²	123	106.3 Å²	106.3	64%	0.644	61%	0.605	S	S	*	*	H	α-helix	trans	-75.1	-26.8	-177.3	-70.7	169.1	0	0	0	113.9	S721 T727	S721-L724 PolarHBondContact O-N 3.47Å; L724-T727 PolarHBondContact O-OG1 3.24Å
725	L	36.2	Very low	39.8	Very low	126 Å²	126	109.1 Å²	109.1	66%	0.66	61%	0.61	S	S	*	*	H	α-helix	trans	-78.9	-18.8	177.7	-71.3	170.1	0	0	0	113.5	S721	S721-L725 WeakPolarHBondContact O-CG 3.21Å; S721-L725 PolarHBondContact O-N 3.38Å
726	V	36.1	Very low	42.1	Very low	112 Å²	112	109.7 Å²	109.7	68%	0.679	60%	0.601	S	S	*	*	H	α-helix	trans	-81.2	-32.7	173.5	173.9	0	0	0	0	111.6	T722 L728	T722-V726 WeakPolarHBondContact O-CG2 3.42Å; T722-V726 PolarHBondContact O-N 3.08Å; V726-L728 PolarHBondContact O-N 3.16Å; V726-L728 VanDerWaalsContact O-N 3.1Å
727	T	33.7	Very low	44.5	Very low	96 Å²	96	108 Å²	108	59%	0.589	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	3.1	-173.9	44.7	0	0	0	0	116.5	S723 L724	S723-T727 PolarHBondContact O-OG1 2.89Å; L724-T727 PolarHBondContact O-OG1 3.24Å
728	L	35.7	Very low	47	Very low	103 Å²	103	103.5 Å²	103.5	54%	0.539	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.9	-0.8	-176.6	-72.6	174.6	0	0	0	115.4	I679 V726	I679-L728 HydrophobicContact CD1-CD2 3.89Å; V726-L728 PolarHBondContact O-N 3.16Å; V726-L728 VanDerWaalsContact O-N 3.1Å
729	N	31.9	Very low	49.2	Very low	154 Å²	154	104.2 Å²	104.2	82%	0.824	57%	0.571	S	S	*	*	S	Bend	trans	-108.5	0.4	-174.5	-92.3	-42.3	0	0	0	116.3
730	E	36.6	Very low	51.4	Low	170 Å²	170	104.9 Å²	104.9	79%	0.794	57%	0.569	S	S	*	*			trans	-112	56	-177.8	-66.7	-158.3	118.8	0	0	114.3	Q732	E730-Q732 PolarHBondContact O-N 3.09Å
731	T	38.8	Very low	53.7	Low	98 Å²	98	103.5 Å²	103.5	60%	0.601	56%	0.559	S	S	*	*			trans	-86	103.1	154	51.4	0	0	0	0	109.2	T733	T731-T733 PolarHBondContact O-N 3.34Å
732	Q	46.7	Very low	55.9	Low	184 Å²	184	103.3 Å²	103.3	86%	0.86	56%	0.564	S	S	*	*			trans	-69.1	58.3	169.4	-66.3	-170.4	5.7	0	0	111.4	E730 Q734	E730-Q732 PolarHBondContact O-N 3.09Å; Q732-Q734 PolarHBondContact O-N 3.38Å
733	T	48.7	Very low	58	Low	80 Å²	80	105 Å²	105	49%	0.491	57%	0.565	S	S	.	*			trans	-59.8	120.8	164.3	48.8	0	0	0	0	107.7	T731 R735	T731-T733 PolarHBondContact O-N 3.34Å; T733-R735 PolarHBondContact O-N 2.74Å
734	Q	57.3	Low	60.5	Low	167 Å²	167	105.1 Å²	105.1	78%	0.78	56%	0.559	S	S	*	*			trans	-58.7	101.1	178.4	-99.2	-172.6	-10.6	0	0	109.8	Q732 Y736	Q732-Q734 PolarHBondContact O-N 3.38Å; Q734-Y736 WeakPolarHBondContact O-CD2 3.36Å; Q734-Y736 WeakPolarHBondContact O-CE2 3.47Å
735	R	78.7	Confident	62.9	Low	146 Å²	146	102 Å²	102	55%	0.551	54%	0.539	S	S	*	.			trans	-82.8	124.9	175.8	-70.4	-176.7	-179.8	-175.2	0.5	108.6	T733 S737 N744 Y745	T733-R735 PolarHBondContact O-N 2.74Å; R735-S737 PolarHBondContact O-N 3.47Å; R735-N744 HydrophobicContact CB-CB 4.29Å; R735-Y745 CarbonylContact C-O 3.54Å
736	Y	82.2	Confident	65.2	Low	94 Å²	94	98.7 Å²	98.7	37%	0.369	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	95.1	-178.7	-69.5	-94.6	0	0	0	108.8	Q734 Y745 S748 L751	Q734-Y736 WeakPolarHBondContact O-CD2 3.36Å; Q734-Y736 WeakPolarHBondContact O-CE2 3.47Å; Y736-Y745 PolarHBondContact N-O 3.39Å; Y736-Y745 PolarHBondContact O-N 3.27Å; Y736-S748 VanDerWaalsContact CD2-N 3.34Å; Y736-S748 VanDerWaalsContact CE1-CB 3.49Å; Y736-L751 HydrophobicContact CD1-CD2 4.42Å
737	S	82.5	Confident	67.5	Low	56 Å²	56	95.8 Å²	95.8	39%	0.392	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	148.9	177.4	-157.1	0	0	0	0	112.1	R735 G742 K743 N744 L751	R735-S737 PolarHBondContact O-N 3.47Å; S737-G742 PolarHBondContact OG-O 2.93Å; S737-K743 CarbonylContact C-O 3.54Å; S737-K743 WeakPolarHBondContact CA-O 3.37Å; S737-N744 WeakPolarHBondContact CA-OD1 3.27Å; S737-N744 WeakPolarHBondContact CB-OD1 3.3Å; S737-N744 PolarHBondContact OG-OD1 3.33Å; S737-L751 VanDerWaalsContact O-CD2 3.3Å; S737-L751 WeakPolarHBondContact O-CD2 3.37Å
738	C	87.6	Confident	70.1	Confident	2 Å²	2	92.9 Å²	92.9	1%	0.014	50%	0.496	C	S	.	.			trans	-92.9	121.2	176.1	-155.9	0	0	0	0	110.8	D740 C741 G742 K743 L751 H754 H758	C738-D740 PolarHBondContact O-N 2.98Å; C738-D740 PolarHBondContact SG-OD2 3.39Å; C738-C741 PolarHBondContact O-N 3.37Å; C738-G742 WeakPolarHBondContact O-CA 3.2Å; C738-G742 PolarHBondContact O-N 3.49Å; C738-K743 PolarHBondContact N-O 3.44Å; C738-L751 HydrophobicContact CB-CD1 3.65Å; C738-H754 PolarHBondContact SG-CD2 3.31Å; C738-H758 PolarHBondContact SG-CD2 3.49Å; C738-H758 PolarHBondContact SG-NE2 2.64Å; C738-H758 VanDerWaalsContact SG-NE2 3.39Å
739	P	81.6	Confident	72.4	Confident	99 Å²	99	91.8 Å²	91.8	64%	0.643	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-30.4	-178.8	26.1	-33.5	0	0	0	112.2
740	D	80.8	Confident	74.9	Confident	96 Å²	96	85.7 Å²	85.7	51%	0.513	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-14.6	-172.2	-27.6	-84.5	0	0	0	113.6	C738 H758	C738-D740 PolarHBondContact O-N 2.98Å; C738-D740 PolarHBondContact SG-OD2 3.39Å; D740-H758 HydrophobicContact CB-CB 4.18Å; D740-H758 IonicContact OD2-CD2 3.28Å; D740-H758 PolarHBondContact OD2-CD2 2.81Å; D740-H758 VanDerWaalsContact OD2-CD2 3.26Å; D740-H758 IonicContact OD2-NE2 2.83Å
741	C	85.7	Confident	77.3	Confident	53 Å²	53	78.3 Å²	78.3	36%	0.358	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.7	12.1	179	77.8	0	0	0	0	116.8	C738 K743 H754 H758	C738-C741 PolarHBondContact O-N 3.37Å; C741-K743 PolarHBondContact O-N 2.98Å; C741-K743 VanDerWaalsContact O-N 3.09Å; C741-K743 VanDerWaalsContact SG-CG 3.58Å; C741-H754 PolarHBondContact SG-NE2 3.37Å; C741-H758 PolarHBondContact SG-CE1 3.32Å; C741-H758 PolarHBondContact SG-NE2 3.18Å
742	G	83.3	Confident	79.4	Confident	46 Å²	46	76.1 Å²	76.1	47%	0.474	42%	0.419	S	S	.	.			trans	70.4	-1.3	176.4	0	0	0	0	0	116.9	S737 C738 N744	S737-G742 PolarHBondContact OG-O 2.93Å; C738-G742 WeakPolarHBondContact O-CA 3.2Å; C738-G742 PolarHBondContact O-N 3.49Å; G742-N744 PolarHBondContact O-N 3.5Å; G742-N744 PolarHBondContact O-OD1 3.31Å
743	K	83.2	Confident	81	Confident	120 Å²	120	74.6 Å²	74.6	52%	0.522	41%	0.406	S	S	.	.			trans	-67.5	129.4	-176.8	-72.1	178.7	-174.6	179	0	111.8	S737 C738 C741 Y745	S737-K743 CarbonylContact C-O 3.54Å; S737-K743 WeakPolarHBondContact CA-O 3.37Å; C738-K743 PolarHBondContact N-O 3.44Å; C741-K743 PolarHBondContact O-N 2.98Å; C741-K743 VanDerWaalsContact O-N 3.09Å; C741-K743 VanDerWaalsContact SG-CG 3.58Å; K743-Y745 HydrophobicContact CB-CE2 3.6Å; K743-Y745 VanDerWaalsContact O-CD2 3.3Å; K743-Y745 WeakPolarHBondContact O-CD2 3.5Å; K743-Y745 VanDerWaalsContact O-CE2 3.23Å; K743-Y745 WeakPolarHBondContact O-CE2 3.19Å
744	N	86.5	Confident	82.6	Confident	82 Å²	82	71.6 Å²	71.6	44%	0.439	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.5	-173.5	-70.3	-34.4	0	0	0	112.2	R735 S737 G742	R735-N744 HydrophobicContact CB-CB 4.29Å; S737-N744 WeakPolarHBondContact CA-OD1 3.27Å; S737-N744 WeakPolarHBondContact CB-OD1 3.3Å; S737-N744 PolarHBondContact OG-OD1 3.33Å; G742-N744 PolarHBondContact O-N 3.5Å; G742-N744 PolarHBondContact O-OD1 3.31Å
745	Y	87.3	Confident	83.7	Confident	57 Å²	57	67.9 Å²	67.9	22%	0.224	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	141.5	-177.2	-64.8	-83.6	0	0	0	112.4	R735 Y736 K743 T747 N750 L751 H754	R735-Y745 CarbonylContact C-O 3.54Å; Y736-Y745 PolarHBondContact N-O 3.39Å; Y736-Y745 PolarHBondContact O-N 3.27Å; K743-Y745 HydrophobicContact CB-CE2 3.6Å; K743-Y745 VanDerWaalsContact O-CD2 3.3Å; K743-Y745 WeakPolarHBondContact O-CD2 3.5Å; K743-Y745 VanDerWaalsContact O-CE2 3.23Å; K743-Y745 WeakPolarHBondContact O-CE2 3.19Å; Y745-T747 PolarHBondContact O-N 3.33Å; Y745-N750 HydrophobicContact CD1-CB 3.84Å; Y745-N750 HydrophobicContact CG-CB 4.13Å; Y745-L751 HydrophobicContact CD2-CB 4.24Å; Y745-L751 HydrophobicContact CD2-CD1 4.22Å; Y745-L751 HydrophobicContact CG-CB 4.48Å; Y745-H754 HydrophobicContact CE1-CB 4.24Å; Y745-H754 HydrophobicContact CE2-CB 3.87Å; Y745-H754 AromaticContact CE2-CD2 3.19Å; Y745-H754 WeakPolarHBondContact CE2-CD2 3.45Å; Y745-H754 AromaticContact CE2-CG 3.69Å; Y745-H754 AromaticContact CZ-CD2 3.48Å; Y745-H754 VanDerWaalsContact CZ-CD2 3.48Å; Y745-H754 AromaticContact CZ-CG 3.55Å; Y745-H754 PolarHBondContact OH-CD2 3.1Å
746	A	83.6	Confident	83.7	Confident	58 Å²	58	64.5 Å²	64.5	48%	0.479	36%	0.358	S	S	.	.	S	Bend	trans	-70.4	-9.3	-179.8	0	0	0	0	0	114.6
747	T	85.7	Confident	83.2	Confident	51 Å²	51	64.3 Å²	64.3	31%	0.313	37%	0.367	S	S	.	.	S	Bend	trans	-149.9	150.2	179.9	60.3	0	0	0	0	111.8	Y745 S749 N750 L751	Y745-T747 PolarHBondContact O-N 3.33Å; T747-S749 VanDerWaalsContact C-N 3.29Å; T747-S749 PolarHBondContact O-N 3.44Å; T747-N750 WeakPolarHBondContact O-CB 3.23Å; T747-N750 PolarHBondContact O-N 3.23Å; T747-N750 VanDerWaalsContact O-N 3.09Å; T747-N750 WeakPolarHBondContact OG1-CB 3.3Å; T747-N750 PolarHBondContact OG1-N 3.32Å; T747-N750 PolarHBondContact OG1-ND2 3.37Å; T747-L751 PolarHBondContact O-N 3.18Å; T747-L751 VanDerWaalsContact O-N 3.16Å
748	S	86.8	Confident	82.9	Confident	34 Å²	34	64.9 Å²	64.9	24%	0.238	36%	0.363	C	S	.	.	H	α-helix	trans	-53.7	-44.2	173.8	-176.8	0	0	0	0	112.2	Y736 N750 L751 S752	Y736-S748 VanDerWaalsContact CD2-N 3.34Å; Y736-S748 VanDerWaalsContact CE1-CB 3.49Å; S748-N750 VanDerWaalsContact C-N 3.25Å; S748-N750 PolarHBondContact O-N 3.41Å; S748-L751 CarbonylContact O-C 3.42Å; S748-L751 PolarHBondContact O-N 3.13Å; S748-L751 VanDerWaalsContact O-N 3.08Å; S748-S752 PolarHBondContact O-N 2.91Å; S748-S752 PolarHBondContact O-OG 3.17Å
749	S	84.8	Confident	82	Confident	81 Å²	81	73.2 Å²	73.2	57%	0.566	39%	0.394	S	S	*	.	H	α-helix	trans	-61.9	-31.1	179.6	-37.2	0	0	0	0	113.1	T747 R753	T747-S749 VanDerWaalsContact C-N 3.29Å; T747-S749 PolarHBondContact O-N 3.44Å; S749-R753 WeakPolarHBondContact O-CB 3.42Å; S749-R753 PolarHBondContact O-N 3.42Å; S749-R753 VanDerWaalsContact O-N 3.13Å
750	N	83.9	Confident	80.8	Confident	25 Å²	25	72.3 Å²	72.3	13%	0.134	39%	0.39	C	S	.	.	H	α-helix	trans	-72.9	-43	173	-85.5	-26.1	0	0	0	111.7	S685 Y745 T747 S748 R753 H754	S685-N750 PolarHBondContact OG-ND2 3.27Å; Y745-N750 HydrophobicContact CD1-CB 3.84Å; Y745-N750 HydrophobicContact CG-CB 4.13Å; T747-N750 WeakPolarHBondContact O-CB 3.23Å; T747-N750 PolarHBondContact O-N 3.23Å; T747-N750 VanDerWaalsContact O-N 3.09Å; T747-N750 WeakPolarHBondContact OG1-CB 3.3Å; T747-N750 PolarHBondContact OG1-N 3.32Å; T747-N750 PolarHBondContact OG1-ND2 3.37Å; S748-N750 VanDerWaalsContact C-N 3.25Å; S748-N750 PolarHBondContact O-N 3.41Å; N750-R753 PolarHBondContact O-N 3.28Å; N750-R753 PolarHBondContact OD1-NH2 3.01Å; N750-H754 PolarHBondContact O-N 3.02Å
751	L	87.7	Confident	79.8	Confident	15 Å²	15	72.2 Å²	72.2	8%	0.079	39%	0.389	C	S	.	.	H	α-helix	trans	-60.7	-48	172.9	170.8	61.2	0	0	0	111.4	Y736 S737 C738 Y745 T747 S748 R753 H754 K755	Y736-L751 HydrophobicContact CD1-CD2 4.42Å; S737-L751 VanDerWaalsContact O-CD2 3.3Å; S737-L751 WeakPolarHBondContact O-CD2 3.37Å; C738-L751 HydrophobicContact CB-CD1 3.65Å; Y745-L751 HydrophobicContact CD2-CB 4.24Å; Y745-L751 HydrophobicContact CD2-CD1 4.22Å; Y745-L751 HydrophobicContact CG-CB 4.48Å; T747-L751 PolarHBondContact O-N 3.18Å; T747-L751 VanDerWaalsContact O-N 3.16Å; S748-L751 CarbonylContact O-C 3.42Å; S748-L751 PolarHBondContact O-N 3.13Å; S748-L751 VanDerWaalsContact O-N 3.08Å; L751-R753 VanDerWaalsContact C-N 3.3Å; L751-R753 PolarHBondContact O-N 3.32Å; L751-H754 CarbonylContact O-C 3.57Å; L751-H754 WeakPolarHBondContact O-CA 3.13Å; L751-H754 WeakPolarHBondContact O-CB 3.42Å; L751-H754 PolarHBondContact O-N 2.7Å; L751-K755 HydrophobicContact CD1-CD 4.47Å; L751-K755 HydrophobicContact CD1-CG 4.04Å; L751-K755 HydrophobicContact CG-CD 4.43Å; L751-K755 HydrophobicContact CG-CG 4.39Å; L751-K755 PolarHBondContact O-N 2.89Å
752	S	82.9	Confident	78.4	Confident	53 Å²	53	74.7 Å²	74.7	37%	0.371	40%	0.399	S	S	.	.	H	α-helix	trans	-63.2	-34.5	179.9	-68.8	0	0	0	0	112.8	S748 H754	S748-S752 PolarHBondContact O-N 2.91Å; S748-S752 PolarHBondContact O-OG 3.17Å; S752-H754 VanDerWaalsContact C-N 3.32Å
753	R	80.6	Confident	77.1	Confident	151 Å²	151	77.1 Å²	77.1	57%	0.57	41%	0.408	S	S	*	.	H	α-helix	trans	-67.5	-31.2	169.6	177.5	167.9	59	164.3	-2.8	112.5	S749 N750 L751	S749-R753 WeakPolarHBondContact O-CB 3.42Å; S749-R753 PolarHBondContact O-N 3.42Å; S749-R753 VanDerWaalsContact O-N 3.13Å; N750-R753 PolarHBondContact O-N 3.28Å; N750-R753 PolarHBondContact OD1-NH2 3.01Å; L751-R753 VanDerWaalsContact C-N 3.3Å; L751-R753 PolarHBondContact O-N 3.32Å
754	H	82.5	Confident	75.9	Confident	18 Å²	18	81 Å²	81	8%	0.083	43%	0.428	C	S	.	.	H	α-helix	trans	-79	-35.8	175.2	175.1	43.4	0	0	0	113.4	C738 C741 Y745 N750 L751 S752 Q756 T757 H758	C738-H754 PolarHBondContact SG-CD2 3.31Å; C741-H754 PolarHBondContact SG-NE2 3.37Å; Y745-H754 HydrophobicContact CE1-CB 4.24Å; Y745-H754 HydrophobicContact CE2-CB 3.87Å; Y745-H754 AromaticContact CE2-CD2 3.19Å; Y745-H754 WeakPolarHBondContact CE2-CD2 3.45Å; Y745-H754 AromaticContact CE2-CG 3.69Å; Y745-H754 AromaticContact CZ-CD2 3.48Å; Y745-H754 VanDerWaalsContact CZ-CD2 3.48Å; Y745-H754 AromaticContact CZ-CG 3.55Å; Y745-H754 PolarHBondContact OH-CD2 3.1Å; N750-H754 PolarHBondContact O-N 3.02Å; L751-H754 CarbonylContact O-C 3.57Å; L751-H754 WeakPolarHBondContact O-CA 3.13Å; L751-H754 WeakPolarHBondContact O-CB 3.42Å; L751-H754 PolarHBondContact O-N 2.7Å; S752-H754 VanDerWaalsContact C-N 3.32Å; H754-Q756 PolarHBondContact O-N 3.14Å; H754-Q756 VanDerWaalsContact O-N 3.09Å; H754-T757 PolarHBondContact CE1-OG1 2.83Å; H754-T757 PolarHBondContact ND1-OG1 3.39Å; H754-T757 PolarHBondContact O-N 3.27Å; H754-T757 PolarHBondContact O-OG1 3.05Å; H754-H758 AromaticContact CD2-NE2 3.82Å; H754-H758 AromaticContact CE1-CD2 3.98Å; H754-H758 AromaticContact CE1-CE1 3.45Å; H754-H758 PolarHBondContact CE1-CE1 2.94Å; H754-H758 VanDerWaalsContact CE1-CE1 3.45Å; H754-H758 AromaticContact CE1-NE2 3.13Å; H754-H758 PolarHBondContact CE1-NE2 3.39Å; H754-H758 AromaticContact NE2-CD2 3.93Å; H754-H758 AromaticContact NE2-CE1 3.66Å; H754-H758 AromaticContact NE2-NE2 2.98Å; H754-H758 PolarHBondContact NE2-NE2 3.43Å
755	K	80.5	Confident	74.5	Confident	89 Å²	89	80.2 Å²	80.2	39%	0.387	43%	0.43	S	S	.	.	H	α-helix	trans	-57	-26.4	172.3	-73.2	-174.1	172.2	-171.7	0	112.4	L751 T757 H758	L751-K755 HydrophobicContact CD1-CD 4.47Å; L751-K755 HydrophobicContact CD1-CG 4.04Å; L751-K755 HydrophobicContact CG-CD 4.43Å; L751-K755 HydrophobicContact CG-CG 4.39Å; L751-K755 PolarHBondContact O-N 2.89Å; K755-T757 PolarHBondContact O-N 3.23Å; K755-H758 PolarHBondContact O-N 2.82Å
756	Q	77	Confident	73.5	Confident	74 Å²	74	78 Å²	78	35%	0.346	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.6	170.6	-63.8	172.7	21.7	0	0	114.2	H754 V777	H754-Q756 PolarHBondContact O-N 3.14Å; H754-Q756 VanDerWaalsContact O-N 3.09Å; Q756-V777 WeakPolarHBondContact O-CB 3.41Å; Q756-V777 WeakPolarHBondContact O-CG1 3.4Å
757	T	73.5	Confident	73.1	Confident	91 Å²	91	81.8 Å²	81.8	56%	0.558	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-9.8	175.7	69.3	0	0	0	0	113.6	H754 K755	H754-T757 PolarHBondContact CE1-OG1 2.83Å; H754-T757 PolarHBondContact ND1-OG1 3.39Å; H754-T757 PolarHBondContact O-N 3.27Å; H754-T757 PolarHBondContact O-OG1 3.05Å; K755-T757 PolarHBondContact O-N 3.23Å
758	H	76.2	Confident	72.8	Confident	68 Å²	68	85.9 Å²	85.9	32%	0.315	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-10.1	177	-62.4	-48.2	0	0	0	113.6	C738 D740 C741 H754 K755 S760	C738-H758 PolarHBondContact SG-CD2 3.49Å; C738-H758 PolarHBondContact SG-NE2 2.64Å; C738-H758 VanDerWaalsContact SG-NE2 3.39Å; D740-H758 HydrophobicContact CB-CB 4.18Å; D740-H758 IonicContact OD2-CD2 3.28Å; D740-H758 PolarHBondContact OD2-CD2 2.81Å; D740-H758 VanDerWaalsContact OD2-CD2 3.26Å; D740-H758 IonicContact OD2-NE2 2.83Å; C741-H758 PolarHBondContact SG-CE1 3.32Å; C741-H758 PolarHBondContact SG-NE2 3.18Å; H754-H758 AromaticContact CD2-NE2 3.82Å; H754-H758 AromaticContact CE1-CD2 3.98Å; H754-H758 AromaticContact CE1-CE1 3.45Å; H754-H758 PolarHBondContact CE1-CE1 2.94Å; H754-H758 VanDerWaalsContact CE1-CE1 3.45Å; H754-H758 AromaticContact CE1-NE2 3.13Å; H754-H758 PolarHBondContact CE1-NE2 3.39Å; H754-H758 AromaticContact NE2-CD2 3.93Å; H754-H758 AromaticContact NE2-CE1 3.66Å; H754-H758 AromaticContact NE2-NE2 2.98Å; H754-H758 PolarHBondContact NE2-NE2 3.43Å; K755-H758 PolarHBondContact O-N 2.82Å; H758-S760 PolarHBondContact O-N 3.27Å
759	R	67.2	Low	72.7	Confident	177 Å²	177	84.4 Å²	84.4	67%	0.668	43%	0.428	S	S	*	.	S	Bend	trans	-66.8	119.2	170.8	-68.3	-177.6	175.5	-164.6	-6.1	108.4	V777	R759-V777 HydrophobicContact CB-CG1 3.92Å
760	S	57.3	Low	72.4	Confident	80 Å²	80	86.3 Å²	86.3	56%	0.559	44%	0.438	S	S	*	.			trans	-44.2	143	166.2	-59.8	0	0	0	0	110.2	H758 D762	H758-S760 PolarHBondContact O-N 3.27Å; S760-D762 VanDerWaalsContact CB-OD1 3.22Å; S760-D762 WeakPolarHBondContact CB-OD1 3.38Å; S760-D762 PolarHBondContact O-N 3.47Å
761	L	59.1	Low	72.1	Confident	93 Å²	93	91.4 Å²	91.4	49%	0.487	46%	0.461	S	S	.	.			trans	-79.6	49.6	-174.8	-163	74.5	0	0	0	111.4	S763 A766 A775 V777	L761-S763 PolarHBondContact O-N 3Å; L761-A766 HydrophobicContact CD1-CB 3.59Å; L761-A766 HydrophobicContact CG-CB 3.81Å; L761-A775 HydrophobicContact CD2-CB 4.33Å; L761-V777 HydrophobicContact CD1-CB 4.49Å; L761-V777 HydrophobicContact CD1-CG2 3.78Å
762	D	56.1	Low	71.8	Confident	105 Å²	105	93.3 Å²	93.3	56%	0.561	48%	0.476	S	S	*	.			trans	-60	125.3	-177	-55.6	-21.3	0	0	0	108.8	S760 Q764 S765 A766	S760-D762 VanDerWaalsContact CB-OD1 3.22Å; S760-D762 WeakPolarHBondContact CB-OD1 3.38Å; S760-D762 PolarHBondContact O-N 3.47Å; D762-Q764 PolarHBondContact O-N 3.15Å; D762-S765 PolarHBondContact O-N 3.04Å; D762-S765 PolarHBondContact O-OG 3.14Å; D762-A766 PolarHBondContact O-N 3.38Å
763	S	55.8	Low	71.7	Confident	97 Å²	97	93.1 Å²	93.1	68%	0.678	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-21.9	-163.7	-58	0	0	0	0	115.7	L761	L761-S763 PolarHBondContact O-N 3Å
764	Q	57.9	Low	71.7	Confident	202 Å²	202	91.9 Å²	91.9	94%	0.944	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-27.7	-178.2	-59.9	175.1	-0.2	0	0	113.2	D762	D762-Q764 PolarHBondContact O-N 3.15Å
765	S	57.7	Low	71.6	Confident	66 Å²	66	92.6 Å²	92.6	46%	0.462	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-22.9	-179.1	76.8	0	0	0	0	113.5	D762	D762-S765 PolarHBondContact O-N 3.04Å; D762-S765 PolarHBondContact O-OG 3.14Å
766	A	66.9	Low	71.6	Confident	11 Å²	11	90.9 Å²	90.9	9%	0.091	48%	0.482	C	S	.	.	S	Bend	trans	-78.1	123.6	-172.8	0	0	0	0	0	112.5	L761 D762 K768 A775	L761-A766 HydrophobicContact CD1-CB 3.59Å; L761-A766 HydrophobicContact CG-CB 3.81Å; D762-A766 PolarHBondContact O-N 3.38Å; A766-K768 PolarHBondContact O-N 3.33Å; A766-A775 HydrophobicContact CB-CB 3.8Å
767	R	74.2	Confident	71.5	Confident	137 Å²	137	89.7 Å²	89.7	52%	0.517	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	107.4	-176.3	-58	-168	-179.9	-136.4	-3.8	110.6	Y776 M779 L782	R767-Y776 PolarHBondContact N-O 2.95Å; R767-Y776 PolarHBondContact O-N 3.37Å; R767-M779 WeakPolarHBondContact CD-SD 3.33Å; R767-M779 VanDerWaalsContact NH1-CG 3.27Å; R767-M779 PolarHBondContact NH1-SD 3.03Å; R767-M779 VanDerWaalsContact NH1-SD 3.39Å; R767-L782 HydrophobicContact CB-CD2 3.8Å
768	K	79.7	Confident	71.6	Confident	136 Å²	136	86.4 Å²	86.4	59%	0.591	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	146	-178	-63.4	177	-176.1	176.6	0	112	A766 K774 A775	A766-K768 PolarHBondContact O-N 3.33Å; K768-K774 CarbonylContact C-O 3.6Å; K768-A775 HydrophobicContact CG-CB 4Å
769	C	85.5	Confident	71.8	Confident	3 Å²	3	87.4 Å²	87.4	2%	0.02	47%	0.466	C	S	.	.			trans	-79.7	124.1	172.2	-178.9	0	0	0	0	110.9	Q771 C772 G773 K774 L782 H785 H789	C769-Q771 PolarHBondContact O-N 2.82Å; C769-Q771 VanDerWaalsContact O-N 3.17Å; C769-Q771 PolarHBondContact SG-N 3.27Å; C769-Q771 VanDerWaalsContact SG-N 3.45Å; C769-C772 PolarHBondContact O-N 3.06Å; C769-G773 WeakPolarHBondContact O-CA 3.42Å; C769-G773 PolarHBondContact O-N 3.41Å; C769-K774 WeakPolarHBondContact CB-O 3.47Å; C769-K774 PolarHBondContact N-O 2.8Å; C769-L782 HydrophobicContact CB-CD1 3.9Å; C769-H785 VanDerWaalsContact SG-CD2 3.52Å; C769-H785 PolarHBondContact SG-NE2 3.41Å; C769-H789 PolarHBondContact SG-NE2 2.61Å; C769-H789 VanDerWaalsContact SG-NE2 3.45Å
770	P	79	Confident	72.3	Confident	121 Å²	121	82.9 Å²	82.9	79%	0.786	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.1	177.8	25.2	-35.3	0	0	0	113.8	L786	P770-L786 HydrophobicContact CG-CD2 4.26Å
771	Q	77.3	Confident	73.2	Confident	132 Å²	132	80.9 Å²	80.9	62%	0.617	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-12.9	-174.7	-171.1	165.6	-1.9	0	0	114.5	C769 H789	C769-Q771 PolarHBondContact O-N 2.82Å; C769-Q771 VanDerWaalsContact O-N 3.17Å; C769-Q771 PolarHBondContact SG-N 3.27Å; C769-Q771 VanDerWaalsContact SG-N 3.45Å; Q771-H789 VanDerWaalsContact CD-CG 3.46Å; Q771-H789 HydrophobicContact CG-CB 4.49Å
772	C	82	Confident	74.4	Confident	56 Å²	56	77.1 Å²	77.1	38%	0.378	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.7	16.9	175.5	76.1	0	0	0	0	116	C769 K774 H785	C769-C772 PolarHBondContact O-N 3.06Å; C772-K774 PolarHBondContact O-N 3.05Å; C772-H785 VanDerWaalsContact SG-CE1 3.56Å; C772-H785 PolarHBondContact SG-NE2 3.38Å
773	G	80.1	Confident	75.6	Confident	49 Å²	49	75 Å²	75	51%	0.505	42%	0.422	S	S	.	.			trans	72.4	-26.1	175.1	0	0	0	0	0	116.4	C769 A775	C769-G773 WeakPolarHBondContact O-CA 3.42Å; C769-G773 PolarHBondContact O-N 3.41Å; G773-A775 PolarHBondContact O-N 3.13Å
774	K	81.2	Confident	76.5	Confident	124 Å²	124	73.7 Å²	73.7	54%	0.539	41%	0.405	S	S	.	.			trans	-48.4	127.3	-176.7	-68.6	-178.9	-174.6	178.5	0	112.2	K768 C769 C772 Y776	K768-K774 CarbonylContact C-O 3.6Å; C769-K774 WeakPolarHBondContact CB-O 3.47Å; C769-K774 PolarHBondContact N-O 2.8Å; C772-K774 PolarHBondContact O-N 3.05Å; K774-Y776 HydrophobicContact CB-CE2 3.68Å; K774-Y776 WeakPolarHBondContact O-CD2 3.23Å; K774-Y776 VanDerWaalsContact O-CE2 3.24Å; K774-Y776 WeakPolarHBondContact O-CE2 3.48Å
775	A	80.6	Confident	77.6	Confident	34 Å²	34	64.9 Å²	64.9	28%	0.281	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	142.6	-174.6	0	0	0	0	0	112	L761 A766 K768 G773	L761-A775 HydrophobicContact CD2-CB 4.33Å; A766-A775 HydrophobicContact CB-CB 3.8Å; K768-A775 HydrophobicContact CG-CB 4Å; G773-A775 PolarHBondContact O-N 3.13Å
776	Y	79.8	Confident	78.7	Confident	53 Å²	53	64.7 Å²	64.7	21%	0.208	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	135.1	-173.9	-65.5	-85.3	0	0	0	111.3	R767 K774 S778 A781 L782 H785	R767-Y776 PolarHBondContact N-O 2.95Å; R767-Y776 PolarHBondContact O-N 3.37Å; K774-Y776 HydrophobicContact CB-CE2 3.68Å; K774-Y776 WeakPolarHBondContact O-CD2 3.23Å; K774-Y776 VanDerWaalsContact O-CE2 3.24Å; K774-Y776 WeakPolarHBondContact O-CE2 3.48Å; Y776-S778 PolarHBondContact O-N 2.99Å; Y776-S778 VanDerWaalsContact O-N 3.14Å; Y776-A781 HydrophobicContact CD1-CB 3.92Å; Y776-A781 HydrophobicContact CG-CB 4.35Å; Y776-L782 HydrophobicContact CD2-CB 4.17Å; Y776-L782 HydrophobicContact CD2-CD1 3.9Å; Y776-L782 HydrophobicContact CE2-CD1 4.37Å; Y776-L782 HydrophobicContact CG-CB 4.28Å; Y776-H785 HydrophobicContact CD2-CB 4.49Å; Y776-H785 HydrophobicContact CE1-CB 4.01Å; Y776-H785 HydrophobicContact CE2-CB 3.76Å; Y776-H785 AromaticContact CE2-CD2 3.33Å; Y776-H785 WeakPolarHBondContact CE2-CD2 3.4Å; Y776-H785 AromaticContact CE2-CG 3.6Å; Y776-H785 VanDerWaalsContact CZ-CB 3.5Å; Y776-H785 AromaticContact CZ-CD2 3.67Å; Y776-H785 AromaticContact CZ-CG 3.45Å; Y776-H785 VanDerWaalsContact CZ-CG 3.45Å; Y776-H785 PolarHBondContact OH-CD2 2.82Å; Y776-H785 PolarHBondContact OH-ND1 3.43Å
777	V	75.6	Confident	79.2	Confident	48 Å²	48	66.9 Å²	66.9	29%	0.291	37%	0.367	S	S	.	.	S	Bend	trans	-66.1	-15.8	-177.6	-143.7	0	0	0	0	113.7	Q756 R759 L761	Q756-V777 WeakPolarHBondContact O-CB 3.41Å; Q756-V777 WeakPolarHBondContact O-CG1 3.4Å; R759-V777 HydrophobicContact CB-CG1 3.92Å; L761-V777 HydrophobicContact CD1-CB 4.49Å; L761-V777 HydrophobicContact CD1-CG2 3.78Å
778	S	74.9	Confident	79.2	Confident	23 Å²	23	63.6 Å²	63.6	16%	0.161	36%	0.363	C	S	.	.	S	Bend	trans	-147.6	152.4	-177.2	73.2	0	0	0	0	113.7	Y776 A781 L782	Y776-S778 PolarHBondContact O-N 2.99Å; Y776-S778 VanDerWaalsContact O-N 3.14Å; S778-A781 PolarHBondContact O-N 3.31Å; S778-A781 VanDerWaalsContact O-N 3.15Å; S778-L782 PolarHBondContact O-N 3.39Å
779	M	79.5	Confident	79.1	Confident	89 Å²	89	59.7 Å²	59.7	44%	0.438	35%	0.347	S	S	.	.	H	α-helix	trans	-58.7	-39.7	175.7	-82.6	-60.1	-66.5	0	0	114.1	R767 A781 L782 S783	R767-M779 WeakPolarHBondContact CD-SD 3.33Å; R767-M779 VanDerWaalsContact NH1-CG 3.27Å; R767-M779 PolarHBondContact NH1-SD 3.03Å; R767-M779 VanDerWaalsContact NH1-SD 3.39Å; M779-A781 VanDerWaalsContact C-N 3.27Å; M779-A781 PolarHBondContact O-N 2.8Å; M779-L782 PolarHBondContact O-N 3.3Å; M779-L782 HydrophobicContact SD-CD2 4.27Å; M779-S783 WeakPolarHBondContact O-CB 3.44Å; M779-S783 PolarHBondContact O-N 3.04Å
780	P	78.2	Confident	78.6	Confident	82 Å²	82	62.8 Å²	62.8	53%	0.532	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-35.1	174.1	-27.1	36.9	0	0	0	113.2	M784	P780-M784 WeakPolarHBondContact O-CB 3.45Å; P780-M784 WeakPolarHBondContact O-CG 3.44Å; P780-M784 PolarHBondContact O-N 2.85Å
781	A	77	Confident	78.5	Confident	38 Å²	38	60.8 Å²	60.8	31%	0.314	35%	0.345	S	S	.	.	H	α-helix	trans	-71.9	-45.6	176.2	0	0	0	0	0	111.9	Y776 S778 M779 M784 H785	Y776-A781 HydrophobicContact CD1-CB 3.92Å; Y776-A781 HydrophobicContact CG-CB 4.35Å; S778-A781 PolarHBondContact O-N 3.31Å; S778-A781 VanDerWaalsContact O-N 3.15Å; M779-A781 VanDerWaalsContact C-N 3.27Å; M779-A781 PolarHBondContact O-N 2.8Å; A781-M784 PolarHBondContact O-N 2.87Å; A781-H785 PolarHBondContact O-N 2.84Å
782	L	84.6	Confident	78.4	Confident	14 Å²	14	61.4 Å²	61.4	7%	0.073	35%	0.346	C	S	.	.	H	α-helix	trans	-62.2	-45.4	174.2	174.3	57.3	0	0	0	111.9	R767 C769 Y776 S778 M779 M784 H785 L786	R767-L782 HydrophobicContact CB-CD2 3.8Å; C769-L782 HydrophobicContact CB-CD1 3.9Å; Y776-L782 HydrophobicContact CD2-CB 4.17Å; Y776-L782 HydrophobicContact CD2-CD1 3.9Å; Y776-L782 HydrophobicContact CE2-CD1 4.37Å; Y776-L782 HydrophobicContact CG-CB 4.28Å; S778-L782 PolarHBondContact O-N 3.39Å; M779-L782 PolarHBondContact O-N 3.3Å; M779-L782 HydrophobicContact SD-CD2 4.27Å; L782-M784 VanDerWaalsContact C-N 3.31Å; L782-M784 PolarHBondContact O-N 3.24Å; L782-H785 CarbonylContact O-C 3.54Å; L782-H785 WeakPolarHBondContact O-CA 3.48Å; L782-H785 PolarHBondContact O-N 3.37Å; L782-L786 HydrophobicContact CD1-CD1 4.37Å; L782-L786 HydrophobicContact CD1-CG 4.15Å; L782-L786 HydrophobicContact CG-CD1 4.2Å; L782-L786 HydrophobicContact CG-CG 4.46Å; L782-L786 WeakPolarHBondContact O-CG 3.22Å; L782-L786 PolarHBondContact O-N 3.5Å
783	S	79.8	Confident	78.3	Confident	61 Å²	61	61.9 Å²	61.9	43%	0.427	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-42	176.5	-179	0	0	0	0	111.5	M779 H785 L786 L787	M779-S783 WeakPolarHBondContact O-CB 3.44Å; M779-S783 PolarHBondContact O-N 3.04Å; S783-H785 VanDerWaalsContact C-N 3.29Å; S783-H785 PolarHBondContact O-N 2.89Å; S783-L786 PolarHBondContact O-N 3.3Å; S783-L787 PolarHBondContact O-N 3.09Å
784	M	75.7	Confident	78.4	Confident	68 Å²	68	65.6 Å²	65.6	34%	0.335	35%	0.347	S	S	.	.	H	α-helix	trans	-67.9	-27.9	174.1	-83	-58.2	-20.3	0	0	114	P780 A781 L782 L787 R804	P780-M784 WeakPolarHBondContact O-CB 3.45Å; P780-M784 WeakPolarHBondContact O-CG 3.44Å; P780-M784 PolarHBondContact O-N 2.85Å; A781-M784 PolarHBondContact O-N 2.87Å; L782-M784 VanDerWaalsContact C-N 3.31Å; L782-M784 PolarHBondContact O-N 3.24Å; M784-L787 HydrophobicContact CE-CB 4.17Å; M784-L787 HydrophobicContact CE-CD1 3.59Å; M784-L787 HydrophobicContact SD-CD1 3.84Å; M784-R804 VanDerWaalsContact CE-CZ 3.45Å; M784-R804 VanDerWaalsContact CE-NE 3.26Å; M784-R804 PolarHBondContact SD-NH2 3.25Å
785	H	80.8	Confident	78.6	Confident	17 Å²	17	59.9 Å²	59.9	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-76.5	-36.2	171.7	170.2	51.8	0	0	0	112.5	C769 C772 Y776 A781 L782 S783 L787 T788 H789	C769-H785 VanDerWaalsContact SG-CD2 3.52Å; C769-H785 PolarHBondContact SG-NE2 3.41Å; C772-H785 VanDerWaalsContact SG-CE1 3.56Å; C772-H785 PolarHBondContact SG-NE2 3.38Å; Y776-H785 HydrophobicContact CD2-CB 4.49Å; Y776-H785 HydrophobicContact CE1-CB 4.01Å; Y776-H785 HydrophobicContact CE2-CB 3.76Å; Y776-H785 AromaticContact CE2-CD2 3.33Å; Y776-H785 WeakPolarHBondContact CE2-CD2 3.4Å; Y776-H785 AromaticContact CE2-CG 3.6Å; Y776-H785 VanDerWaalsContact CZ-CB 3.5Å; Y776-H785 AromaticContact CZ-CD2 3.67Å; Y776-H785 AromaticContact CZ-CG 3.45Å; Y776-H785 VanDerWaalsContact CZ-CG 3.45Å; Y776-H785 PolarHBondContact OH-CD2 2.82Å; Y776-H785 PolarHBondContact OH-ND1 3.43Å; A781-H785 PolarHBondContact O-N 2.84Å; L782-H785 CarbonylContact O-C 3.54Å; L782-H785 WeakPolarHBondContact O-CA 3.48Å; L782-H785 PolarHBondContact O-N 3.37Å; S783-H785 VanDerWaalsContact C-N 3.29Å; S783-H785 PolarHBondContact O-N 2.89Å; H785-L787 PolarHBondContact O-N 3.35Å; H785-T788 PolarHBondContact CE1-OG1 3.3Å; H785-T788 PolarHBondContact ND1-OG1 3.48Å; H785-T788 WeakPolarHBondContact O-CA 3.31Å; H785-T788 WeakPolarHBondContact O-CB 3.31Å; H785-T788 PolarHBondContact O-N 3.37Å; H785-T788 PolarHBondContact O-OG1 3.26Å; H785-H789 AromaticContact CE1-CE1 3.77Å; H785-H789 AromaticContact CE1-NE2 3.18Å; H785-H789 PolarHBondContact CE1-NE2 2.98Å; H785-H789 AromaticContact NE2-CD2 3.91Å; H785-H789 AromaticContact NE2-CE1 3.9Å; H785-H789 AromaticContact NE2-NE2 3.02Å; H785-H789 PolarHBondContact NE2-NE2 3.07Å
786	L	79.8	Confident	78.9	Confident	62 Å²	62	63 Å²	63	33%	0.325	33%	0.334	S	S	.	.	H	α-helix	trans	-58.7	-36.6	176.4	-74.6	169.2	0	0	0	112	P770 L782 S783 T788 H789 D790	P770-L786 HydrophobicContact CG-CD2 4.26Å; L782-L786 HydrophobicContact CD1-CD1 4.37Å; L782-L786 HydrophobicContact CD1-CG 4.15Å; L782-L786 HydrophobicContact CG-CD1 4.2Å; L782-L786 HydrophobicContact CG-CG 4.46Å; L782-L786 WeakPolarHBondContact O-CG 3.22Å; L782-L786 PolarHBondContact O-N 3.5Å; S783-L786 PolarHBondContact O-N 3.3Å; L786-T788 PolarHBondContact O-N 2.89Å; L786-T788 VanDerWaalsContact O-N 3.13Å; L786-H789 PolarHBondContact O-N 3.37Å; L786-D790 PolarHBondContact O-N 3.31Å
787	L	77.2	Confident	79.1	Confident	57 Å²	57	64.9 Å²	64.9	30%	0.298	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.5	170.4	-76.2	164.1	0	0	0	114.2	S783 M784 H785 H789 D790 S803	S783-L787 PolarHBondContact O-N 3.09Å; M784-L787 HydrophobicContact CE-CB 4.17Å; M784-L787 HydrophobicContact CE-CD1 3.59Å; M784-L787 HydrophobicContact SD-CD1 3.84Å; H785-L787 PolarHBondContact O-N 3.35Å; L787-H789 VanDerWaalsContact C-N 3.34Å; L787-D790 CarbonylContact O-C 3.48Å; L787-S803 WeakPolarHBondContact O-CA 3.45Å; L787-S803 WeakPolarHBondContact O-CB 3.46Å
788	T	75.8	Confident	79.5	Confident	68 Å²	68	64.9 Å²	64.9	42%	0.417	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.9	175.2	68	0	0	0	0	114	H785 L786 L791	H785-T788 PolarHBondContact CE1-OG1 3.3Å; H785-T788 PolarHBondContact ND1-OG1 3.48Å; H785-T788 WeakPolarHBondContact O-CA 3.31Å; H785-T788 WeakPolarHBondContact O-CB 3.31Å; H785-T788 PolarHBondContact O-N 3.37Å; H785-T788 PolarHBondContact O-OG1 3.26Å; L786-T788 PolarHBondContact O-N 2.89Å; L786-T788 VanDerWaalsContact O-N 3.13Å; T788-L791 WeakPolarHBondContact O-CD2 3.42Å
789	H	77.1	Confident	79.9	Confident	55 Å²	55	65.6 Å²	65.6	26%	0.255	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-38.6	166.5	-53.6	-69.2	0	0	0	111.1	C769 Q771 H785 L786 L787 L791	C769-H789 PolarHBondContact SG-NE2 2.61Å; C769-H789 VanDerWaalsContact SG-NE2 3.45Å; Q771-H789 VanDerWaalsContact CD-CG 3.46Å; Q771-H789 HydrophobicContact CG-CB 4.49Å; H785-H789 AromaticContact CE1-CE1 3.77Å; H785-H789 AromaticContact CE1-NE2 3.18Å; H785-H789 PolarHBondContact CE1-NE2 2.98Å; H785-H789 AromaticContact NE2-CD2 3.91Å; H785-H789 AromaticContact NE2-CE1 3.9Å; H785-H789 AromaticContact NE2-NE2 3.02Å; H785-H789 PolarHBondContact NE2-NE2 3.07Å; L786-H789 PolarHBondContact O-N 3.37Å; L787-H789 VanDerWaalsContact C-N 3.34Å; H789-L791 VanDerWaalsContact C-N 3.26Å; H789-L791 PolarHBondContact O-N 3.39Å
790	D	74.6	Confident	80	Confident	67 Å²	67	67.3 Å²	67.3	36%	0.358	36%	0.364	S	S	.	.			trans	-80.6	65	-179.7	-170.2	28.8	0	0	0	111.9	L786 L787 K792	L786-D790 PolarHBondContact O-N 3.31Å; L787-D790 CarbonylContact O-C 3.48Å; D790-K792 PolarHBondContact O-N 3.32Å; D790-K792 WeakPolarHBondContact OD1-CG 3.34Å; D790-K792 IonicContact OD1-NZ 3.75Å; D790-K792 PolarHBondContact OD1-NZ 3.02Å; D790-K792 IonicContact OD2-NZ 2.65Å; D790-K792 PolarHBondContact OD2-NZ 3.08Å
791	L	76.6	Confident	80.2	Confident	79 Å²	79	65.4 Å²	65.4	41%	0.414	36%	0.355	S	S	.	.			trans	-73.9	59.3	-174.8	-60.8	178.2	0	0	0	113.2	T788 H789 H793 A801 F802	T788-L791 WeakPolarHBondContact O-CD2 3.42Å; H789-L791 VanDerWaalsContact C-N 3.26Å; H789-L791 PolarHBondContact O-N 3.39Å; L791-H793 VanDerWaalsContact C-N 3.28Å; L791-H793 PolarHBondContact O-N 3.36Å; L791-A801 HydrophobicContact CB-CB 3.73Å; L791-A801 HydrophobicContact CD1-CB 4.35Å; L791-A801 WeakPolarHBondContact O-CB 3.15Å; L791-F802 CarbonylContact C-O 3.55Å
792	K	76.4	Confident	80.5	Confident	145 Å²	145	65.7 Å²	65.7	63%	0.63	35%	0.35	S	S	*	.			trans	-64.3	-19	-173.5	-76.8	179.6	156.6	77.8	0	116.3	D790	D790-K792 PolarHBondContact O-N 3.32Å; D790-K792 WeakPolarHBondContact OD1-CG 3.34Å; D790-K792 IonicContact OD1-NZ 3.75Å; D790-K792 PolarHBondContact OD1-NZ 3.02Å; D790-K792 IonicContact OD2-NZ 2.65Å; D790-K792 PolarHBondContact OD2-NZ 3.08Å
793	H	78.7	Confident	80.4	Confident	67 Å²	67	66 Å²	66	31%	0.31	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	87.9	-171.7	-61.1	-68.6	0	0	0	111.3	L791 F802 R804 P805 L808	L791-H793 VanDerWaalsContact C-N 3.28Å; L791-H793 PolarHBondContact O-N 3.36Å; H793-F802 HydrophobicContact CB-CB 4.39Å; H793-F802 WeakPolarHBondContact CB-O 3.43Å; H793-F802 PolarHBondContact N-O 3.27Å; H793-F802 WeakPolarHBondContact O-CD2 3.47Å; H793-F802 PolarHBondContact O-N 2.84Å; H793-R804 VanDerWaalsContact CD2-C 3.5Å; H793-P805 WeakPolarHBondContact NE2-CD 3.24Å; H793-L808 HydrophobicContact CB-CB 4.09Å; H793-L808 HydrophobicContact CB-CD2 3.91Å
794	Q	81.8	Confident	80.4	Confident	127 Å²	127	67.3 Å²	67.3	59%	0.593	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	144.7	178.3	-160.3	173	22.6	0	0	112.5	G799 K800 L808	Q794-G799 VanDerWaalsContact CG-O 3.31Å; Q794-G799 WeakPolarHBondContact CG-O 3.27Å; Q794-G799 PolarHBondContact NE2-O 2.86Å; Q794-K800 CarbonylContact C-O 3.37Å; Q794-K800 WeakPolarHBondContact CA-O 3.33Å; Q794-L808 WeakPolarHBondContact O-CD2 3.32Å
795	C	86.8	Confident	80.7	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.02	36%	0.357	C	S	.	.			trans	-81.9	121.6	170.6	-174.9	0	0	0	0	111.2	I797 G799 K800 L808	C795-I797 PolarHBondContact O-N 3.44Å; C795-I797 PolarHBondContact SG-N 2.61Å; C795-I797 VanDerWaalsContact SG-N 3.37Å; C795-G799 WeakPolarHBondContact O-CA 3.46Å; C795-G799 PolarHBondContact O-N 3.31Å; C795-K800 PolarHBondContact N-O 2.86Å; C795-L808 HydrophobicContact CB-CD1 3.6Å
796	D	85.3	Confident	80.7	Confident	101 Å²	101	73.6 Å²	73.6	54%	0.54	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.3	-44.8	163.3	46.2	-17.7	0	0	0	114.3	R812	D796-R812 IonicContact OD1-NE 3.26Å; D796-R812 PolarHBondContact OD1-NE 3.29Å; D796-R812 IonicContact OD2-CZ 2.7Å; D796-R812 VanDerWaalsContact OD2-CZ 3.28Å; D796-R812 IonicContact OD2-NE 3.99Å; D796-R812 PolarHBondContact OD2-NE 2.98Å; D796-R812 IonicContact OD2-NH2 2.66Å; D796-R812 PolarHBondContact OD2-NH2 3.26Å
797	I	84	Confident	80.8	Confident	92 Å²	92	73.3 Å²	73.3	47%	0.472	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-26.4	-168.7	-57.8	168.7	0	0	0	113.3	C795 H815	C795-I797 PolarHBondContact O-N 3.44Å; C795-I797 PolarHBondContact SG-N 2.61Å; C795-I797 VanDerWaalsContact SG-N 3.37Å; I797-H815 HydrophobicContact CB-CB 4.48Å; I797-H815 HydrophobicContact CD1-CB 3.58Å; I797-H815 HydrophobicContact CG2-CB 4.22Å; I797-H815 WeakPolarHBondContact CG2-ND1 3.43Å
798	C	85.3	Confident	81.2	Confident	48 Å²	48	71.8 Å²	71.8	32%	0.324	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.4	9.4	-175.7	75.1	0	0	0	0	116.4	K800 H811 H815	C798-K800 PolarHBondContact O-N 3.01Å; C798-H811 PolarHBondContact SG-NE2 3.19Å; C798-H815 PolarHBondContact SG-NE2 3.31Å
799	G	82.8	Confident	81.6	Confident	38 Å²	38	72.4 Å²	72.4	39%	0.392	37%	0.367	S	S	.	.			trans	68.2	2.1	176.2	0	0	0	0	0	115.8	Q794 C795	Q794-G799 VanDerWaalsContact CG-O 3.31Å; Q794-G799 WeakPolarHBondContact CG-O 3.27Å; Q794-G799 PolarHBondContact NE2-O 2.86Å; C795-G799 WeakPolarHBondContact O-CA 3.46Å; C795-G799 PolarHBondContact O-N 3.31Å
800	K	82.2	Confident	81.8	Confident	125 Å²	125	71.2 Å²	71.2	54%	0.543	37%	0.369	S	S	.	.			trans	-70.4	133.4	178.5	-71.4	177.3	-173.4	169.2	0	111.1	Q794 C795 C798 F802	Q794-K800 CarbonylContact C-O 3.37Å; Q794-K800 WeakPolarHBondContact CA-O 3.33Å; C795-K800 PolarHBondContact N-O 2.86Å; C798-K800 PolarHBondContact O-N 3.01Å; K800-F802 HydrophobicContact CB-CE2 3.74Å; K800-F802 HydrophobicContact CB-CZ 4.06Å; K800-F802 WeakPolarHBondContact O-CD2 3.5Å; K800-F802 WeakPolarHBondContact O-CE2 3.44Å
801	A	82.5	Confident	82.3	Confident	41 Å²	41	69.5 Å²	69.5	34%	0.339	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	138.2	-173.3	0	0	0	0	0	112.3	L791	L791-A801 HydrophobicContact CB-CB 3.73Å; L791-A801 HydrophobicContact CD1-CB 4.35Å; L791-A801 WeakPolarHBondContact O-CB 3.15Å
802	F	82.4	Confident	82.7	Confident	45 Å²	45	69.4 Å²	69.4	20%	0.197	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147.9	-173.1	-62.8	-91	0	0	0	112.5	L791 H793 K800 R804 L807 L808 H811	L791-F802 CarbonylContact C-O 3.55Å; H793-F802 HydrophobicContact CB-CB 4.39Å; H793-F802 WeakPolarHBondContact CB-O 3.43Å; H793-F802 PolarHBondContact N-O 3.27Å; H793-F802 WeakPolarHBondContact O-CD2 3.47Å; H793-F802 PolarHBondContact O-N 2.84Å; K800-F802 HydrophobicContact CB-CE2 3.74Å; K800-F802 HydrophobicContact CB-CZ 4.06Å; K800-F802 WeakPolarHBondContact O-CD2 3.5Å; K800-F802 WeakPolarHBondContact O-CE2 3.44Å; F802-R804 VanDerWaalsContact C-N 3.29Å; F802-R804 PolarHBondContact O-N 2.81Å; F802-L807 HydrophobicContact CB-CB 4.2Å; F802-L807 HydrophobicContact CD1-CB 4Å; F802-L807 HydrophobicContact CG-CB 4.4Å; F802-L808 HydrophobicContact CB-CB 4.32Å; F802-L808 HydrophobicContact CD2-CB 4.17Å; F802-L808 HydrophobicContact CD2-CD1 4.07Å; F802-L808 HydrophobicContact CE2-CD1 4.35Å; F802-L808 HydrophobicContact CG-CB 4.4Å; F802-H811 HydrophobicContact CE1-CB 4.06Å; F802-H811 HydrophobicContact CE2-CB 4.07Å; F802-H811 AromaticContact CE2-CD2 3.15Å; F802-H811 WeakPolarHBondContact CE2-CD2 3.48Å; F802-H811 AromaticContact CE2-CG 3.72Å; F802-H811 AromaticContact CE2-NE2 3.87Å; F802-H811 HydrophobicContact CZ-CB 3.62Å; F802-H811 AromaticContact CZ-CD2 3.27Å; F802-H811 WeakPolarHBondContact CZ-CD2 3.12Å; F802-H811 AromaticContact CZ-CG 3.35Å; F802-H811 AromaticContact CZ-NE2 3.94Å
803	S	83.1	Confident	83.1	Confident	20 Å²	20	64.6 Å²	64.6	14%	0.14	33%	0.331	C	S	.	.	S	Bend	trans	-74.8	-11.3	-178.9	55	0	0	0	0	115.1	L787 L807	L787-S803 WeakPolarHBondContact O-CA 3.45Å; L787-S803 WeakPolarHBondContact O-CB 3.46Å; S803-L807 WeakPolarHBondContact OG-CD1 3.16Å
804	R	80.2	Confident	83.3	Confident	89 Å²	89	65.2 Å²	65.2	34%	0.336	35%	0.348	S	S	.	.	S	Bend	trans	-150.8	146.6	-177.7	-66.8	-174.4	170.6	154.1	-11.4	110.8	M784 H793 F802 W806 L807 L808	M784-R804 VanDerWaalsContact CE-CZ 3.45Å; M784-R804 VanDerWaalsContact CE-NE 3.26Å; M784-R804 PolarHBondContact SD-NH2 3.25Å; H793-R804 VanDerWaalsContact CD2-C 3.5Å; F802-R804 VanDerWaalsContact C-N 3.29Å; F802-R804 PolarHBondContact O-N 2.81Å; R804-W806 VanDerWaalsContact C-N 3.3Å; R804-W806 PolarHBondContact O-N 3.45Å; R804-L807 HydrophobicContact CB-CD1 4.13Å; R804-L807 HydrophobicContact CB-CG 4.32Å; R804-L807 HydrophobicContact CG-CD1 4.49Å; R804-L807 PolarHBondContact O-N 2.82Å; R804-L808 PolarHBondContact O-N 3.11Å
805	P	81.2	Confident	83.4	Confident	78 Å²	78	62.8 Å²	62.8	51%	0.506	34%	0.336	S	S	.	.	H	α-helix	trans	-69.3	-26.9	-177.3	27.9	-33.9	0	0	0	112.8	H793 L808 Q809	H793-P805 WeakPolarHBondContact NE2-CD 3.24Å; P805-L808 PolarHBondContact O-N 3.02Å; P805-Q809 PolarHBondContact O-N 3.44Å
806	W	80.6	Confident	83.1	Confident	138 Å²	138	66.1 Å²	66.1	52%	0.523	36%	0.356	S	S	.	.	H	α-helix	trans	-73.8	-27.8	175.8	74.1	-105.6	0	0	0	113.2	R804 Q809 G810	R804-W806 VanDerWaalsContact C-N 3.3Å; R804-W806 PolarHBondContact O-N 3.45Å; W806-Q809 PolarHBondContact O-N 3.45Å; W806-G810 PolarHBondContact O-N 3.26Å
807	L	82.1	Confident	83	Confident	57 Å²	57	63.6 Å²	63.6	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-69.1	-42.1	171.7	-73.5	169.7	0	0	0	110.1	F802 S803 R804 G810 H811	F802-L807 HydrophobicContact CB-CB 4.2Å; F802-L807 HydrophobicContact CD1-CB 4Å; F802-L807 HydrophobicContact CG-CB 4.4Å; S803-L807 WeakPolarHBondContact OG-CD1 3.16Å; R804-L807 HydrophobicContact CB-CD1 4.13Å; R804-L807 HydrophobicContact CB-CG 4.32Å; R804-L807 HydrophobicContact CG-CD1 4.49Å; R804-L807 PolarHBondContact O-N 2.82Å; L807-G810 PolarHBondContact O-N 3.28Å; L807-H811 WeakPolarHBondContact O-CB 3.46Å; L807-H811 PolarHBondContact O-N 2.97Å
808	L	86.1	Confident	82.7	Confident	24 Å²	24	63.3 Å²	63.3	13%	0.126	35%	0.351	C	S	.	.	H	α-helix	trans	-58.5	-48.5	170.4	171.8	60	0	0	0	111.4	H793 Q794 C795 F802 R804 P805 G810 H811 R812	H793-L808 HydrophobicContact CB-CB 4.09Å; H793-L808 HydrophobicContact CB-CD2 3.91Å; Q794-L808 WeakPolarHBondContact O-CD2 3.32Å; C795-L808 HydrophobicContact CB-CD1 3.6Å; F802-L808 HydrophobicContact CB-CB 4.32Å; F802-L808 HydrophobicContact CD2-CB 4.17Å; F802-L808 HydrophobicContact CD2-CD1 4.07Å; F802-L808 HydrophobicContact CE2-CD1 4.35Å; F802-L808 HydrophobicContact CG-CB 4.4Å; R804-L808 PolarHBondContact O-N 3.11Å; P805-L808 PolarHBondContact O-N 3.02Å; L808-G810 PolarHBondContact O-N 3.03Å; L808-H811 CarbonylContact O-C 3.53Å; L808-H811 WeakPolarHBondContact O-CA 3.36Å; L808-H811 WeakPolarHBondContact O-CB 3.49Å; L808-H811 PolarHBondContact O-N 3.39Å; L808-H811 VanDerWaalsContact O-N 3.1Å; L808-R812 HydrophobicContact CD1-CG 3.95Å; L808-R812 HydrophobicContact CG-CG 4.4Å; L808-R812 WeakPolarHBondContact O-CG 3.33Å; L808-R812 PolarHBondContact O-N 3.06Å
809	Q	83.1	Confident	82.7	Confident	82 Å²	82	67.3 Å²	67.3	38%	0.383	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-40.7	179.8	-172.4	62.8	11.8	0	0	112.5	P805 W806 H811 R812 R813	P805-Q809 PolarHBondContact O-N 3.44Å; W806-Q809 PolarHBondContact O-N 3.45Å; Q809-H811 VanDerWaalsContact C-N 3.27Å; Q809-H811 PolarHBondContact O-N 2.66Å; Q809-R812 PolarHBondContact O-N 3.42Å; Q809-R813 PolarHBondContact O-N 3.07Å
810	G	82	Confident	82.8	Confident	30 Å²	30	69 Å²	69	31%	0.309	37%	0.367	S	S	.	.	H	α-helix	trans	-63.2	-32.5	172.8	0	0	0	0	0	113.1	W806 L807 L808	W806-G810 PolarHBondContact O-N 3.26Å; L807-G810 PolarHBondContact O-N 3.28Å; L808-G810 PolarHBondContact O-N 3.03Å
811	H	85.2	Confident	82.9	Confident	31 Å²	31	65.9 Å²	65.9	14%	0.144	35%	0.352	C	S	.	.	H	α-helix	trans	-73.8	-38.9	172.9	167.4	51.4	0	0	0	113.2	C798 F802 L807 L808 Q809 R813 A814 H815	C798-H811 PolarHBondContact SG-NE2 3.19Å; F802-H811 HydrophobicContact CE1-CB 4.06Å; F802-H811 HydrophobicContact CE2-CB 4.07Å; F802-H811 AromaticContact CE2-CD2 3.15Å; F802-H811 WeakPolarHBondContact CE2-CD2 3.48Å; F802-H811 AromaticContact CE2-CG 3.72Å; F802-H811 AromaticContact CE2-NE2 3.87Å; F802-H811 HydrophobicContact CZ-CB 3.62Å; F802-H811 AromaticContact CZ-CD2 3.27Å; F802-H811 WeakPolarHBondContact CZ-CD2 3.12Å; F802-H811 AromaticContact CZ-CG 3.35Å; F802-H811 AromaticContact CZ-NE2 3.94Å; L807-H811 WeakPolarHBondContact O-CB 3.46Å; L807-H811 PolarHBondContact O-N 2.97Å; L808-H811 CarbonylContact O-C 3.53Å; L808-H811 WeakPolarHBondContact O-CA 3.36Å; L808-H811 WeakPolarHBondContact O-CB 3.49Å; L808-H811 PolarHBondContact O-N 3.39Å; L808-H811 VanDerWaalsContact O-N 3.1Å; Q809-H811 VanDerWaalsContact C-N 3.27Å; Q809-H811 PolarHBondContact O-N 2.66Å; H811-R813 PolarHBondContact O-N 2.83Å; H811-A814 WeakPolarHBondContact O-CA 3.33Å; H811-A814 VanDerWaalsContact O-CB 3.23Å; H811-A814 WeakPolarHBondContact O-CB 3.16Å; H811-A814 PolarHBondContact O-N 2.82Å; H811-H815 AromaticContact CE1-CD2 3.68Å; H811-H815 AromaticContact CE1-NE2 3.32Å; H811-H815 PolarHBondContact CE1-NE2 2.65Å; H811-H815 VanDerWaalsContact CE1-NE2 3.32Å; H811-H815 AromaticContact NE2-CD2 3.86Å; H811-H815 AromaticContact NE2-NE2 3.54Å
812	R	84	Confident	82.9	Confident	77 Å²	77	65.9 Å²	65.9	29%	0.291	36%	0.356	S	S	.	.	H	α-helix	trans	-59.7	-31.3	177.7	-72.4	177.9	83.4	-116.6	1.8	112.2	D796 L808 Q809 A814 H815 T816	D796-R812 IonicContact OD1-NE 3.26Å; D796-R812 PolarHBondContact OD1-NE 3.29Å; D796-R812 IonicContact OD2-CZ 2.7Å; D796-R812 VanDerWaalsContact OD2-CZ 3.28Å; D796-R812 IonicContact OD2-NE 3.99Å; D796-R812 PolarHBondContact OD2-NE 2.98Å; D796-R812 IonicContact OD2-NH2 2.66Å; D796-R812 PolarHBondContact OD2-NH2 3.26Å; L808-R812 HydrophobicContact CD1-CG 3.95Å; L808-R812 HydrophobicContact CG-CG 4.4Å; L808-R812 WeakPolarHBondContact O-CG 3.33Å; L808-R812 PolarHBondContact O-N 3.06Å; Q809-R812 PolarHBondContact O-N 3.42Å; R812-A814 PolarHBondContact O-N 3.2Å; R812-H815 WeakPolarHBondContact O-CA 2.89Å; R812-H815 WeakPolarHBondContact O-CB 3.34Å; R812-H815 PolarHBondContact O-N 3.3Å; R812-T816 PolarHBondContact O-N 3.29Å; R812-T816 PolarHBondContact O-OG1 2.86Å
813	R	85.8	Confident	83.1	Confident	43 Å²	43	64 Å²	64	16%	0.162	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-26.6	170.1	-64.7	-179.1	-180	151.2	-1.3	114.4	Q809 H811 H815 T816 G817 E818 Y821 A831	Q809-R813 PolarHBondContact O-N 3.07Å; H811-R813 PolarHBondContact O-N 2.83Å; R813-H815 PolarHBondContact O-N 2.88Å; R813-T816 WeakPolarHBondContact CA-OG1 3.42Å; R813-G817 WeakPolarHBondContact O-CA 3.45Å; R813-G817 PolarHBondContact O-N 2.94Å; R813-E818 HydrophobicContact CB-CB 4.08Å; R813-E818 HydrophobicContact CG-CB 3.89Å; R813-E818 PolarHBondContact O-N 2.89Å; R813-Y821 PolarHBondContact NH1-OH 2.88Å; R813-A831 HydrophobicContact CB-CB 4.07Å; R813-A831 WeakPolarHBondContact CD-O 3.45Å; R813-A831 PolarHBondContact NH1-O 3.44Å
814	A	82.7	Confident	83.1	Confident	80 Å²	80	67.1 Å²	67.1	66%	0.661	38%	0.376	S	S	*	.	H	α-helix	trans	-74.6	-14.8	173.4	0	0	0	0	0	113	H811 R812	H811-A814 WeakPolarHBondContact O-CA 3.33Å; H811-A814 VanDerWaalsContact O-CB 3.23Å; H811-A814 WeakPolarHBondContact O-CB 3.16Å; H811-A814 PolarHBondContact O-N 2.82Å; R812-A814 PolarHBondContact O-N 3.2Å
815	H	83.9	Confident	83.1	Confident	77 Å²	77	67.4 Å²	67.4	36%	0.356	38%	0.381	S	S	.	.	H	α-helix	trans	-94.5	-43	170.4	-72.1	-72.6	0	0	0	112.3	I797 C798 H811 R812 R813 G817	I797-H815 HydrophobicContact CB-CB 4.48Å; I797-H815 HydrophobicContact CD1-CB 3.58Å; I797-H815 HydrophobicContact CG2-CB 4.22Å; I797-H815 WeakPolarHBondContact CG2-ND1 3.43Å; C798-H815 PolarHBondContact SG-NE2 3.31Å; H811-H815 AromaticContact CE1-CD2 3.68Å; H811-H815 AromaticContact CE1-NE2 3.32Å; H811-H815 PolarHBondContact CE1-NE2 2.65Å; H811-H815 VanDerWaalsContact CE1-NE2 3.32Å; H811-H815 AromaticContact NE2-CD2 3.86Å; H811-H815 AromaticContact NE2-NE2 3.54Å; R812-H815 WeakPolarHBondContact O-CA 2.89Å; R812-H815 WeakPolarHBondContact O-CB 3.34Å; R812-H815 PolarHBondContact O-N 3.3Å; R813-H815 PolarHBondContact O-N 2.88Å; H815-G817 VanDerWaalsContact C-N 3.3Å; H815-G817 PolarHBondContact O-N 2.86Å
816	T	81.2	Confident	83.3	Confident	72 Å²	72	66.3 Å²	66.3	44%	0.442	37%	0.374	S	S	.	.	H	α-helix	trans	-77.7	-13.8	179.3	60.5	0	0	0	0	113.8	R812 R813 E818	R812-T816 PolarHBondContact O-N 3.29Å; R812-T816 PolarHBondContact O-OG1 2.86Å; R813-T816 WeakPolarHBondContact CA-OG1 3.42Å; T816-E818 VanDerWaalsContact CB-OE1 3.31Å; T816-E818 WeakPolarHBondContact CB-OE1 3.49Å; T816-E818 PolarHBondContact O-N 2.81Å; T816-E818 VanDerWaalsContact OG1-CG 3.31Å; T816-E818 WeakPolarHBondContact OG1-CG 3.31Å; T816-E818 PolarHBondContact OG1-OE1 3.41Å
817	G	81.9	Confident	83.4	Confident	48 Å²	48	62.2 Å²	62.2	50%	0.495	38%	0.375	S	S	.	.			trans	77.1	-0.2	-176.3	0	0	0	0	0	114.4	R813 H815 K819	R813-G817 WeakPolarHBondContact O-CA 3.45Å; R813-G817 PolarHBondContact O-N 2.94Å; H815-G817 VanDerWaalsContact C-N 3.3Å; H815-G817 PolarHBondContact O-N 2.86Å; G817-K819 PolarHBondContact O-N 2.75Å
818	E	79.6	Confident	83.5	Confident	87 Å²	87	67.4 Å²	67.4	41%	0.407	39%	0.391	S	S	.	.			trans	-52.3	126.2	179.9	-83.6	165.9	-118.7	0	0	112.9	R813 T816 A831	R813-E818 HydrophobicContact CB-CB 4.08Å; R813-E818 HydrophobicContact CG-CB 3.89Å; R813-E818 PolarHBondContact O-N 2.89Å; T816-E818 VanDerWaalsContact CB-OE1 3.31Å; T816-E818 WeakPolarHBondContact CB-OE1 3.49Å; T816-E818 PolarHBondContact O-N 2.81Å; T816-E818 VanDerWaalsContact OG1-CG 3.31Å; T816-E818 WeakPolarHBondContact OG1-CG 3.31Å; T816-E818 PolarHBondContact OG1-OE1 3.41Å; E818-A831 WeakPolarHBondContact O-CA 3.26Å; E818-A831 WeakPolarHBondContact O-CB 3.49Å
819	K	85.1	Confident	83.4	Confident	132 Å²	132	68.1 Å²	68.1	57%	0.574	40%	0.4	S	S	*	.			trans	-128.4	68.7	178.7	-73.3	160.6	177.8	171.2	0	110.8	G817 Y821 A829 F830	G817-K819 PolarHBondContact O-N 2.75Å; K819-Y821 PolarHBondContact O-N 3.11Å; K819-A829 HydrophobicContact CB-CB 3.62Å; K819-A829 HydrophobicContact CD-CB 4.44Å; K819-A829 WeakPolarHBondContact CD-O 3.42Å; K819-A829 WeakPolarHBondContact O-CB 3.44Å; K819-F830 CarbonylContact C-O 3.16Å; K819-F830 VanDerWaalsContact C-O 3.29Å; K819-F830 VanDerWaalsContact CA-O 3.31Å; K819-F830 WeakPolarHBondContact CA-O 3.39Å
820	P	83.7	Confident	83.4	Confident	72 Å²	72	65.9 Å²	65.9	47%	0.468	39%	0.389	S	S	.	.			trans	-69.7	-11.1	-174.1	28.4	-35.6	0	0	0	114.4
821	Y	84.9	Confident	83.4	Confident	61 Å²	61	65.9 Å²	65.9	24%	0.239	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	85.4	-177.5	-52.5	-64.8	0	0	0	111.1	R813 K819 A829 F830 R833	R813-Y821 PolarHBondContact NH1-OH 2.88Å; K819-Y821 PolarHBondContact O-N 3.11Å; Y821-A829 WeakPolarHBondContact O-CA 3.33Å; Y821-F830 WeakPolarHBondContact CD2-O 3.39Å; Y821-F830 PolarHBondContact N-O 3.3Å; Y821-F830 VanDerWaalsContact N-O 3.09Å; Y821-F830 PolarHBondContact O-N 3.17Å; Y821-R833 HydrophobicContact CD1-CB 4.33Å; Y821-R833 HydrophobicContact CD2-CB 4.34Å; Y821-R833 VanDerWaalsContact CD2-N 3.3Å; Y821-R833 HydrophobicContact CE1-CB 4.22Å; Y821-R833 HydrophobicContact CE2-CB 4.19Å; Y821-R833 HydrophobicContact CG-CB 4.39Å
822	G	82.2	Confident	83.2	Confident	41 Å²	41	66.9 Å²	66.9	42%	0.423	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	142.7	173	0	0	0	0	0	113.1
823	C	87.7	Confident	83.3	Confident	4 Å²	4	70.2 Å²	70.2	3%	0.027	41%	0.405	C	S	.	.			trans	-84.5	122	168.5	-179.2	0	0	0	0	111.2	H825 C826 G827 R828 L836 H843	C823-H825 PolarHBondContact O-N 3.25Å; C823-H825 PolarHBondContact SG-N 3.34Å; C823-C826 PolarHBondContact O-N 3.19Å; C823-G827 WeakPolarHBondContact O-CA 3.49Å; C823-G827 PolarHBondContact O-N 3.37Å; C823-R828 VanDerWaalsContact CB-O 3.28Å; C823-R828 WeakPolarHBondContact CB-O 3.34Å; C823-R828 PolarHBondContact N-O 3.08Å; C823-L836 HydrophobicContact CB-CD1 3.87Å; C823-H843 PolarHBondContact SG-CD2 2.73Å; C823-H843 PolarHBondContact SG-NE2 3.5Å
824	A	82.6	Confident	83	Confident	87 Å²	87	71.9 Å²	71.9	72%	0.719	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-20	179	0	0	0	0	0	114.5
825	H	80.4	Confident	83	Confident	95 Å²	95	72.4 Å²	72.4	44%	0.44	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-17.3	-177.6	-61.7	-47	0	0	0	114.7	C823 M840	C823-H825 PolarHBondContact O-N 3.25Å; C823-H825 PolarHBondContact SG-N 3.34Å; H825-M840 VanDerWaalsContact CD2-CE 3.44Å; H825-M840 WeakPolarHBondContact CD2-CE 3.4Å
826	C	84.6	Confident	83.1	Confident	54 Å²	54	70.2 Å²	70.2	37%	0.365	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.4	13.1	179.3	69.9	0	0	0	0	115.4	C823 R828 H839 H843	C823-C826 PolarHBondContact O-N 3.19Å; C826-R828 PolarHBondContact O-N 3.28Å; C826-H839 PolarHBondContact SG-NE2 3.1Å; C826-H843 WeakPolarHBondContact CB-CE1 3.39Å; C826-H843 PolarHBondContact SG-CE1 3.44Å; C826-H843 PolarHBondContact SG-NE2 3.02Å
827	G	83.2	Confident	83.2	Confident	53 Å²	53	70.8 Å²	70.8	55%	0.546	40%	0.399	S	S	.	.			trans	67.7	-10.5	-179.8	0	0	0	0	0	115.8	C823 A829	C823-G827 WeakPolarHBondContact O-CA 3.49Å; C823-G827 PolarHBondContact O-N 3.37Å; G827-A829 PolarHBondContact O-N 3.29Å
828	R	82.9	Confident	83.1	Confident	166 Å²	166	69.8 Å²	69.8	63%	0.626	39%	0.386	S	S	*	.			trans	-61.5	121.6	-175.8	-169.1	173.5	-173	160.8	6.5	110.9	C823 C826 F830	C823-R828 VanDerWaalsContact CB-O 3.28Å; C823-R828 WeakPolarHBondContact CB-O 3.34Å; C823-R828 PolarHBondContact N-O 3.08Å; C826-R828 PolarHBondContact O-N 3.28Å; R828-F830 HydrophobicContact CB-CE2 4.1Å; R828-F830 HydrophobicContact CB-CZ 4.46Å; R828-F830 HydrophobicContact CG-CE2 3.85Å; R828-F830 HydrophobicContact CG-CZ 3.83Å; R828-F830 WeakPolarHBondContact O-CD2 3.26Å; R828-F830 WeakPolarHBondContact O-CE2 3.43Å
829	A	85	Confident	83.4	Confident	38 Å²	38	66.7 Å²	66.7	31%	0.314	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	143.6	-172.4	0	0	0	0	0	113.2	K819 Y821 G827	K819-A829 HydrophobicContact CB-CB 3.62Å; K819-A829 HydrophobicContact CD-CB 4.44Å; K819-A829 WeakPolarHBondContact CD-O 3.42Å; K819-A829 WeakPolarHBondContact O-CB 3.44Å; Y821-A829 WeakPolarHBondContact O-CA 3.33Å; G827-A829 PolarHBondContact O-N 3.29Å
830	F	82.8	Confident	83.2	Confident	36 Å²	36	62.8 Å²	62.8	16%	0.158	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	146.7	-173.5	-61.7	-94.7	0	0	0	112.4	K819 Y821 R828 D832 N835 L836 H839	K819-F830 CarbonylContact C-O 3.16Å; K819-F830 VanDerWaalsContact C-O 3.29Å; K819-F830 VanDerWaalsContact CA-O 3.31Å; K819-F830 WeakPolarHBondContact CA-O 3.39Å; Y821-F830 WeakPolarHBondContact CD2-O 3.39Å; Y821-F830 PolarHBondContact N-O 3.3Å; Y821-F830 VanDerWaalsContact N-O 3.09Å; Y821-F830 PolarHBondContact O-N 3.17Å; R828-F830 HydrophobicContact CB-CE2 4.1Å; R828-F830 HydrophobicContact CB-CZ 4.46Å; R828-F830 HydrophobicContact CG-CE2 3.85Å; R828-F830 HydrophobicContact CG-CZ 3.83Å; R828-F830 WeakPolarHBondContact O-CD2 3.26Å; R828-F830 WeakPolarHBondContact O-CE2 3.43Å; F830-D832 VanDerWaalsContact C-N 3.34Å; F830-N835 HydrophobicContact CB-CB 4.3Å; F830-N835 HydrophobicContact CD1-CB 3.86Å; F830-N835 HydrophobicContact CG-CB 4.37Å; F830-L836 HydrophobicContact CB-CB 4.46Å; F830-L836 HydrophobicContact CD2-CB 4.28Å; F830-L836 HydrophobicContact CD2-CD1 4.08Å; F830-L836 HydrophobicContact CE2-CD1 4.34Å; F830-H839 HydrophobicContact CE1-CB 4.12Å; F830-H839 HydrophobicContact CE2-CB 3.93Å; F830-H839 AromaticContact CE2-CD2 3.24Å; F830-H839 WeakPolarHBondContact CE2-CD2 3.4Å; F830-H839 AromaticContact CE2-CG 3.72Å; F830-H839 HydrophobicContact CZ-CB 3.52Å; F830-H839 AromaticContact CZ-CD2 3.41Å; F830-H839 VanDerWaalsContact CZ-CD2 3.41Å; F830-H839 WeakPolarHBondContact CZ-CD2 3.37Å; F830-H839 AromaticContact CZ-CG 3.41Å; F830-H839 VanDerWaalsContact CZ-CG 3.41Å
831	A	83.1	Confident	82.9	Confident	29 Å²	29	62.2 Å²	62.2	24%	0.24	35%	0.347	C	S	.	.	S	Bend	trans	-75.1	-19.6	178.3	0	0	0	0	0	114	R813 E818	R813-A831 HydrophobicContact CB-CB 4.07Å; R813-A831 WeakPolarHBondContact CD-O 3.45Å; R813-A831 PolarHBondContact NH1-O 3.44Å; E818-A831 WeakPolarHBondContact O-CA 3.26Å; E818-A831 WeakPolarHBondContact O-CB 3.49Å
832	D	81	Confident	82.5	Confident	53 Å²	53	62 Å²	62	28%	0.283	35%	0.352	S	S	.	.	S	Bend	trans	-136.6	146	178.8	-177.9	44.3	0	0	0	112.8	F830 S834 N835 L836	F830-D832 VanDerWaalsContact C-N 3.34Å; D832-S834 VanDerWaalsContact C-N 3.3Å; D832-S834 PolarHBondContact O-N 2.88Å; D832-S834 WeakPolarHBondContact OD2-CB 3.38Å; D832-S834 PolarHBondContact OD2-N 2.96Å; D832-S834 VanDerWaalsContact OD2-N 3.11Å; D832-S834 PolarHBondContact OD2-OG 3.37Å; D832-N835 PolarHBondContact O-N 3.28Å; D832-L836 PolarHBondContact O-N 3.14Å
833	R	84.5	Confident	82.3	Confident	146 Å²	146	63.3 Å²	63.3	55%	0.551	35%	0.347	S	S	*	.	H	α-helix	trans	-67.1	-29.7	-178.1	-175.9	174.4	175.6	167.2	-1.2	112	Y821 N835 L836 R837	Y821-R833 HydrophobicContact CD1-CB 4.33Å; Y821-R833 HydrophobicContact CD2-CB 4.34Å; Y821-R833 VanDerWaalsContact CD2-N 3.3Å; Y821-R833 HydrophobicContact CE1-CB 4.22Å; Y821-R833 HydrophobicContact CE2-CB 4.19Å; Y821-R833 HydrophobicContact CG-CB 4.39Å; R833-N835 VanDerWaalsContact C-N 3.32Å; R833-L836 PolarHBondContact O-N 3.03Å; R833-R837 PolarHBondContact O-N 3.13Å
834	S	80	Confident	81.3	Confident	78 Å²	78	66.3 Å²	66.3	55%	0.545	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-40.4	174.8	-35.7	0	0	0	0	111.1	D832 R837 A838	D832-S834 VanDerWaalsContact C-N 3.3Å; D832-S834 PolarHBondContact O-N 2.88Å; D832-S834 WeakPolarHBondContact OD2-CB 3.38Å; D832-S834 PolarHBondContact OD2-N 2.96Å; D832-S834 VanDerWaalsContact OD2-N 3.11Å; D832-S834 PolarHBondContact OD2-OG 3.37Å; S834-R837 PolarHBondContact O-N 3.39Å; S834-A838 WeakPolarHBondContact O-CB 3.44Å; S834-A838 PolarHBondContact O-N 3.13Å
835	N	82.5	Confident	80.4	Confident	92 Å²	92	64.6 Å²	64.6	49%	0.492	36%	0.359	S	S	.	.	H	α-helix	trans	-70.6	-36.8	177.5	-67.9	-28	0	0	0	111.9	F830 D832 R833 H839	F830-N835 HydrophobicContact CB-CB 4.3Å; F830-N835 HydrophobicContact CD1-CB 3.86Å; F830-N835 HydrophobicContact CG-CB 4.37Å; D832-N835 PolarHBondContact O-N 3.28Å; R833-N835 VanDerWaalsContact C-N 3.32Å; N835-H839 WeakPolarHBondContact O-CB 3.44Å; N835-H839 PolarHBondContact O-N 3.13Å
836	L	86.9	Confident	79.5	Confident	30 Å²	30	65.1 Å²	65.1	16%	0.157	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-48.6	169.8	176.3	60.6	0	0	0	111.1	C823 F830 D832 R833 A838 H839 M840	C823-L836 HydrophobicContact CB-CD1 3.87Å; F830-L836 HydrophobicContact CB-CB 4.46Å; F830-L836 HydrophobicContact CD2-CB 4.28Å; F830-L836 HydrophobicContact CD2-CD1 4.08Å; F830-L836 HydrophobicContact CE2-CD1 4.34Å; D832-L836 PolarHBondContact O-N 3.14Å; R833-L836 PolarHBondContact O-N 3.03Å; L836-A838 VanDerWaalsContact C-N 3.33Å; L836-A838 PolarHBondContact O-N 3.02Å; L836-H839 CarbonylContact O-C 3.47Å; L836-H839 WeakPolarHBondContact O-CA 3.41Å; L836-H839 PolarHBondContact O-N 3.02Å; L836-M840 HydrophobicContact CD1-CG 4.07Å; L836-M840 HydrophobicContact CD1-SD 4.12Å; L836-M840 HydrophobicContact CG-CG 4.3Å; L836-M840 WeakPolarHBondContact O-CG 3.34Å; L836-M840 PolarHBondContact O-N 3.21Å
837	R	82.9	Confident	78.8	Confident	85 Å²	85	68.4 Å²	68.4	32%	0.321	37%	0.371	S	S	.	.	H	α-helix	trans	-57.4	-44.7	177.6	174.9	168.9	-81	175.1	-1.2	111.8	D690 N693 R833 S834 H839 M840 Q841	D690-R837 IonicContact OD1-CZ 2.73Å; D690-R837 VanDerWaalsContact OD1-CZ 3.25Å; D690-R837 IonicContact OD1-NH1 3.25Å; D690-R837 PolarHBondContact OD1-NH1 3.29Å; D690-R837 IonicContact OD1-NH2 3.41Å; D690-R837 PolarHBondContact OD1-NH2 3.04Å; N693-R837 PolarHBondContact OD1-NH2 3.41Å; R833-R837 PolarHBondContact O-N 3.13Å; S834-R837 PolarHBondContact O-N 3.39Å; R837-H839 VanDerWaalsContact C-N 3.3Å; R837-H839 PolarHBondContact O-N 2.79Å; R837-M840 PolarHBondContact O-N 3.47Å; R837-Q841 PolarHBondContact O-N 3.17Å
838	A	79.8	Confident	78.3	Confident	26 Å²	26	71.2 Å²	71.2	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-61.8	-36.8	175.3	0	0	0	0	0	112.6	S834 L836 L860	S834-A838 WeakPolarHBondContact O-CB 3.44Å; S834-A838 PolarHBondContact O-N 3.13Å; L836-A838 VanDerWaalsContact C-N 3.33Å; L836-A838 PolarHBondContact O-N 3.02Å; A838-L860 HydrophobicContact CB-CD1 4.01Å; A838-L860 HydrophobicContact CB-CD2 3.77Å
839	H	84.7	Confident	78.1	Confident	23 Å²	23	66 Å²	66	11%	0.106	35%	0.352	C	S	.	.	H	α-helix	trans	-72.9	-35.6	174.4	173	51.7	0	0	0	113.2	C826 F830 N835 L836 R837 Q841 T842 H843	C826-H839 PolarHBondContact SG-NE2 3.1Å; F830-H839 HydrophobicContact CE1-CB 4.12Å; F830-H839 HydrophobicContact CE2-CB 3.93Å; F830-H839 AromaticContact CE2-CD2 3.24Å; F830-H839 WeakPolarHBondContact CE2-CD2 3.4Å; F830-H839 AromaticContact CE2-CG 3.72Å; F830-H839 HydrophobicContact CZ-CB 3.52Å; F830-H839 AromaticContact CZ-CD2 3.41Å; F830-H839 VanDerWaalsContact CZ-CD2 3.41Å; F830-H839 WeakPolarHBondContact CZ-CD2 3.37Å; F830-H839 AromaticContact CZ-CG 3.41Å; F830-H839 VanDerWaalsContact CZ-CG 3.41Å; N835-H839 WeakPolarHBondContact O-CB 3.44Å; N835-H839 PolarHBondContact O-N 3.13Å; L836-H839 CarbonylContact O-C 3.47Å; L836-H839 WeakPolarHBondContact O-CA 3.41Å; L836-H839 PolarHBondContact O-N 3.02Å; R837-H839 VanDerWaalsContact C-N 3.3Å; R837-H839 PolarHBondContact O-N 2.79Å; H839-Q841 PolarHBondContact O-N 3.06Å; H839-T842 PolarHBondContact ND1-OG1 3.06Å; H839-T842 WeakPolarHBondContact O-CA 3.3Å; H839-T842 WeakPolarHBondContact O-CB 3.47Å; H839-T842 PolarHBondContact O-N 3.09Å; H839-T842 PolarHBondContact O-OG1 3.44Å; H839-H843 AromaticContact CD2-NE2 3.26Å; H839-H843 PolarHBondContact CD2-NE2 3.21Å; H839-H843 VanDerWaalsContact CD2-NE2 3.26Å; H839-H843 AromaticContact CE1-CD2 3.76Å; H839-H843 AromaticContact CE1-NE2 2.66Å; H839-H843 PolarHBondContact CE1-NE2 3.45Å; H839-H843 AromaticContact ND1-NE2 3.74Å; H839-H843 AromaticContact NE2-CD2 3.69Å; H839-H843 AromaticContact NE2-NE2 2.22Å; H839-H843 PolarHBondContact NE2-NE2 3.26Å
840	M	80.7	Confident	77.9	Confident	50 Å²	50	68.7 Å²	68.7	25%	0.246	36%	0.358	C	S	.	.	H	α-helix	trans	-60	-30.7	176	-67	-61.1	-68.6	0	0	112.3	H825 L836 R837 T842 H843 S844	H825-M840 VanDerWaalsContact CD2-CE 3.44Å; H825-M840 WeakPolarHBondContact CD2-CE 3.4Å; L836-M840 HydrophobicContact CD1-CG 4.07Å; L836-M840 HydrophobicContact CD1-SD 4.12Å; L836-M840 HydrophobicContact CG-CG 4.3Å; L836-M840 WeakPolarHBondContact O-CG 3.34Å; L836-M840 PolarHBondContact O-N 3.21Å; R837-M840 PolarHBondContact O-N 3.47Å; M840-T842 PolarHBondContact O-N 2.79Å; M840-H843 PolarHBondContact O-N 2.94Å; M840-S844 PolarHBondContact O-N 3.47Å
841	Q	77.7	Confident	78.1	Confident	60 Å²	60	67 Å²	67	28%	0.28	35%	0.351	S	S	.	.	H	α-helix	trans	-64.6	-21	171.6	-66.2	178.7	-42.8	0	0	113.5	R837 H839 S844	R837-Q841 PolarHBondContact O-N 3.17Å; H839-Q841 PolarHBondContact O-N 3.06Å; Q841-S844 PolarHBondContact O-OG 2.94Å
842	T	77.3	Confident	78	Confident	55 Å²	55	74.8 Å²	74.8	34%	0.337	38%	0.379	S	S	.	.	H	α-helix	trans	-78.1	-23	171.9	66.4	0	0	0	0	112.9	H839 M840 A859	H839-T842 PolarHBondContact ND1-OG1 3.06Å; H839-T842 WeakPolarHBondContact O-CA 3.3Å; H839-T842 WeakPolarHBondContact O-CB 3.47Å; H839-T842 PolarHBondContact O-N 3.09Å; H839-T842 PolarHBondContact O-OG1 3.44Å; M840-T842 PolarHBondContact O-N 2.79Å; T842-A859 HydrophobicContact CG2-CB 4.31Å
843	H	77.5	Confident	77.9	Confident	70 Å²	70	76.6 Å²	76.6	32%	0.324	39%	0.386	S	S	.	.	H	α-helix	trans	-84.6	-31.6	174.6	-72.2	-64.5	0	0	0	113.5	C823 C826 H839 M840 G845	C823-H843 PolarHBondContact SG-CD2 2.73Å; C823-H843 PolarHBondContact SG-NE2 3.5Å; C826-H843 WeakPolarHBondContact CB-CE1 3.39Å; C826-H843 PolarHBondContact SG-CE1 3.44Å; C826-H843 PolarHBondContact SG-NE2 3.02Å; H839-H843 AromaticContact CD2-NE2 3.26Å; H839-H843 PolarHBondContact CD2-NE2 3.21Å; H839-H843 VanDerWaalsContact CD2-NE2 3.26Å; H839-H843 AromaticContact CE1-CD2 3.76Å; H839-H843 AromaticContact CE1-NE2 2.66Å; H839-H843 PolarHBondContact CE1-NE2 3.45Å; H839-H843 AromaticContact ND1-NE2 3.74Å; H839-H843 AromaticContact NE2-CD2 3.69Å; H839-H843 AromaticContact NE2-NE2 2.22Å; H839-H843 PolarHBondContact NE2-NE2 3.26Å; M840-H843 PolarHBondContact O-N 2.94Å; H843-G845 PolarHBondContact O-N 3.31Å
844	S	66.1	Low	77.9	Confident	67 Å²	67	70.3 Å²	70.3	47%	0.469	36%	0.364	S	S	.	.	S	Bend	trans	-73	-5.5	178	65.8	0	0	0	0	114	M840 Q841 M846	M840-S844 PolarHBondContact O-N 3.47Å; Q841-S844 PolarHBondContact O-OG 2.94Å; S844-M846 PolarHBondContact O-N 3.24Å; S844-M846 WeakPolarHBondContact OG-CG 3.46Å
845	G	64.9	Low	78	Confident	50 Å²	50	71.2 Å²	71.2	52%	0.515	36%	0.36	S	S	.	.			trans	66.4	-2.9	-175.3	0	0	0	0	0	114.8	H843 K847	H843-G845 PolarHBondContact O-N 3.31Å; G845-K847 PolarHBondContact O-N 3.37Å
846	M	60.7	Low	77.8	Confident	107 Å²	107	70.2 Å²	70.2	53%	0.527	35%	0.351	S	S	.	.			trans	-73.3	87.8	-171.5	-63.6	-171.3	85	0	0	111.9	S844 Q848	S844-M846 PolarHBondContact O-N 3.24Å; S844-M846 WeakPolarHBondContact OG-CG 3.46Å; M846-Q848 HydrophobicContact CB-CG 4.18Å; M846-Q848 PolarHBondContact O-N 3.32Å
847	K	69.6	Low	77.5	Confident	123 Å²	123	72.5 Å²	72.5	54%	0.535	36%	0.363	S	S	.	.			trans	-78.9	66.9	176.6	-65.9	171	175.3	178.7	0	111.7	G845 F849 N857 F858	G845-K847 PolarHBondContact O-N 3.37Å; K847-F849 PolarHBondContact O-N 3.49Å; K847-F849 VanDerWaalsContact O-N 3.15Å; K847-N857 HydrophobicContact CB-CB 3.61Å; K847-N857 HydrophobicContact CD-CB 4.25Å; K847-N857 WeakPolarHBondContact CD-O 3.38Å; K847-F858 CarbonylContact C-O 3.55Å; K847-F858 WeakPolarHBondContact CA-O 3.42Å
848	Q	73.9	Confident	77.3	Confident	112 Å²	112	70.5 Å²	70.5	52%	0.523	36%	0.357	S	S	.	.			trans	-66.8	-7.4	-172.3	-66.4	-179.8	-21.5	0	0	116.1	M846 F858	M846-Q848 HydrophobicContact CB-CG 4.18Å; M846-Q848 PolarHBondContact O-N 3.32Å; Q848-F858 PolarHBondContact N-O 3.23Å
849	F	78.9	Confident	77.2	Confident	57 Å²	57	69.9 Å²	69.9	25%	0.25	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	106.2	-171.4	-57.2	-77.7	0	0	0	112	K847 F858 L860 K861 L864	K847-F849 PolarHBondContact O-N 3.49Å; K847-F849 VanDerWaalsContact O-N 3.15Å; F849-F858 HydrophobicContact CB-CB 4.36Å; F849-F858 PolarHBondContact N-O 3.3Å; F849-F858 WeakPolarHBondContact O-CB 3.41Å; F849-F858 WeakPolarHBondContact O-CD2 3.4Å; F849-F858 PolarHBondContact O-N 3.18Å; F849-L860 VanDerWaalsContact CD2-C 3.49Å; F849-K861 HydrophobicContact CD1-CB 3.88Å; F849-K861 HydrophobicContact CD1-CG 4.3Å; F849-K861 HydrophobicContact CD2-CB 4.36Å; F849-K861 VanDerWaalsContact CD2-N 3.28Å; F849-K861 HydrophobicContact CE1-CB 3.81Å; F849-K861 HydrophobicContact CE1-CD 4.36Å; F849-K861 HydrophobicContact CE1-CG 4.39Å; F849-K861 HydrophobicContact CE2-CB 4.29Å; F849-K861 HydrophobicContact CG-CB 4.16Å; F849-K861 HydrophobicContact CZ-CB 4.02Å; F849-L864 HydrophobicContact CB-CB 4.16Å; F849-L864 HydrophobicContact CB-CD2 3.89Å
850	E	81.3	Confident	77	Confident	93 Å²	93	69.8 Å²	69.8	44%	0.435	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	138.2	-180	-179.4	174.9	-166.3	0	0	112.7	K852 H855 N857 L864	E850-K852 PolarHBondContact O-N 3.34Å; E850-H855 WeakPolarHBondContact OE1-CA 3.33Å; E850-H855 WeakPolarHBondContact OE1-CB 3.34Å; E850-H855 IonicContact OE1-CE1 2.8Å; E850-H855 IonicContact OE1-CG 2.7Å; E850-H855 IonicContact OE1-ND1 3.83Å; E850-H855 PolarHBondContact OE1-ND1 3.38Å; E850-N857 VanDerWaalsContact CB-OD1 3.28Å; E850-N857 WeakPolarHBondContact CB-OD1 3.39Å; E850-N857 VanDerWaalsContact CG-OD1 3.26Å; E850-N857 WeakPolarHBondContact CG-OD1 3.35Å; E850-L864 WeakPolarHBondContact O-CD2 3.49Å
851	C	85.2	Confident	77.1	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.014	37%	0.367	C	S	.	.			trans	-77.7	108.1	161	-176.7	0	0	0	0	109.5	Q853 C854 H855 K856 F858 L864 L868 C872	C851-Q853 PolarHBondContact O-N 3.43Å; C851-C854 PolarHBondContact O-N 3.1Å; C851-C854 VanDerWaalsContact O-N 3.11Å; C851-H855 WeakPolarHBondContact O-CA 3.46Å; C851-H855 PolarHBondContact O-N 3.11Å; C851-K856 PolarHBondContact N-O 3.39Å; C851-F858 HydrophobicContact CB-CE2 4.49Å; C851-L864 HydrophobicContact CB-CD1 3.64Å; C851-L868 VanDerWaalsContact SG-CD2 3.55Å; C851-C872 WeakPolarHBondContact CB-SG 3.42Å; C851-C872 WeakPolarHBondContact SG-CB 3.44Å; C851-C872 CovalentContact SG-SG 2.06Å; C851-C872 PolarHBondContact SG-SG 3.08Å
852	K	81.8	Confident	77.2	Confident	192 Å²	192	73.8 Å²	73.8	84%	0.835	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-15.4	177.3	-67.7	-167.7	174.9	-169.3	0	115.4	E850	E850-K852 PolarHBondContact O-N 3.34Å
853	Q	79.6	Confident	77.4	Confident	91 Å²	91	76.8 Å²	76.8	43%	0.425	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-26.3	-176.7	-173.7	176.1	7.5	0	0	113.7	C851 C872 N874 K875	C851-Q853 PolarHBondContact O-N 3.43Å; Q853-C872 HydrophobicContact CB-CB 4.47Å; Q853-C872 PolarHBondContact NE2-O 3.06Å; Q853-C872 PolarHBondContact OE1-O 3.07Å; Q853-C872 VanDerWaalsContact OE1-O 3.13Å; Q853-N874 WeakPolarHBondContact CG-OD1 3.33Å; Q853-N874 PolarHBondContact NE2-OD1 2.88Å; Q853-N874 WeakPolarHBondContact O-CA 3.46Å; Q853-K875 PolarHBondContact O-N 3.16Å
854	C	84.4	Confident	77.9	Confident	14 Å²	14	74.4 Å²	74.4	10%	0.095	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-7.1	-179.2	83.6	0	0	0	0	114.9	C851 K856 H867 C872 M873	C851-C854 PolarHBondContact O-N 3.1Å; C851-C854 VanDerWaalsContact O-N 3.11Å; C854-K856 PolarHBondContact O-N 3.29Å; C854-K856 WeakPolarHBondContact SG-CB 3.42Å; C854-K856 WeakPolarHBondContact SG-CG 3.28Å; C854-K856 PolarHBondContact SG-N 3.38Å; C854-K856 VanDerWaalsContact SG-N 3.38Å; C854-H867 PolarHBondContact SG-NE2 3.03Å; C854-C872 WeakPolarHBondContact CB-SG 3.31Å; C854-C872 PolarHBondContact SG-SG 3.32Å; C854-M873 WeakPolarHBondContact CB-O 3.34Å
855	H	81.2	Confident	78.7	Confident	97 Å²	97	75.3 Å²	75.3	45%	0.449	37%	0.37	S	S	.	.			trans	60.1	25.7	-177.9	-52.5	-80.2	0	0	0	114.8	E850 C851	E850-H855 WeakPolarHBondContact OE1-CA 3.33Å; E850-H855 WeakPolarHBondContact OE1-CB 3.34Å; E850-H855 IonicContact OE1-CE1 2.8Å; E850-H855 IonicContact OE1-CG 2.7Å; E850-H855 IonicContact OE1-ND1 3.83Å; E850-H855 PolarHBondContact OE1-ND1 3.38Å; C851-H855 WeakPolarHBondContact O-CA 3.46Å; C851-H855 PolarHBondContact O-N 3.11Å
856	K	78.4	Confident	79.5	Confident	70 Å²	70	79.6 Å²	79.6	30%	0.304	38%	0.375	S	S	.	.			trans	-81.7	128.6	168.5	-69.3	175.3	-176	179.6	0	109.6	C851 C854 F858 W878	C851-K856 PolarHBondContact N-O 3.39Å; C854-K856 PolarHBondContact O-N 3.29Å; C854-K856 WeakPolarHBondContact SG-CB 3.42Å; C854-K856 WeakPolarHBondContact SG-CG 3.28Å; C854-K856 PolarHBondContact SG-N 3.38Å; C854-K856 VanDerWaalsContact SG-N 3.38Å; K856-F858 HydrophobicContact CB-CE2 3.86Å; K856-F858 HydrophobicContact CB-CZ 4.02Å; K856-F858 WeakPolarHBondContact O-CD2 3.49Å; K856-F858 WeakPolarHBondContact O-CE2 3.38Å; K856-W878 VanDerWaalsContact NZ-CZ2 3.33Å; K856-W878 VanDerWaalsContact NZ-CZ3 3.32Å
857	N	80.8	Confident	80.6	Confident	79 Å²	79	75.9 Å²	75.9	42%	0.422	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.1	-177.5	-63	-15	0	0	0	111.1	K847 E850	K847-N857 HydrophobicContact CB-CB 3.61Å; K847-N857 HydrophobicContact CD-CB 4.25Å; K847-N857 WeakPolarHBondContact CD-O 3.38Å; E850-N857 VanDerWaalsContact CB-OD1 3.28Å; E850-N857 WeakPolarHBondContact CB-OD1 3.39Å; E850-N857 VanDerWaalsContact CG-OD1 3.26Å; E850-N857 WeakPolarHBondContact CG-OD1 3.35Å
858	F	79.2	Confident	81.3	Confident	42 Å²	42	74.1 Å²	74.1	18%	0.184	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.4	-175.3	-61.3	-89.3	0	0	0	111.1	K847 Q848 F849 C851 K856 L860 L864 H867	K847-F858 CarbonylContact C-O 3.55Å; K847-F858 WeakPolarHBondContact CA-O 3.42Å; Q848-F858 PolarHBondContact N-O 3.23Å; F849-F858 HydrophobicContact CB-CB 4.36Å; F849-F858 PolarHBondContact N-O 3.3Å; F849-F858 WeakPolarHBondContact O-CB 3.41Å; F849-F858 WeakPolarHBondContact O-CD2 3.4Å; F849-F858 PolarHBondContact O-N 3.18Å; C851-F858 HydrophobicContact CB-CE2 4.49Å; K856-F858 HydrophobicContact CB-CE2 3.86Å; K856-F858 HydrophobicContact CB-CZ 4.02Å; K856-F858 WeakPolarHBondContact O-CD2 3.49Å; K856-F858 WeakPolarHBondContact O-CE2 3.38Å; F858-L860 VanDerWaalsContact C-N 3.28Å; F858-L860 PolarHBondContact O-N 3.47Å; F858-L864 HydrophobicContact CB-CB 4.39Å; F858-L864 HydrophobicContact CD2-CB 4.02Å; F858-L864 HydrophobicContact CD2-CD1 4.05Å; F858-L864 HydrophobicContact CE2-CD1 4.17Å; F858-L864 HydrophobicContact CG-CB 4.31Å; F858-H867 HydrophobicContact CE1-CB 4.09Å; F858-H867 HydrophobicContact CE2-CB 4.18Å; F858-H867 AromaticContact CE2-CD2 3.35Å; F858-H867 WeakPolarHBondContact CE2-CD2 3.27Å; F858-H867 AromaticContact CE2-CG 3.97Å; F858-H867 HydrophobicContact CZ-CB 3.62Å; F858-H867 AromaticContact CZ-CD2 3.24Å; F858-H867 WeakPolarHBondContact CZ-CD2 3.49Å; F858-H867 AromaticContact CZ-CG 3.45Å; F858-H867 VanDerWaalsContact CZ-CG 3.45Å; F858-H867 AromaticContact CZ-NE2 4Å
859	A	78.4	Confident	81.6	Confident	14 Å²	14	76.9 Å²	76.9	12%	0.116	37%	0.365	C	S	.	.	S	Bend	trans	-71.7	-20.1	175.2	0	0	0	0	0	113.7	T842	T842-A859 HydrophobicContact CG2-CB 4.31Å
860	L	78.8	Confident	81.6	Confident	21 Å²	21	78.6 Å²	78.6	11%	0.11	38%	0.384	C	S	.	.	S	Bend	trans	-136.1	134	-175.4	-76.3	166.5	0	0	0	111.5	A838 F849 F858 S862 Y863 L864	A838-L860 HydrophobicContact CB-CD1 4.01Å; A838-L860 HydrophobicContact CB-CD2 3.77Å; F849-L860 VanDerWaalsContact CD2-C 3.49Å; F858-L860 VanDerWaalsContact C-N 3.28Å; F858-L860 PolarHBondContact O-N 3.47Å; L860-S862 PolarHBondContact O-N 3.09Å; L860-S862 VanDerWaalsContact O-N 3.17Å; L860-Y863 HydrophobicContact CB-CD2 3.89Å; L860-Y863 HydrophobicContact CB-CE2 4.26Å; L860-Y863 HydrophobicContact CB-CG 4.22Å; L860-Y863 HydrophobicContact CD1-CD2 4.22Å; L860-Y863 HydrophobicContact CD1-CE2 3.7Å; L860-Y863 HydrophobicContact CG-CE2 4.45Å; L860-Y863 PolarHBondContact O-N 3.03Å; L860-L864 PolarHBondContact O-N 3.13Å
861	K	83.1	Confident	81.2	Confident	128 Å²	128	76.3 Å²	76.3	56%	0.557	39%	0.386	S	S	*	.	H	α-helix	trans	-56.9	-29.7	174.4	-171.1	169.9	-177.7	172.4	0	113	F849 Y863 L864 N865	F849-K861 HydrophobicContact CD1-CB 3.88Å; F849-K861 HydrophobicContact CD1-CG 4.3Å; F849-K861 HydrophobicContact CD2-CB 4.36Å; F849-K861 VanDerWaalsContact CD2-N 3.28Å; F849-K861 HydrophobicContact CE1-CB 3.81Å; F849-K861 HydrophobicContact CE1-CD 4.36Å; F849-K861 HydrophobicContact CE1-CG 4.39Å; F849-K861 HydrophobicContact CE2-CB 4.29Å; F849-K861 HydrophobicContact CG-CB 4.16Å; F849-K861 HydrophobicContact CZ-CB 4.02Å; K861-Y863 VanDerWaalsContact C-N 3.31Å; K861-Y863 PolarHBondContact O-N 3.12Å; K861-L864 PolarHBondContact O-N 3.49Å; K861-N865 WeakPolarHBondContact O-CB 3.49Å; K861-N865 PolarHBondContact O-N 3.03Å; K861-N865 PolarHBondContact O-OD1 3.16Å
862	S	80.6	Confident	80.7	Confident	65 Å²	65	76.5 Å²	76.5	46%	0.455	39%	0.387	S	S	.	.	H	α-helix	trans	-67.2	-28.5	174.7	52.8	0	0	0	0	113.5	L860 K866	L860-S862 PolarHBondContact O-N 3.09Å; L860-S862 VanDerWaalsContact O-N 3.17Å; S862-K866 WeakPolarHBondContact O-CG 3.35Å; S862-K866 PolarHBondContact O-N 2.93Å
863	Y	82.2	Confident	79.7	Confident	119 Å²	119	71.4 Å²	71.4	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-79.4	-39.2	172.8	-60.8	-26	0	0	0	111.6	L860 K861 K866 H867	L860-Y863 HydrophobicContact CB-CD2 3.89Å; L860-Y863 HydrophobicContact CB-CE2 4.26Å; L860-Y863 HydrophobicContact CB-CG 4.22Å; L860-Y863 HydrophobicContact CD1-CD2 4.22Å; L860-Y863 HydrophobicContact CD1-CE2 3.7Å; L860-Y863 HydrophobicContact CG-CE2 4.45Å; L860-Y863 PolarHBondContact O-N 3.03Å; K861-Y863 VanDerWaalsContact C-N 3.31Å; K861-Y863 PolarHBondContact O-N 3.12Å; Y863-K866 PolarHBondContact O-N 3.39Å; Y863-H867 WeakPolarHBondContact O-CB 3.21Å; Y863-H867 PolarHBondContact O-N 3.05Å
864	L	86.5	Confident	78.8	Confident	20 Å²	20	70 Å²	70	11%	0.105	36%	0.363	C	S	.	.	H	α-helix	trans	-58.4	-47.9	170.3	173.2	58.4	0	0	0	111.3	F849 E850 C851 F858 L860 K861 K866 H867 L868	F849-L864 HydrophobicContact CB-CB 4.16Å; F849-L864 HydrophobicContact CB-CD2 3.89Å; E850-L864 WeakPolarHBondContact O-CD2 3.49Å; C851-L864 HydrophobicContact CB-CD1 3.64Å; F858-L864 HydrophobicContact CB-CB 4.39Å; F858-L864 HydrophobicContact CD2-CB 4.02Å; F858-L864 HydrophobicContact CD2-CD1 4.05Å; F858-L864 HydrophobicContact CE2-CD1 4.17Å; F858-L864 HydrophobicContact CG-CB 4.31Å; L860-L864 PolarHBondContact O-N 3.13Å; K861-L864 PolarHBondContact O-N 3.49Å; L864-K866 PolarHBondContact O-N 2.99Å; L864-H867 WeakPolarHBondContact O-CB 3.5Å; L864-H867 PolarHBondContact O-N 2.76Å; L864-H867 VanDerWaalsContact O-N 3.14Å; L864-L868 HydrophobicContact CD1-CD1 4.03Å; L864-L868 HydrophobicContact CD1-CG 4.09Å; L864-L868 HydrophobicContact CG-CD1 4.03Å; L864-L868 WeakPolarHBondContact O-CG 3.35Å; L864-L868 PolarHBondContact O-N 2.87Å
865	N	83.5	Confident	77.6	Confident	85 Å²	85	75.7 Å²	75.7	46%	0.455	39%	0.386	S	S	.	.	H	α-helix	trans	-58.2	-45.9	177.1	-78.1	21.7	0	0	0	111.9	K861 H867 L868 E869	K861-N865 WeakPolarHBondContact O-CB 3.49Å; K861-N865 PolarHBondContact O-N 3.03Å; K861-N865 PolarHBondContact O-OD1 3.16Å; N865-H867 VanDerWaalsContact C-N 3.3Å; N865-H867 PolarHBondContact O-N 3.48Å; N865-L868 PolarHBondContact O-N 2.8Å; N865-E869 WeakPolarHBondContact O-CB 3.33Å; N865-E869 PolarHBondContact O-N 3.13Å
866	K	81.1	Confident	76.4	Confident	141 Å²	141	74.4 Å²	74.4	61%	0.613	39%	0.387	S	S	*	.	H	α-helix	trans	-62.8	-35.1	176	-80.4	-173.1	172.1	-163.1	0	113.2	S862 Y863 L864 E869 S870	S862-K866 WeakPolarHBondContact O-CG 3.35Å; S862-K866 PolarHBondContact O-N 2.93Å; Y863-K866 PolarHBondContact O-N 3.39Å; L864-K866 PolarHBondContact O-N 2.99Å; K866-E869 PolarHBondContact O-N 3.02Å; K866-S870 VanDerWaalsContact O-CB 3.31Å; K866-S870 WeakPolarHBondContact O-CB 3.5Å; K866-S870 PolarHBondContact O-N 3.38Å; K866-S870 PolarHBondContact O-OG 3.14Å
867	H	83.8	Confident	75.6	Confident	29 Å²	29	73.9 Å²	73.9	13%	0.134	39%	0.388	C	S	.	.	H	α-helix	trans	-71.6	-35.4	177.4	172.6	46.7	0	0	0	112.7	C854 F858 Y863 L864 N865 S870 G871 C872	C854-H867 PolarHBondContact SG-NE2 3.03Å; F858-H867 HydrophobicContact CE1-CB 4.09Å; F858-H867 HydrophobicContact CE2-CB 4.18Å; F858-H867 AromaticContact CE2-CD2 3.35Å; F858-H867 WeakPolarHBondContact CE2-CD2 3.27Å; F858-H867 AromaticContact CE2-CG 3.97Å; F858-H867 HydrophobicContact CZ-CB 3.62Å; F858-H867 AromaticContact CZ-CD2 3.24Å; F858-H867 WeakPolarHBondContact CZ-CD2 3.49Å; F858-H867 AromaticContact CZ-CG 3.45Å; F858-H867 VanDerWaalsContact CZ-CG 3.45Å; F858-H867 AromaticContact CZ-NE2 4Å; Y863-H867 WeakPolarHBondContact O-CB 3.21Å; Y863-H867 PolarHBondContact O-N 3.05Å; L864-H867 WeakPolarHBondContact O-CB 3.5Å; L864-H867 PolarHBondContact O-N 2.76Å; L864-H867 VanDerWaalsContact O-N 3.14Å; N865-H867 VanDerWaalsContact C-N 3.3Å; N865-H867 PolarHBondContact O-N 3.48Å; H867-S870 PolarHBondContact O-OG 3.23Å; H867-G871 CarbonylContact O-C 3.59Å; H867-G871 PolarHBondContact O-N 3.49Å; H867-C872 PolarHBondContact NE2-SG 3.43Å; H867-C872 PolarHBondContact O-N 3.04Å
868	L	84.3	Confident	74.7	Confident	86 Å²	86	73.1 Å²	73.1	45%	0.45	38%	0.379	S	S	.	.	H	α-helix	trans	-66.4	-45.1	169.9	-68.3	165.6	0	0	0	110.7	C851 L864 N865 S870 G871 C872	C851-L868 VanDerWaalsContact SG-CD2 3.55Å; L864-L868 HydrophobicContact CD1-CD1 4.03Å; L864-L868 HydrophobicContact CD1-CG 4.09Å; L864-L868 HydrophobicContact CG-CD1 4.03Å; L864-L868 WeakPolarHBondContact O-CG 3.35Å; L864-L868 PolarHBondContact O-N 2.87Å; N865-L868 PolarHBondContact O-N 2.8Å; L868-S870 VanDerWaalsContact C-N 3.34Å; L868-S870 PolarHBondContact O-N 2.9Å; L868-G871 PolarHBondContact O-N 3.4Å; L868-G871 VanDerWaalsContact O-N 3.14Å; L868-C872 HydrophobicContact CD2-CB 4.03Å
869	E	81.2	Confident	73.8	Confident	169 Å²	169	74.8 Å²	74.8	79%	0.79	40%	0.396	S	S	*	.	H	α-helix	trans	-63.6	-34.2	177.4	-173.9	176.3	-155.4	0	0	112.8	N865 K866 G871	N865-E869 WeakPolarHBondContact O-CB 3.33Å; N865-E869 PolarHBondContact O-N 3.13Å; K866-E869 PolarHBondContact O-N 3.02Å; E869-G871 VanDerWaalsContact C-N 3.28Å; E869-G871 PolarHBondContact O-N 3.49Å
870	S	78.1	Confident	73.2	Confident	93 Å²	93	78.8 Å²	78.8	65%	0.65	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	6.3	175	75.3	0	0	0	0	114.4	K866 H867 L868	K866-S870 VanDerWaalsContact O-CB 3.31Å; K866-S870 WeakPolarHBondContact O-CB 3.5Å; K866-S870 PolarHBondContact O-N 3.38Å; K866-S870 PolarHBondContact O-OG 3.14Å; H867-S870 PolarHBondContact O-OG 3.23Å; L868-S870 VanDerWaalsContact C-N 3.34Å; L868-S870 PolarHBondContact O-N 2.9Å
871	G	73.9	Confident	72.3	Confident	46 Å²	46	81 Å²	81	47%	0.474	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	99.6	-173.9	0	0	0	0	0	113.5	H867 L868 E869 M873	H867-G871 CarbonylContact O-C 3.59Å; H867-G871 PolarHBondContact O-N 3.49Å; L868-G871 PolarHBondContact O-N 3.4Å; L868-G871 VanDerWaalsContact O-N 3.14Å; E869-G871 VanDerWaalsContact C-N 3.28Å; E869-G871 PolarHBondContact O-N 3.49Å; G871-M873 PolarHBondContact O-N 3.39Å; G871-M873 VanDerWaalsContact O-N 3.17Å
872	C	73	Confident	71.5	Confident	6 Å²	6	78 Å²	78	4%	0.041	42%	0.42	C	S	.	.			trans	-78.4	93.1	168.6	-173.9	0	0	0	0	108.9	C851 Q853 C854 H867 L868	C851-C872 WeakPolarHBondContact CB-SG 3.42Å; C851-C872 WeakPolarHBondContact SG-CB 3.44Å; C851-C872 CovalentContact SG-SG 2.06Å; C851-C872 PolarHBondContact SG-SG 3.08Å; Q853-C872 HydrophobicContact CB-CB 4.47Å; Q853-C872 PolarHBondContact NE2-O 3.06Å; Q853-C872 PolarHBondContact OE1-O 3.07Å; Q853-C872 VanDerWaalsContact OE1-O 3.13Å; C854-C872 WeakPolarHBondContact CB-SG 3.31Å; C854-C872 PolarHBondContact SG-SG 3.32Å; H867-C872 PolarHBondContact NE2-SG 3.43Å; H867-C872 PolarHBondContact O-N 3.04Å; L868-C872 HydrophobicContact CD2-CB 4.03Å
873	M	62.5	Low	71	Confident	85 Å²	85	79.4 Å²	79.4	42%	0.419	43%	0.429	S	S	.	.			trans	-60.7	143.4	176.2	-64.3	-172.5	83.8	0	0	111.4	C854 G871 D877 M881	C854-M873 WeakPolarHBondContact CB-O 3.34Å; G871-M873 PolarHBondContact O-N 3.39Å; G871-M873 VanDerWaalsContact O-N 3.17Å; M873-D877 HydrophobicContact CB-CB 4.42Å; M873-D877 HydrophobicContact CE-CB 3.93Å; M873-M881 HydrophobicContact CE-SD 4.39Å; M873-M881 HydrophobicContact SD-SD 3.88Å
874	N	60.3	Low	70.5	Confident	61 Å²	61	78 Å²	78	33%	0.326	44%	0.437	S	S	.	.			trans	-64.4	158.3	-179.7	-53.9	-61.1	0	0	0	111	Q853 S876 D877 W878	Q853-N874 WeakPolarHBondContact CG-OD1 3.33Å; Q853-N874 PolarHBondContact NE2-OD1 2.88Å; Q853-N874 WeakPolarHBondContact O-CA 3.46Å; N874-S876 WeakPolarHBondContact CB-OG 3.48Å; N874-S876 PolarHBondContact O-N 3.06Å; N874-D877 VanDerWaalsContact CB-OD2 3.27Å; N874-D877 WeakPolarHBondContact CB-OD2 3.19Å; N874-D877 PolarHBondContact N-OD2 3.01Å; N874-D877 PolarHBondContact ND2-OD2 3.26Å; N874-D877 PolarHBondContact O-N 3.28Å; N874-W878 WeakPolarHBondContact O-CB 3.41Å; N874-W878 PolarHBondContact O-N 3.37Å
875	K	58.8	Low	69.1	Low	134 Å²	134	77.9 Å²	77.9	58%	0.583	44%	0.436	S	S	*	.	H	α-helix	trans	-58.7	-30.2	176	-165.4	172	-178.8	177.3	0	113.1	Q853 S879	Q853-K875 PolarHBondContact O-N 3.16Å; K875-S879 PolarHBondContact O-N 3.15Å; K875-S879 VanDerWaalsContact O-N 3.16Å; K875-S879 PolarHBondContact O-OG 3.08Å
876	S	55.5	Low	68.1	Low	69 Å²	69	77.3 Å²	77.3	48%	0.483	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-52.1	169.4	44.6	0	0	0	0	112.2	N874 W878 S879 V880	N874-S876 WeakPolarHBondContact CB-OG 3.48Å; N874-S876 PolarHBondContact O-N 3.06Å; S876-W878 VanDerWaalsContact C-N 3.34Å; S876-S879 WeakPolarHBondContact O-CB 3.18Å; S876-S879 PolarHBondContact O-N 2.96Å; S876-S879 VanDerWaalsContact O-N 3.12Å; S876-V880 PolarHBondContact O-N 2.94Å
877	D	62.8	Low	66.9	Low	59 Å²	59	75.8 Å²	75.8	32%	0.316	44%	0.443	S	S	.	.	H	α-helix	trans	-73.9	-34.7	-170.5	-36.4	-21.8	0	0	0	109.6	M873 N874 V880 M881	M873-D877 HydrophobicContact CB-CB 4.42Å; M873-D877 HydrophobicContact CE-CB 3.93Å; N874-D877 VanDerWaalsContact CB-OD2 3.27Å; N874-D877 WeakPolarHBondContact CB-OD2 3.19Å; N874-D877 PolarHBondContact N-OD2 3.01Å; N874-D877 PolarHBondContact ND2-OD2 3.26Å; N874-D877 PolarHBondContact O-N 3.28Å; D877-V880 PolarHBondContact O-N 2.84Å; D877-M881 WeakPolarHBondContact O-CB 3.49Å; D877-M881 PolarHBondContact O-N 3.4Å
878	W	60.4	Low	65.1	Low	64 Å²	64	82 Å²	82	24%	0.242	47%	0.472	C	S	.	.	H	α-helix	trans	-61.4	-40.5	168.7	-171.7	-98.9	0	0	0	112.3	K856 N874 S876 N882 F893	K856-W878 VanDerWaalsContact NZ-CZ2 3.33Å; K856-W878 VanDerWaalsContact NZ-CZ3 3.32Å; N874-W878 WeakPolarHBondContact O-CB 3.41Å; N874-W878 PolarHBondContact O-N 3.37Å; S876-W878 VanDerWaalsContact C-N 3.34Å; W878-N882 WeakPolarHBondContact O-CB 3.34Å; W878-N882 PolarHBondContact O-N 2.95Å; W878-F893 HydrophobicContact CH2-CB 3.91Å; W878-F893 AromaticContact CH2-CD1 3.95Å; W878-F893 HydrophobicContact CH2-CD1 3.95Å; W878-F893 HydrophobicContact CH2-CG 4.04Å; W878-F893 HydrophobicContact CZ2-CB 4.25Å
879	S	60.6	Low	63.3	Low	76 Å²	76	82.2 Å²	82.2	53%	0.531	47%	0.471	S	S	.	.	H	α-helix	trans	-65	-44.4	174.9	-77.5	0	0	0	0	112	K875 S876 N882 S883	K875-S879 PolarHBondContact O-N 3.15Å; K875-S879 VanDerWaalsContact O-N 3.16Å; K875-S879 PolarHBondContact O-OG 3.08Å; S876-S879 WeakPolarHBondContact O-CB 3.18Å; S876-S879 PolarHBondContact O-N 2.96Å; S876-S879 VanDerWaalsContact O-N 3.12Å; S879-N882 PolarHBondContact O-N 3.35Å; S879-S883 PolarHBondContact O-N 2.81Å; S879-S883 PolarHBondContact O-OG 3.45Å; S879-S883 VanDerWaalsContact O-OG 3.11Å
880	V	66.2	Low	61.9	Low	98 Å²	98	77.8 Å²	77.8	59%	0.594	45%	0.449	S	S	*	.	H	α-helix	trans	-64.5	-41.8	177.5	174.8	0	0	0	0	111.7	S876 D877 S883 S884	S876-V880 PolarHBondContact O-N 2.94Å; D877-V880 PolarHBondContact O-N 2.84Å; V880-S883 WeakPolarHBondContact CA-OG 3.47Å; V880-S883 PolarHBondContact O-OG 3.11Å; V880-S884 PolarHBondContact O-N 3.46Å; V880-S884 PolarHBondContact O-OG 2.88Å
881	M	60.7	Low	60.1	Low	68 Å²	68	77.6 Å²	77.6	34%	0.335	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-48.3	174.1	-168.8	172.6	-174.2	0	0	110.9	M873 D877 S883 S884 L885	M873-M881 HydrophobicContact CE-SD 4.39Å; M873-M881 HydrophobicContact SD-SD 3.88Å; D877-M881 WeakPolarHBondContact O-CB 3.49Å; D877-M881 PolarHBondContact O-N 3.4Å; M881-S883 VanDerWaalsContact C-N 3.31Å; M881-S883 PolarHBondContact O-N 3.15Å; M881-S884 CarbonylContact O-C 3.29Å; M881-S884 WeakPolarHBondContact O-CA 3.47Å; M881-S884 VanDerWaalsContact O-CB 3.32Å; M881-S884 WeakPolarHBondContact O-CB 3.42Å; M881-S884 PolarHBondContact O-N 3.46Å; M881-L885 HydrophobicContact CE-CD2 4.31Å; M881-L885 HydrophobicContact CG-CD2 4.41Å; M881-L885 HydrophobicContact CG-CG 4.35Å; M881-L885 WeakPolarHBondContact O-CG 3.48Å; M881-L885 PolarHBondContact O-N 3.39Å
882	N	66.3	Low	58.2	Low	66 Å²	66	85 Å²	85	35%	0.353	46%	0.463	S	S	.	.	H	α-helix	trans	-67.6	-24.6	-179.2	-166.7	30.8	0	0	0	113.5	W878 S879 S884 K890	W878-N882 WeakPolarHBondContact O-CB 3.34Å; W878-N882 PolarHBondContact O-N 2.95Å; S879-N882 PolarHBondContact O-N 3.35Å; N882-S884 VanDerWaalsContact C-N 3.26Å; N882-K890 WeakPolarHBondContact O-CE 3.39Å; N882-K890 PolarHBondContact O-NZ 2.92Å; N882-K890 WeakPolarHBondContact OD1-CE 3.46Å
883	S	69.7	Low	56.5	Low	94 Å²	94	89.5 Å²	89.5	66%	0.657	48%	0.481	S	S	*	.	H	α-helix	trans	-70.7	-22.4	165.9	48.1	0	0	0	0	113.4	S879 V880 M881	S879-S883 PolarHBondContact O-N 2.81Å; S879-S883 PolarHBondContact O-OG 3.45Å; S879-S883 VanDerWaalsContact O-OG 3.11Å; V880-S883 WeakPolarHBondContact CA-OG 3.47Å; V880-S883 PolarHBondContact O-OG 3.11Å; M881-S883 VanDerWaalsContact C-N 3.31Å; M881-S883 PolarHBondContact O-N 3.15Å
884	S	70.5	Confident	55.1	Low	90 Å²	90	89.3 Å²	89.3	63%	0.629	49%	0.489	S	S	*	.	H	α-helix	trans	-93.7	-26.3	-177.2	-50.5	0	0	0	0	113.7	V880 M881 N882	V880-S884 PolarHBondContact O-N 3.46Å; V880-S884 PolarHBondContact O-OG 2.88Å; M881-S884 CarbonylContact O-C 3.29Å; M881-S884 WeakPolarHBondContact O-CA 3.47Å; M881-S884 VanDerWaalsContact O-CB 3.32Å; M881-S884 WeakPolarHBondContact O-CB 3.42Å; M881-S884 PolarHBondContact O-N 3.46Å; N882-S884 VanDerWaalsContact C-N 3.26Å
885	L	58.3	Low	54	Low	17 Å²	17	91.6 Å²	91.6	9%	0.089	51%	0.507	C	S	.	.	S	Bend	trans	-68.1	138.2	178.9	-65.1	179.1	0	0	0	112.4	M881 E889 K890 F893	M881-L885 HydrophobicContact CE-CD2 4.31Å; M881-L885 HydrophobicContact CG-CD2 4.41Å; M881-L885 HydrophobicContact CG-CG 4.35Å; M881-L885 WeakPolarHBondContact O-CG 3.48Å; M881-L885 PolarHBondContact O-N 3.39Å; L885-E889 HydrophobicContact CB-CB 4.1Å; L885-E889 HydrophobicContact CD2-CB 3.95Å; L885-E889 HydrophobicContact CG-CB 4.43Å; L885-K890 HydrophobicContact CB-CG 3.96Å; L885-K890 WeakPolarHBondContact O-CE 3.49Å; L885-K890 PolarHBondContact O-NZ 3.33Å; L885-F893 HydrophobicContact CD1-CD2 3.58Å; L885-F893 HydrophobicContact CD1-CE2 3.96Å; L885-F893 HydrophobicContact CD1-CG 4.47Å; L885-F893 HydrophobicContact CD2-CE2 4.31Å
886	T	61.3	Low	52.6	Low	73 Å²	73	91.9 Å²	91.9	45%	0.448	51%	0.51	S	S	.	.			trans	-65.7	168	169.1	61.2	0	0	0	0	112.5	E888 E889 K890	T886-E888 PolarHBondContact O-N 3.38Å; T886-E889 VanDerWaalsContact CB-OE2 3.3Å; T886-E889 WeakPolarHBondContact CB-OE2 3.47Å; T886-E889 WeakPolarHBondContact CG2-OE2 3.46Å; T886-E889 PolarHBondContact N-OE2 2.69Å; T886-E889 PolarHBondContact O-N 3.4Å; T886-E889 VanDerWaalsContact OG1-CG 3.31Å; T886-E889 WeakPolarHBondContact OG1-CG 3.49Å; T886-E889 PolarHBondContact OG1-N 3.01Å; T886-E889 PolarHBondContact OG1-OE2 3.38Å; T886-K890 WeakPolarHBondContact O-CB 3.44Å; T886-K890 WeakPolarHBondContact O-CG 3.32Å; T886-K890 PolarHBondContact O-N 3.47Å
887	S	56.4	Low	51.6	Low	108 Å²	108	92.8 Å²	92.8	76%	0.755	51%	0.514	S	S	*	.	H	α-helix	trans	-56.9	-35.8	174.4	-49.9	0	0	0	0	112.8
888	E	47.4	Very low	50.1	Low	161 Å²	161	95.1 Å²	95.1	75%	0.752	54%	0.535	S	S	*	.	H	α-helix	trans	-73.9	-48.4	-180	-60.6	-173.2	157.3	0	0	110.9	T886 K890 S891	T886-E888 PolarHBondContact O-N 3.38Å; E888-K890 VanDerWaalsContact C-N 3.27Å; E888-K890 PolarHBondContact O-N 3.16Å; E888-S891 WeakPolarHBondContact O-CB 3.47Å; E888-S891 PolarHBondContact O-N 3.04Å; E888-S891 PolarHBondContact O-OG 3.33Å
889	E	44.9	Very low	48.9	Very low	89 Å²	89	99.7 Å²	99.7	42%	0.416	56%	0.559	S	S	.	*	H	α-helix	trans	-61.7	-35.3	177.4	-67.2	163.7	117.1	0	0	112.2	L885 T886 S891 Y892 F893	L885-E889 HydrophobicContact CB-CB 4.1Å; L885-E889 HydrophobicContact CD2-CB 3.95Å; L885-E889 HydrophobicContact CG-CB 4.43Å; T886-E889 VanDerWaalsContact CB-OE2 3.3Å; T886-E889 WeakPolarHBondContact CB-OE2 3.47Å; T886-E889 WeakPolarHBondContact CG2-OE2 3.46Å; T886-E889 PolarHBondContact N-OE2 2.69Å; T886-E889 PolarHBondContact O-N 3.4Å; T886-E889 VanDerWaalsContact OG1-CG 3.31Å; T886-E889 WeakPolarHBondContact OG1-CG 3.49Å; T886-E889 PolarHBondContact OG1-N 3.01Å; T886-E889 PolarHBondContact OG1-OE2 3.38Å; E889-S891 PolarHBondContact O-N 3.4Å; E889-Y892 VanDerWaalsContact O-CB 3.27Å; E889-Y892 WeakPolarHBondContact O-CB 3.44Å; E889-Y892 PolarHBondContact O-N 3.31Å; E889-F893 VanDerWaalsContact O-CD2 3.28Å; E889-F893 WeakPolarHBondContact O-CD2 3.42Å
890	K	52.7	Low	47.8	Very low	77 Å²	77	103 Å²	103	34%	0.335	56%	0.564	S	S	.	*	H	α-helix	trans	-58.4	-33.1	173.9	-82.4	166.2	168.9	133.7	0	113.2	N882 L885 T886 E888 Y892 F893 S894	N882-K890 WeakPolarHBondContact O-CE 3.39Å; N882-K890 PolarHBondContact O-NZ 2.92Å; N882-K890 WeakPolarHBondContact OD1-CE 3.46Å; L885-K890 HydrophobicContact CB-CG 3.96Å; L885-K890 WeakPolarHBondContact O-CE 3.49Å; L885-K890 PolarHBondContact O-NZ 3.33Å; T886-K890 WeakPolarHBondContact O-CB 3.44Å; T886-K890 WeakPolarHBondContact O-CG 3.32Å; T886-K890 PolarHBondContact O-N 3.47Å; E888-K890 VanDerWaalsContact C-N 3.27Å; E888-K890 PolarHBondContact O-N 3.16Å; K890-Y892 VanDerWaalsContact C-N 3.27Å; K890-Y892 PolarHBondContact O-N 2.88Å; K890-F893 PolarHBondContact O-N 3.07Å; K890-S894 PolarHBondContact O-N 3.06Å
891	S	40.5	Very low	46.2	Very low	88 Å²	88	104.7 Å²	104.7	62%	0.615	57%	0.569	S	S	*	*	H	α-helix	trans	-65.5	-31.9	174.7	77.6	0	0	0	0	112.4	E888 E889 F893	E888-S891 WeakPolarHBondContact O-CB 3.47Å; E888-S891 PolarHBondContact O-N 3.04Å; E888-S891 PolarHBondContact O-OG 3.33Å; E889-S891 PolarHBondContact O-N 3.4Å; S891-F893 VanDerWaalsContact C-N 3.29Å; S891-F893 PolarHBondContact O-N 3.03Å
892	Y	32.8	Very low	45	Very low	203 Å²	203	106.4 Å²	106.4	80%	0.796	59%	0.588	S	S	*	*	H	α-helix	trans	-72.3	-21.1	-179.2	-138.7	-87.8	0	0	0	113.6	E889 K890	E889-Y892 VanDerWaalsContact O-CB 3.27Å; E889-Y892 WeakPolarHBondContact O-CB 3.44Å; E889-Y892 PolarHBondContact O-N 3.31Å; K890-Y892 VanDerWaalsContact C-N 3.27Å; K890-Y892 PolarHBondContact O-N 2.88Å
893	F	39.1	Very low	43.6	Very low	99 Å²	99	112.3 Å²	112.3	43%	0.434	61%	0.61	S	S	.	*	H	α-helix	trans	-109.6	-5.5	-176.5	-70.8	-67.8	0	0	0	114.5	W878 L885 E889 K890 S891	W878-F893 HydrophobicContact CH2-CB 3.91Å; W878-F893 AromaticContact CH2-CD1 3.95Å; W878-F893 HydrophobicContact CH2-CD1 3.95Å; W878-F893 HydrophobicContact CH2-CG 4.04Å; W878-F893 HydrophobicContact CZ2-CB 4.25Å; L885-F893 HydrophobicContact CD1-CD2 3.58Å; L885-F893 HydrophobicContact CD1-CE2 3.96Å; L885-F893 HydrophobicContact CD1-CG 4.47Å; L885-F893 HydrophobicContact CD2-CE2 4.31Å; E889-F893 VanDerWaalsContact O-CD2 3.28Å; E889-F893 WeakPolarHBondContact O-CD2 3.42Å; K890-F893 PolarHBondContact O-N 3.07Å; S891-F893 VanDerWaalsContact C-N 3.29Å; S891-F893 PolarHBondContact O-N 3.03Å
894	S	31.5	Very low	41.6	Very low	82 Å²	82	115.5 Å²	115.5	57%	0.573	62%	0.617	S	S	*	*			trans	-89.8	123.7	-179.4	-165.3	0	0	0	0	111.4	K890 E896	K890-S894 PolarHBondContact O-N 3.06Å; S894-E896 PolarHBondContact O-N 3.13Å
895	P	36.7	Very low	39.7	Very low	108 Å²	108	119.7 Å²	119.7	70%	0.701	63%	0.627	S	S	*	*			trans	-76	104.2	173.3	30.5	-31.6	0	0	0	109.8
896	E	30	Very low	38.3	Very low	140 Å²	140	127.4 Å²	127.4	65%	0.654	66%	0.66	S	S	*	*			trans	-55	143.2	177.8	-89.9	-145.8	118.3	0	0	112.4	S894 K900	S894-E896 PolarHBondContact O-N 3.13Å; E896-K900 IonicContact OE1-NZ 3.02Å; E896-K900 PolarHBondContact OE1-NZ 2.84Å
897	P	34	Very low	36.8	Very low	88 Å²	88	132 Å²	132	57%	0.571	68%	0.676	S	S	*	*			trans	-63.7	135.1	176.7	-21	33	0	0	0	112.5	E899	P897-E899 PolarHBondContact O-N 3.36Å
898	S	32.3	Very low	35.7	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	16.2	-177.7	49.6	0	0	0	0	115.3
899	E	34.9	Very low	35.1	Very low	161 Å²	161	133.9 Å²	133.9	75%	0.752	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-22.3	-170.9	-64.2	-176.4	125.9	0	0	114.1	P897 L901 S902	P897-E899 PolarHBondContact O-N 3.36Å; E899-L901 PolarHBondContact O-N 2.7Å; E899-S902 PolarHBondContact O-OG 3.5Å
900	K	37	Very low	34.6	Very low	146 Å²	146	133.2 Å²	133.2	64%	0.635	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-67	-15.9	178.3	-72.7	179.5	-176.7	164.8	0	114.1	E896 S902	E896-K900 IonicContact OE1-NZ 3.02Å; E896-K900 PolarHBondContact OE1-NZ 2.84Å; K900-S902 PolarHBondContact O-N 2.67Å
901	L	33.7	Very low	33.9	Very low	132 Å²	132	136.3 Å²	136.3	69%	0.691	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-75.2	-4.4	-173.1	-122	74.3	0	0	0	115.2	E899	E899-L901 PolarHBondContact O-N 2.7Å
902	S	34.4	Very low	33.9	Very low	104 Å²	104	139.2 Å²	139.2	73%	0.727	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-93	0.2	-176.2	61	0	0	0	0	115	E899 K900	E899-S902 PolarHBondContact O-OG 3.5Å; K900-S902 PolarHBondContact O-N 2.67Å
903	K	38.4	Very low	34.2	Very low	190 Å²	190	132.5 Å²	132.5	83%	0.826	69%	0.689	S	S	*	*	S	Bend	trans	-133.6	10.9	-176.3	-73.1	-166.9	174.9	-175.7	0	115.7
904	M	27.6	Very low	34.1	Very low	161 Å²	161	137.7 Å²	137.7	79%	0.793	71%	0.705	S	S	*	*			trans	-89.5	109.2	166.4	-75.6	-178.6	67.8	0	0	109.4
905	E	30.3	Very low	34.6	Very low	179 Å²	179	138 Å²	138	84%	0.836	71%	0.708	S	S	*	*			trans	-66.9	162.9	171.6	-67.7	-179.4	113.2	0	0	111.7	H907	E905-H907 PolarHBondContact O-N 3.26Å
906	F	27.9	Very low	35	Very low	179 Å²	179	136.5 Å²	136.5	79%	0.785	70%	0.696	S	S	*	*			trans	-71.8	80.7	-166	-104.7	-117.8	0	0	0	114.3	Q908	F906-Q908 HydrophobicContact CD1-CG 4.05Å; F906-Q908 HydrophobicContact CE1-CG 4.43Å; F906-Q908 VanDerWaalsContact CE1-NE2 3.32Å
907	H	31.4	Very low	36	Very low	170 Å²	170	133.2 Å²	133.2	79%	0.787	69%	0.686	S	S	*	*			trans	-98.1	78.6	161.4	-88.8	-70.5	0	0	0	111.8	E905 Q909	E905-H907 PolarHBondContact O-N 3.26Å; H907-Q909 PolarHBondContact O-N 3.33Å
908	Q	33.4	Very low	36.9	Very low	154 Å²	154	137.3 Å²	137.3	72%	0.72	70%	0.695	S	S	*	*			trans	-74.6	59	171.8	-69.5	-167.6	-5.4	0	0	112.7	F906	F906-Q908 HydrophobicContact CD1-CG 4.05Å; F906-Q908 HydrophobicContact CE1-CG 4.43Å; F906-Q908 VanDerWaalsContact CE1-NE2 3.32Å
909	Q	34.9	Very low	37.5	Very low	153 Å²	153	139 Å²	139	72%	0.715	69%	0.694	S	S	*	*	S	Bend	trans	-174.3	104.1	171.1	-103.4	153.5	42	0	0	109.9	H907	H907-Q909 PolarHBondContact O-N 3.33Å
910	S	33.9	Very low	38.6	Very low	76 Å²	76	137.7 Å²	137.7	53%	0.531	69%	0.691	S	S	.	*			trans	167	-16.6	147.1	45.7	0	0	0	0	117	L912 S913	S910-L912 PolarHBondContact O-N 3.31Å; S910-S913 PolarHBondContact O-N 3.2Å; S910-S913 PolarHBondContact O-OG 3.26Å
911	D	38.4	Very low	39.4	Very low	141 Å²	141	139 Å²	139	75%	0.754	71%	0.705	S	S	*	*	H	α-helix	trans	-56	-20.7	-170.3	-67.2	-25.4	0	0	0	116.3
912	L	39.9	Very low	39.7	Very low	150 Å²	150	139.4 Å²	139.4	79%	0.785	71%	0.706	S	S	*	*	H	α-helix	trans	-87.5	-12.5	174.8	-82.6	159.6	0	0	0	114.8	S910 V916	S910-L912 PolarHBondContact O-N 3.31Å; L912-V916 VanDerWaalsContact O-CG2 3.32Å; L912-V916 WeakPolarHBondContact O-CG2 3.39Å
913	S	37.7	Very low	40	Very low	62 Å²	62	141.2 Å²	141.2	43%	0.434	71%	0.705	S	S	.	*	H	α-helix	trans	-89.5	-40.4	175.4	66	0	0	0	0	112.7	S910 S915 V916 T917	S910-S913 PolarHBondContact O-N 3.2Å; S910-S913 PolarHBondContact O-OG 3.26Å; S913-S915 VanDerWaalsContact C-N 3.26Å; S913-S915 PolarHBondContact O-N 3.26Å; S913-V916 PolarHBondContact O-N 2.81Å; S913-T917 PolarHBondContact O-N 3.22Å; S913-T917 PolarHBondContact O-OG1 3.02Å
914	W	37.7	Very low	40	Very low	207 Å²	207	138.5 Å²	138.5	78%	0.784	70%	0.698	S	S	*	*	H	α-helix	trans	-58	-37.6	-176	-165	2.3	0	0	0	112.7	V916	W914-V916 VanDerWaalsContact C-N 3.32Å; W914-V916 PolarHBondContact O-N 3.28Å
915	S	41.4	Very low	40.8	Very low	90 Å²	90	137.2 Å²	137.2	63%	0.629	69%	0.693	S	S	*	*	H	α-helix	trans	-73.3	-19.6	176	-59.8	0	0	0	0	114.2	S913	S913-S915 VanDerWaalsContact C-N 3.26Å; S913-S915 PolarHBondContact O-N 3.26Å
916	V	45.9	Very low	41.4	Very low	75 Å²	75	134.6 Å²	134.6	46%	0.455	68%	0.684	S	S	.	*	H	α-helix	trans	-98.3	-40.1	-176.3	174	0	0	0	0	111	L912 S913 W914 K918 L919 I920	L912-V916 VanDerWaalsContact O-CG2 3.32Å; L912-V916 WeakPolarHBondContact O-CG2 3.39Å; S913-V916 PolarHBondContact O-N 2.81Å; W914-V916 VanDerWaalsContact C-N 3.32Å; W914-V916 PolarHBondContact O-N 3.28Å; V916-K918 PolarHBondContact O-N 3.48Å; V916-L919 CarbonylContact O-C 3.57Å; V916-L919 WeakPolarHBondContact O-CA 3.42Å; V916-L919 PolarHBondContact O-N 3.09Å; V916-I920 HydrophobicContact CG1-CD1 3.62Å; V916-I920 HydrophobicContact CG1-CG1 4.37Å; V916-I920 WeakPolarHBondContact O-CG1 3.33Å; V916-I920 PolarHBondContact O-N 3.31Å
917	T	50.5	Low	42.3	Very low	71 Å²	71	131.6 Å²	131.6	44%	0.436	68%	0.677	S	S	.	*	H	α-helix	trans	-63	-31.6	175.6	-54.9	0	0	0	0	112	S913 L919 I920 N921	S913-T917 PolarHBondContact O-N 3.22Å; S913-T917 PolarHBondContact O-OG1 3.02Å; T917-L919 PolarHBondContact O-N 2.99Å; T917-I920 PolarHBondContact O-N 3.38Å; T917-N921 WeakPolarHBondContact O-CB 3.36Å; T917-N921 PolarHBondContact O-N 2.67Å
918	K	53	Low	43.1	Very low	174 Å²	174	128.9 Å²	128.9	76%	0.757	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	14.3	173.3	-152.7	-172.7	176.2	-176.7	0	114	V916	V916-K918 PolarHBondContact O-N 3.48Å
919	L	45.4	Very low	43.9	Very low	143 Å²	143	126.9 Å²	126.9	75%	0.749	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.8	11.7	177.7	-132.1	167	0	0	0	110.9	V916 T917	V916-L919 CarbonylContact O-C 3.57Å; V916-L919 WeakPolarHBondContact O-CA 3.42Å; V916-L919 PolarHBondContact O-N 3.09Å; T917-L919 PolarHBondContact O-N 2.99Å
920	I	58.2	Low	44.6	Very low	135 Å²	135	124.8 Å²	124.8	69%	0.692	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	-35.3	179.4	-69.1	-179.7	0	0	0	109.2	V916 T917	V916-I920 HydrophobicContact CG1-CD1 3.62Å; V916-I920 HydrophobicContact CG1-CG1 4.37Å; V916-I920 WeakPolarHBondContact O-CG1 3.33Å; V916-I920 PolarHBondContact O-N 3.31Å; T917-I920 PolarHBondContact O-N 3.38Å
921	N	53.4	Low	45.6	Very low	173 Å²	173	129.2 Å²	129.2	93%	0.925	67%	0.673	S	S	*	*			trans	-80.7	0	153.3	-57.9	-4.4	0	0	0	110.2	T917	T917-N921 WeakPolarHBondContact O-CB 3.36Å; T917-N921 PolarHBondContact O-N 2.67Å

Retrieved 921 of 921 residues in 113.6 ms (Link to these results)

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