A0A5K4F4B8_SCHMA Loading...

Zinc finger protein Sma-Zic

AlphaFold DB , UniProt , Accession A0A5K4F4B8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,417 aa.

						>A0A5K4F4B8_SCHMA|A0A5K4F4B8
MHTQLYNVLPPGVNTQSQSHLRSQTSHLSNTPLIYSHYYPNDTVSQSSHQHHHHHQQQHRELSQITTTTPPPQPGAGAAPSNYVANVPIIENYQLSNESRHVTDTNSLFPTIAPYTTNSLSTPSSLSSSSSSTSISSSTLMPETAIDYNNRGHLNYALSYLSNQTSNDKNFINSNSHHSLNHLQQINSSKESISANHLKLLYPQCYVTPPTLNEGLLDTSQSIGSCDTSVANIWPQSIISAQYSTNFLSSYSTGMAAAAAAAAVAVHSTSFDYTQPSMMLSPSRSNTTQLCRYLNDRHLGNNNNNSNICNKTIGRTKSINYLTSTPISSQVNVNSHISETNFPLSTYSSVSTSSSCLPSATCELYNVPQHILSNRLSMNQHVASTTLTSIPTGEVRNSINNELYYCQWIDPVPTIPGSIPKPCSRVFDSVTEIVNHITLEHVGGPEQLDHTCYWKDCIRDGKPFKAKYKLVNHIRVHTGEKPFPCPFSGCMKVFARSENLKIHKRTHTGEKPFVCEFEGCDRRFANSSDRKKHMHVHMNDKPYFCRFKGCDKSYTHPSSLRKHLRVHYLSPNDALNPTDYDTHSNSSDTTNNNNNNDNNQLNTNDSRTCTRINNMNMTEFLTRESHNSVNTTNYFYPMMNRDNVDCLRNTDYTGNNTTTTTTQNNNNNNCISTLNKMRKKTQNSPIQTSDFSLRKASRKRHYSTRNEYDSESFTHVNTNTTTNITNSSINIRSPSSKDFMSQLAAVVCGPTEKEFKFQRNNLNYNEFQETIQQHAENISQFRNDTFMWGQLDNDLPMTNNRNNNNKKTNTNLSYLSSNHNNIDPFLSSSRMYSSLNFGQSLSTLSQITPSSPTDIIAQHEMNMDSVKMKSDLLNLNRSYELHNNVINNSNSNPYGNLHHQQHEEQMDHLQHSSSQYALNEYTQNLFHANDLLMETQKNLGLIKHPYYYTQQQQQQQQQRQGPYCFLPSSHQYHSDNQQSQETQHFQRQQMNSSPKSCNNLYSLDTNLLYTCNNNSQSMHNLQPNHKHLTSDHLLIQQSQQHSIYSETSHQSNSTDSDLENSSILFKTNLSANNSFINNNNNNSNSITSCTGNILSTINNDHHHNNNLSMTNVPVISTPTIITSCETNSSTISLFNCKDSQLNENKLKGHLEGNNNSNNSNSNNSNNNNNSNSTDLSLSEPLTCGVQFPVTNSLSNWLSLNNRNGISVTNYLGWSMLNNDKTMITSNINNNIDELPHHSLDNNNHHQIDEINNIDCIPSTVHHQMKCCENFDNIPLSNNNNNNDNGFLNNDTEKDQSNQCTFTKNKIKDSIISPYISNCTFSYICNLDEHKLHNKEENDKRNKIIEHKNEYIDNYYSSSSSSSSTIIDCVNNSSTLCSMINNSVIHGNPNNSTAGPTPSLSPTTNTIANNDNDNSNNK
					

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(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	34.7	Very low	33.4	Very low	201 Å²	201	120.4 Å²	120.4	99%	0.99	64%	0.641	S	S	*	*				0	71.5	0	-46.6	-35.5	-178.2	0	0	108.2
2	H	34.9	Very low	33	Very low	154 Å²	154	116.8 Å²	116.8	71%	0.713	65%	0.653	S	S	*	*				72.2	80.8	87.9	-55.3	165	0	0	0	108
3	T	29	Very low	32.7	Very low	99 Å²	99	116.8 Å²	116.8	61%	0.607	66%	0.658	S	S	*	*			cis	62	145.8	39.9	-27.7	0	0	0	0	111.3
4	Q	34.3	Very low	32.4	Very low	85 Å²	85	118.7 Å²	118.7	40%	0.397	67%	0.666	S	S	.	*			trans	87.6	122.5	158.3	-32.9	-146.4	123.7	0	0	118.1	N320 Y321 L322	Q4-N320 WeakPolarHBondContact CA-ND2 3.32Å; Q4-N320 HydrophobicContact CB-CB 3.47Å; Q4-N320 VanDerWaalsContact CB-CB 3.47Å; Q4-N320 HydrophobicContact CG-CB 3.99Å; Q4-N320 VanDerWaalsContact CG-OD1 3.27Å; Q4-N320 WeakPolarHBondContact CG-OD1 3.4Å; Q4-N320 PolarHBondContact OE1-OD1 3.32Å; Q4-N320 VanDerWaalsContact OE1-OD1 3.09Å; Q4-Y321 WeakPolarHBondContact CB-O 3.47Å; Q4-Y321 VanDerWaalsContact NE2-N 3.2Å; Q4-Y321 PolarHBondContact NE2-O 3.44Å; Q4-L322 WeakPolarHBondContact O-CG 3.37Å
5	L	29.2	Very low	32.3	Very low	106 Å²	106	117.3 Å²	117.3	56%	0.555	66%	0.661	S	S	*	*			cis	88.1	158.7	0.1	-102.5	175.6	0	0	0	123.6	N320 Y321	L5-N320 VanDerWaalsContact C-CB 3.47Å; L5-N320 HydrophobicContact CB-CB 3.78Å; L5-N320 WeakPolarHBondContact CB-ND2 3.38Å; L5-N320 CarbonylContact O-C 3.5Å; L5-N320 WeakPolarHBondContact O-CB 3.34Å; L5-Y321 WeakPolarHBondContact O-CA 3.41Å; L5-Y321 WeakPolarHBondContact O-CB 3.44Å; L5-Y321 WeakPolarHBondContact O-CD1 3.46Å; L5-Y321 PolarHBondContact O-N 3.15Å
6	Y	28.5	Very low	32.1	Very low	94 Å²	94	120.9 Å²	120.9	37%	0.369	67%	0.671	S	S	.	*			trans	75.9	124.7	176.5	-96.5	-149.7	0	0	0	118.3	I319 Y321	Y6-I319 HydrophobicContact CD1-CG2 3.65Å; Y6-I319 HydrophobicContact CD2-CG2 3.63Å; Y6-I319 HydrophobicContact CE1-CG2 3.42Å; Y6-I319 VanDerWaalsContact CE1-CG2 3.42Å; Y6-I319 HydrophobicContact CE2-CG2 3.41Å; Y6-I319 VanDerWaalsContact CE2-CG2 3.41Å; Y6-I319 HydrophobicContact CG-CG2 3.76Å; Y6-Y321 WeakPolarHBondContact O-CD2 3.36Å; Y6-Y321 VanDerWaalsContact O-CE2 3.23Å; Y6-Y321 WeakPolarHBondContact O-CE2 3.42Å
7	N	34	Very low	31.9	Very low	114 Å²	114	119.2 Å²	119.2	61%	0.61	67%	0.669	S	S	*	*				72.5	132.1	79.5	-65.3	9.7	0	0	0	113.4
8	V	29.4	Very low	31.9	Very low	126 Å²	126	120 Å²	120	76%	0.764	67%	0.667	S	S	*	*				170.6	120.2	111.3	149.4	0	0	0	0	103.2
9	L	42.6	Very low	31.8	Very low	158 Å²	158	115.7 Å²	115.7	83%	0.827	65%	0.646	S	S	*	*			cis	53	107.1	44.6	-98.9	176.1	0	0	0	111.9
10	P	37.6	Very low	31.7	Very low	96 Å²	96	115.6 Å²	115.6	62%	0.623	64%	0.64	S	S	*	*				-145.1	-121.8	51	37.9	-13.2	0	0	0	111.7
11	P	33	Very low	31.4	Very low	91 Å²	91	116.9 Å²	116.9	59%	0.591	65%	0.645	S	S	*	*			cis	-128.3	152	-42.5	32.2	-14.4	0	0	0	116.5
12	G	29.1	Very low	31	Very low	77 Å²	77	117 Å²	117	79%	0.794	63%	0.634	S	S	*	*			trans	69.1	-172.3	156	0	0	0	0	0	117.2
13	V	29.5	Very low	30.6	Very low	117 Å²	117	113.4 Å²	113.4	71%	0.709	63%	0.626	S	S	*	*			cis	-144.4	125.8	-1	174.7	0	0	0	0	109.8
14	N	27.9	Very low	30.4	Very low	144 Å²	144	116.8 Å²	116.8	77%	0.77	64%	0.635	S	S	*	*			trans	62.3	158.6	158.4	-66.2	-7	0	0	0	119
15	T	30.2	Very low	30	Very low	97 Å²	97	118.7 Å²	118.7	60%	0.595	65%	0.653	S	S	*	*			cis	-153.5	147.2	-6.3	1.5	0	0	0	0	110.6
16	Q	29.2	Very low	29.8	Very low	176 Å²	176	117.8 Å²	117.8	82%	0.822	66%	0.656	S	S	*	*			trans	58.1	148.7	149.4	-70.7	150.4	-14.4	0	0	119.1
17	S	28.8	Very low	29.8	Very low	92 Å²	92	119.7 Å²	119.7	64%	0.643	67%	0.668	S	S	*	*			cis	-143	124.1	-3.2	43.3	0	0	0	0	109.1
18	Q	32.2	Very low	29.4	Very low	133 Å²	133	118.9 Å²	118.9	62%	0.621	66%	0.663	S	S	*	*				76.6	135.5	108.2	-70.7	175.7	-48.3	0	0	117.7	L1021 P1023	Q18-L1021 PolarHBondContact NE2-O 3.09Å; Q18-P1023 WeakPolarHBondContact O-CB 3.25Å
19	S	30.2	Very low	29.3	Very low	38 Å²	38	115 Å²	115	27%	0.266	64%	0.641	S	S	.	*			cis	-178.7	167.7	-13.6	46.2	0	0	0	0	111.7	Q1022 P1023	S19-Q1022 WeakPolarHBondContact OG-CA 3.26Å; S19-Q1022 PolarHBondContact OG-N 3.13Å; S19-P1023 WeakPolarHBondContact O-CB 3.01Å
20	H	29.1	Very low	28.7	Very low	113 Å²	113	109.5 Å²	109.5	52%	0.523	61%	0.613	S	S	.	*			trans	69.1	129.7	160.4	-55.1	-49.6	0	0	0	119.4	Q1022	H20-Q1022 HydrophobicContact CB-CG 4.23Å; H20-Q1022 PolarHBondContact CD2-N 3.18Å
21	L	27	Very low	28.7	Very low	143 Å²	143	108.5 Å²	108.5	75%	0.749	61%	0.605	S	S	*	*			cis	73.3	150.9	35.8	-55.7	159.7	0	0	0	112.5
22	R	25.9	Very low	28.7	Very low	204 Å²	204	108.8 Å²	108.8	77%	0.77	61%	0.606	S	S	*	*			cis	-152.1	131.1	12.9	-129.2	-171.9	-172.7	165.4	-0.9	106.8
23	S	25.5	Very low	28.7	Very low	78 Å²	78	112.2 Å²	112.2	55%	0.545	61%	0.606	S	S	.	*				76.6	130.6	94.5	79.5	0	0	0	0	119.7
24	Q	25.7	Very low	28.5	Very low	170 Å²	170	112.8 Å²	112.8	79%	0.794	60%	0.603	S	S	*	*			trans	82.5	144.6	136.9	-75.9	173.3	1.4	0	0	122.9
25	T	25.3	Very low	28.5	Very low	125 Å²	125	115.5 Å²	115.5	77%	0.767	60%	0.604	S	S	*	*			trans	58.2	121	150.2	46.9	0	0	0	0	118.6
26	S	25	Very low	28.5	Very low	88 Å²	88	115.1 Å²	115.1	62%	0.615	61%	0.606	S	S	*	*			cis	167.9	179	38.6	47	0	0	0	0	111.5
27	H	27.6	Very low	28.6	Very low	134 Å²	134	112.5 Å²	112.5	62%	0.62	59%	0.593	S	S	*	*			trans	56.5	84.4	158.4	-53.4	-60	0	0	0	120.7	K1305	H27-K1305 HydrophobicContact CB-CD 4.17Å; H27-K1305 PolarHBondContact O-NZ 3.5Å
28	L	27.3	Very low	28.6	Very low	97 Å²	97	119.2 Å²	119.2	51%	0.508	61%	0.606	S	S	.	*				54.2	163.2	120.2	-53.2	169.5	0	0	0	119.2	K1305 K1307	L28-K1305 HydrophobicContact CB-CB 4.07Å; L28-K1305 HydrophobicContact CB-CD 4.09Å; L28-K1305 HydrophobicContact CB-CG 4.43Å; L28-K1305 HydrophobicContact CD1-CB 4.25Å; L28-K1305 WeakPolarHBondContact O-CE 3.35Å; L28-K1305 PolarHBondContact O-NZ 3.08Å; L28-K1307 HydrophobicContact CD2-CB 3.68Å
29	S	27.6	Very low	28.8	Very low	43 Å²	43	120.5 Å²	120.5	30%	0.301	61%	0.606	S	S	.	*			cis	-166.8	165.9	39.2	53	0	0	0	0	117.4	I1306 K1307	S29-I1306 CarbonylContact C-O 3.33Å; S29-I1306 WeakPolarHBondContact CA-O 2.97Å; S29-I1306 WeakPolarHBondContact CB-O 3.38Å; S29-K1307 VanDerWaalsContact C-CD 3.46Å; S29-K1307 PolarHBondContact O-NZ 2.78Å
30	N	29.6	Very low	29	Very low	44 Å²	44	124.3 Å²	124.3	24%	0.235	63%	0.63	C	S	.	*			trans	46.1	127.2	162.1	-65.7	-10.6	0	0	0	120.6	I1306 K1307	N30-I1306 PolarHBondContact N-O 3.28Å; N30-I1306 VanDerWaalsContact OD1-C 3.28Å; N30-I1306 WeakPolarHBondContact OD1-CB 3.35Å; N30-I1306 PolarHBondContact OD1-N 3.07Å; N30-I1306 PolarHBondContact OD1-O 2.86Å; N30-K1307 PolarHBondContact O-NZ 3.33Å
31	T	36.1	Very low	28.9	Very low	75 Å²	75	124.5 Å²	124.5	46%	0.46	64%	0.635	S	S	.	*				20	161.6	101.7	15.8	0	0	0	0	120	D1308	T31-D1308 WeakPolarHBondContact CB-OD2 3.34Å; T31-D1308 VanDerWaalsContact CG2-CG 3.42Å; T31-D1308 WeakPolarHBondContact CG2-OD1 3.46Å; T31-D1308 WeakPolarHBondContact CG2-OD2 3.48Å; T31-D1308 PolarHBondContact N-OD2 2.75Å; T31-D1308 PolarHBondContact OG1-OD1 2.74Å; T31-D1308 PolarHBondContact OG1-OD2 3.12Å
32	P	33.9	Very low	29.2	Very low	96 Å²	96	124.2 Å²	124.2	62%	0.623	63%	0.634	S	S	*	*			cis	-140.7	-171.1	-0.8	31.8	-6.9	0	0	0	115.8
33	L	28.4	Very low	29.5	Very low	149 Å²	149	120.2 Å²	120.2	78%	0.78	63%	0.633	S	S	*	*			trans	68.9	166.9	157.5	-49.8	-171.7	0	0	0	116.7
34	I	26.7	Very low	29.7	Very low	129 Å²	129	121.6 Å²	121.6	66%	0.662	64%	0.637	S	S	*	*			cis	-155.4	132.1	-23.3	-112.2	170.5	0	0	0	105.3
35	Y	27.7	Very low	30	Very low	201 Å²	201	118.8 Å²	118.8	79%	0.788	64%	0.637	S	S	*	*				68.8	163.7	84.3	-142	-91.2	0	0	0	114.9
36	S	29.6	Very low	30.3	Very low	89 Å²	89	121.1 Å²	121.1	62%	0.622	64%	0.639	S	S	*	*			trans	68.7	153.2	171.4	72.2	0	0	0	0	117.7
37	H	30.9	Very low	30.6	Very low	121 Å²	121	122.2 Å²	122.2	56%	0.56	65%	0.647	S	S	*	*			cis	-163.7	164	-25.5	-105	-51.1	0	0	0	107.8	Y39	H37-Y39 AromaticContact CE1-CE2 3.67Å; H37-Y39 AromaticContact ND1-CE2 3.97Å
38	Y	30	Very low	30.5	Very low	233 Å²	233	120.2 Å²	120.2	91%	0.914	65%	0.648	S	S	*	*				-154	126.3	127.5	-114.4	-75.4	0	0	0	110.7
39	Y	35.7	Very low	30.7	Very low	160 Å²	160	123.9 Å²	123.9	63%	0.627	66%	0.662	S	S	*	*			trans	-88.4	170.4	165.1	-83.4	-90.6	0	0	0	109	H37	H37-Y39 AromaticContact CE1-CE2 3.67Å; H37-Y39 AromaticContact ND1-CE2 3.97Å
40	P	33.6	Very low	31	Very low	118 Å²	118	130.3 Å²	130.3	77%	0.766	69%	0.687	S	S	*	*				-129.3	175.4	81.2	6.4	17.4	0	0	0	112.7
41	N	28.2	Very low	30.9	Very low	117 Å²	117	136.5 Å²	136.5	63%	0.626	71%	0.714	S	S	*	*			cis	-173.9	-177.3	-35.2	-102.2	2.7	0	0	0	107.7
42	D	33	Very low	30.8	Very low	137 Å²	137	140.8 Å²	140.8	73%	0.733	73%	0.729	S	S	*	*			trans	74.6	138.2	155.1	-53.6	-40.3	0	0	0	118.4
43	T	32.6	Very low	30.8	Very low	120 Å²	120	143.8 Å²	143.8	74%	0.736	73%	0.734	S	S	*	*			cis	-151.6	144.1	-3.5	1.7	0	0	0	0	113.6
44	V	30.1	Very low	31.2	Very low	107 Å²	107	143.5 Å²	143.5	65%	0.648	73%	0.729	S	S	*	*			trans	9	124.7	141.9	-173.5	0	0	0	0	117.9	Q46	V44-Q46 HydrophobicContact CG1-CG 4.21Å
45	S	32.3	Very low	31.7	Very low	111 Å²	111	144 Å²	144	78%	0.776	73%	0.728	S	S	*	*				-166.9	133.6	90.2	-63.8	0	0	0	0	110
46	Q	30.1	Very low	32.3	Very low	174 Å²	174	141.3 Å²	141.3	81%	0.813	72%	0.723	S	S	*	*				84.4	149.2	53.1	-79.4	-158.2	0.4	0	0	115.8	V44	V44-Q46 HydrophobicContact CG1-CG 4.21Å
47	S	30.8	Very low	32.7	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	72%	0.722	S	S	*	*			trans	64.1	130.9	-169.7	76	0	0	0	0	117
48	S	27.3	Very low	33.1	Very low	92 Å²	92	144.5 Å²	144.5	64%	0.643	73%	0.728	S	S	*	*			cis	106.2	137.3	3.2	84.4	0	0	0	0	117.4
49	H	30.8	Very low	33.6	Very low	173 Å²	173	140.4 Å²	140.4	80%	0.801	72%	0.717	S	S	*	*			trans	75.8	158.3	175	-54	-26.3	0	0	0	114.5
50	Q	33.8	Very low	33.5	Very low	179 Å²	179	142.4 Å²	142.4	84%	0.836	72%	0.723	S	S	*	*			cis	-148.2	163.8	18.5	-148.2	152.3	37.4	0	0	113.5
51	H	27.9	Very low	33.5	Very low	173 Å²	173	143.3 Å²	143.3	80%	0.801	72%	0.717	S	S	*	*			trans	-73.6	155.8	176.4	-78	-104.8	0	0	0	113.4
52	H	34.4	Very low	33.7	Very low	165 Å²	165	144.9 Å²	144.9	76%	0.764	73%	0.725	S	S	*	*				-168	133.4	122.5	-101.1	62.2	0	0	0	108.6
53	H	33.1	Very low	33.6	Very low	159 Å²	159	142.3 Å²	142.3	74%	0.736	72%	0.717	S	S	*	*				55	141.6	94.8	-71.9	-56	0	0	0	114.8
54	H	35.7	Very low	33.7	Very low	143 Å²	143	144.5 Å²	144.5	66%	0.662	72%	0.719	S	S	*	*			cis	-166.6	149.4	35.7	-162.6	56.6	0	0	0	113.3
55	H	37.9	Very low	33.7	Very low	141 Å²	141	145.7 Å²	145.7	65%	0.653	72%	0.721	S	S	*	*			trans	52	155.2	159.1	-76.8	-20.5	0	0	0	120.9
56	Q	39.8	Very low	33.6	Very low	144 Å²	144	146.2 Å²	146.2	67%	0.673	72%	0.719	S	S	*	*			cis	-162.2	170.3	-7.9	-105.7	171.7	37.7	0	0	106.1
57	Q	39.7	Very low	33.6	Very low	130 Å²	130	143.4 Å²	143.4	61%	0.607	71%	0.714	S	S	*	*			cis	-142.9	165.2	-5.9	-112.9	-165.2	-58.4	0	0	106.2
58	Q	38.5	Very low	33.6	Very low	147 Å²	147	143.6 Å²	143.6	69%	0.687	71%	0.711	S	S	*	*				59.6	134.7	65.1	-49.5	-179.6	-17	0	0	115.5
59	H	40	Very low	33.8	Very low	147 Å²	147	145.1 Å²	145.1	68%	0.681	72%	0.716	S	S	*	*			cis	-125	157.1	0	-67	-106.2	0	0	0	110.1
60	R	34.4	Very low	34.1	Very low	201 Å²	201	142.6 Å²	142.6	76%	0.758	72%	0.715	S	S	*	*			cis	94.5	137.2	19.1	-147.9	-158.5	-165.4	-144	12.8	114.8
61	E	33.4	Very low	34.7	Very low	138 Å²	138	139.3 Å²	139.3	65%	0.645	71%	0.709	S	S	*	*			trans	82.3	156.1	163.4	-51.8	-176	-168.9	0	0	119.2
62	L	31.3	Very low	35.3	Very low	150 Å²	150	136.9 Å²	136.9	79%	0.785	71%	0.709	S	S	*	*				-174.3	142.9	-56.7	-114.4	166.2	0	0	0	111
63	S	32	Very low	35.5	Very low	82 Å²	82	137.8 Å²	137.8	57%	0.573	71%	0.714	S	S	*	*			trans	78.6	153.7	141.5	83.7	0	0	0	0	122.4
64	Q	35.4	Very low	35.8	Very low	167 Å²	167	136.5 Å²	136.5	78%	0.78	72%	0.72	S	S	*	*			trans	73.7	150	149.7	-71.7	170.9	94	0	0	120.2
65	I	30	Very low	35.7	Very low	132 Å²	132	133.1 Å²	133.1	68%	0.677	72%	0.723	S	S	*	*			cis	-167.7	165.9	-34.7	-131.2	175.4	0	0	0	108.4
66	T	29.9	Very low	35.6	Very low	121 Å²	121	131.4 Å²	131.4	74%	0.742	73%	0.733	S	S	*	*			trans	62.3	156.7	166.9	45.8	0	0	0	0	118.9
67	T	28.5	Very low	35.3	Very low	115 Å²	115	128.4 Å²	128.4	71%	0.706	74%	0.741	S	S	*	*			cis	-162.9	-174.2	-27.7	25.6	0	0	0	0	109.3
68	T	32.5	Very low	35.1	Very low	116 Å²	116	127.2 Å²	127.2	71%	0.712	75%	0.754	S	S	*	*			trans	75.5	92.8	152.9	50.2	0	0	0	0	122.3
69	T	30.5	Very low	34.8	Very low	124 Å²	124	124.1 Å²	124.1	76%	0.761	75%	0.753	S	S	*	*				45.3	150.9	101.1	62.5	0	0	0	0	122.5
70	P	38.4	Very low	34.6	Very low	121 Å²	121	122.9 Å²	122.9	79%	0.786	76%	0.758	S	S	*	*				-129	-109.3	-61.5	25	0.6	0	0	0	116.3
71	P	45.3	Very low	34.3	Very low	109 Å²	109	117.4 Å²	117.4	71%	0.708	75%	0.75	S	S	*	*				-121.5	-171.4	-128.9	43.8	-24.3	0	0	0	114.8
72	P	40.7	Very low	34.1	Very low	123 Å²	123	117.3 Å²	117.3	80%	0.799	75%	0.754	S	S	*	*				-152.8	172.7	87.1	40.2	-21	0	0	0	117.4
73	Q	38	Very low	34.1	Very low	183 Å²	183	120.3 Å²	120.3	86%	0.855	76%	0.757	S	S	*	*			trans	-102.6	165.3	158.1	-70.3	-173.6	-30.1	0	0	110.5
74	P	39.1	Very low	33.9	Very low	133 Å²	133	121.8 Å²	121.8	86%	0.864	76%	0.762	S	S	*	*				-139	170.6	95.2	37	-22.8	0	0	0	111.6
75	G	35.3	Very low	33.7	Very low	71 Å²	71	117.7 Å²	117.7	73%	0.732	76%	0.757	S	S	*	*			cis	147.6	176.8	23.7	0	0	0	0	0	106.7
76	A	35.7	Very low	33.7	Very low	105 Å²	105	118.9 Å²	118.9	87%	0.868	76%	0.764	S	S	*	*			cis	-164.4	154.9	-11.2	0	0	0	0	0	110.3
77	G	33	Very low	33.9	Very low	81 Å²	81	116.9 Å²	116.9	84%	0.835	75%	0.752	S	S	*	*			trans	82.8	148.9	165	0	0	0	0	0	117.2
78	A	34.3	Very low	34.1	Very low	106 Å²	106	116.2 Å²	116.2	88%	0.876	75%	0.75	S	S	*	*			cis	-156.6	156.5	-11.8	0	0	0	0	0	111.4
79	A	33.2	Very low	33.8	Very low	81 Å²	81	117 Å²	117	67%	0.669	75%	0.748	S	S	*	*			trans	-96.2	-179.2	169.6	0	0	0	0	0	110.2
80	P	34.9	Very low	33.6	Very low	121 Å²	121	116.8 Å²	116.8	79%	0.786	74%	0.741	S	S	*	*			cis	-121.4	172.3	43.7	15.4	9.5	0	0	0	113.7
81	S	30	Very low	33.1	Very low	86 Å²	86	119.3 Å²	119.3	60%	0.601	74%	0.742	S	S	*	*			cis	98.2	128.4	12.2	-52	0	0	0	0	117.7
82	N	28.6	Very low	32.1	Very low	136 Å²	136	119.7 Å²	119.7	73%	0.727	74%	0.738	S	S	*	*			trans	72.5	147.6	163	-47.8	-24.4	0	0	0	116.1
83	Y	30.1	Very low	31.4	Very low	214 Å²	214	122.9 Å²	122.9	84%	0.839	74%	0.736	S	S	*	*			cis	-121.3	150.5	20.9	-85	-116.7	0	0	0	112
84	V	28.6	Very low	30.9	Very low	113 Å²	113	120.7 Å²	120.7	69%	0.685	73%	0.726	S	S	*	*			cis	88.9	138.7	34.1	177.3	0	0	0	0	113.8
85	A	31	Very low	30.2	Very low	81 Å²	81	121 Å²	121	67%	0.669	72%	0.719	S	S	*	*			trans	78.8	135.1	-177.3	0	0	0	0	0	116.8
86	N	30.9	Very low	29.7	Very low	156 Å²	156	121.5 Å²	121.5	83%	0.834	71%	0.712	S	S	*	*			cis	-148.4	142.7	-8	-97.8	-15.8	0	0	0	113
87	V	33.9	Very low	29.3	Very low	80 Å²	80	122 Å²	122	49%	0.485	70%	0.7	S	S	.	*			trans	-129.4	175.7	150.9	-137.1	0	0	0	0	103.8	Y1009	V87-Y1009 HydrophobicContact CG1-CD1 3.93Å; V87-Y1009 HydrophobicContact CG1-CD2 4.26Å; V87-Y1009 HydrophobicContact CG1-CE1 4.31Å; V87-Y1009 HydrophobicContact CG1-CG 3.97Å; V87-Y1009 HydrophobicContact CG2-CD2 3.67Å; V87-Y1009 HydrophobicContact CG2-CE2 3.75Å; V87-Y1009 HydrophobicContact CG2-CG 4.23Å
88	P	33	Very low	29	Very low	100 Å²	100	125.6 Å²	125.6	65%	0.649	70%	0.695	S	S	*	*			cis	-143.1	-140.4	17.5	32.6	-3.9	0	0	0	113
89	I	26	Very low	28.7	Very low	133 Å²	133	124.3 Å²	124.3	68%	0.682	68%	0.679	S	S	*	*			trans	80	109.8	160.6	-66.4	157.5	0	0	0	113.9
90	I	25.4	Very low	28.4	Very low	120 Å²	120	130.1 Å²	130.1	62%	0.615	68%	0.684	S	S	*	*				69.1	117.5	61.5	-51.1	158.1	0	0	0	109.6
91	E	27.9	Very low	28.1	Very low	173 Å²	173	131.9 Å²	131.9	81%	0.808	68%	0.681	S	S	*	*				-167.7	140.9	93.9	-85.6	179.8	163.7	0	0	108.3
92	N	25.1	Very low	28	Very low	117 Å²	117	133.1 Å²	133.1	63%	0.626	69%	0.685	S	S	*	*				82.7	127.6	58.5	-89.1	-14.7	0	0	0	115.4
93	Y	26	Very low	27.9	Very low	191 Å²	191	131.6 Å²	131.6	75%	0.749	68%	0.681	S	S	*	*			trans	71.3	157.8	150.9	-76.4	-138.9	0	0	0	115.5
94	Q	26.4	Very low	27.9	Very low	136 Å²	136	127.5 Å²	127.5	64%	0.636	67%	0.673	S	S	*	*			cis	-163	163.3	-12.6	-125.6	-175.4	-15.7	0	0	109.7
95	L	25.7	Very low	27.8	Very low	140 Å²	140	127 Å²	127	73%	0.733	67%	0.671	S	S	*	*			trans	59.7	163.1	147.4	-66.8	169.5	0	0	0	118.6
96	S	24.9	Very low	27.7	Very low	82 Å²	82	130 Å²	130	57%	0.573	68%	0.675	S	S	*	*			cis	-172.8	-161.5	-34.7	54.5	0	0	0	0	108.2
97	N	27	Very low	27.6	Very low	115 Å²	115	126.8 Å²	126.8	62%	0.615	67%	0.665	S	S	*	*			trans	78.9	114.7	162.8	-65	33.8	0	0	0	116.7
98	E	26.3	Very low	27.5	Very low	157 Å²	157	130.5 Å²	130.5	73%	0.734	68%	0.682	S	S	*	*				75.4	133	92.3	-65	173.5	141.3	0	0	112.6
99	S	27.9	Very low	27.5	Very low	78 Å²	78	132.9 Å²	132.9	55%	0.545	68%	0.682	S	S	.	*				-170.4	146.8	57.8	-72.9	0	0	0	0	113.3
100	R	26.9	Very low	28	Very low	204 Å²	204	131.4 Å²	131.4	77%	0.77	68%	0.681	S	S	*	*			trans	67.6	157.6	140.1	-68.5	163.4	-143.2	-173.2	4.9	117.7
101	H	28.1	Very low	28.2	Very low	158 Å²	158	130 Å²	130	73%	0.731	68%	0.678	S	S	*	*			cis	-153.3	160.2	6.5	-125.5	-48.3	0	0	0	110.9
102	V	29.5	Very low	28.2	Very low	111 Å²	111	128.7 Å²	128.7	67%	0.673	68%	0.675	S	S	*	*			trans	66.2	106.3	159.4	176.6	0	0	0	0	114.6
103	T	26.1	Very low	28.5	Very low	105 Å²	105	127.4 Å²	127.4	64%	0.644	68%	0.681	S	S	*	*				66.7	148.7	57.1	85.9	0	0	0	0	112.9
104	D	28.4	Very low	29.2	Very low	127 Å²	127	122.4 Å²	122.4	68%	0.679	67%	0.672	S	S	*	*			cis	-148	138.7	15.9	-95.7	-61.4	0	0	0	113.3
105	T	27.9	Very low	29.5	Very low	103 Å²	103	125.8 Å²	125.8	63%	0.632	68%	0.68	S	S	*	*			trans	54	160.1	138.9	71.7	0	0	0	0	124.5
106	N	28.9	Very low	29.8	Very low	143 Å²	143	124.3 Å²	124.3	77%	0.765	68%	0.677	S	S	*	*			trans	75.6	141.5	146.9	-67.3	-28.7	0	0	0	119.2
107	S	28.9	Very low	30	Very low	89 Å²	89	126 Å²	126	62%	0.622	68%	0.684	S	S	*	*			cis	-170.1	159.8	-10	47.9	0	0	0	0	113.4
108	L	30.5	Very low	30.3	Very low	159 Å²	159	127.2 Å²	127.2	83%	0.832	69%	0.691	S	S	*	*			trans	79.2	107.8	146.6	-76.2	158.7	0	0	0	122.3
109	F	33.9	Very low	30.5	Very low	149 Å²	149	124.2 Å²	124.2	65%	0.654	69%	0.687	S	S	*	*				-39.4	-175.7	127.3	-80.2	-91.6	0	0	0	114.6
110	P	35.9	Very low	30.7	Very low	103 Å²	103	127.8 Å²	127.8	67%	0.669	70%	0.699	S	S	*	*			cis	-124.5	-179.4	8.6	13.1	15.7	0	0	0	114.4
111	T	30.7	Very low	30.9	Very low	90 Å²	90	122.1 Å²	122.1	55%	0.552	69%	0.691	S	S	*	*			cis	84.5	152.7	35.7	-31.9	0	0	0	0	115.3
112	I	27.9	Very low	31	Very low	145 Å²	145	120.8 Å²	120.8	74%	0.744	69%	0.694	S	S	*	*			trans	95.1	105	169.7	-52.8	162.6	0	0	0	114.9
113	A	31.2	Very low	31.6	Very low	90 Å²	90	120.7 Å²	120.7	74%	0.744	70%	0.695	S	S	*	*				70.3	168.4	59.4	0	0	0	0	0	115.2
114	P	40.5	Very low	32	Very low	87 Å²	87	120.4 Å²	120.4	57%	0.565	70%	0.698	S	S	*	*				-133.5	-143.4	-54.9	40.7	-24.3	0	0	0	113.2
115	Y	33.1	Very low	32.3	Very low	207 Å²	207	119.4 Å²	119.4	81%	0.812	70%	0.701	S	S	*	*			trans	85.2	150.7	168.3	-49.4	-60.8	0	0	0	117.9
116	T	31	Very low	32.5	Very low	109 Å²	109	121.4 Å²	121.4	67%	0.669	71%	0.707	S	S	*	*			cis	-168.1	158.3	-11.4	21	0	0	0	0	112.8
117	T	30.4	Very low	32.7	Very low	118 Å²	118	119.4 Å²	119.4	72%	0.724	70%	0.704	S	S	*	*			trans	64.8	158.2	150.9	51.7	0	0	0	0	119.3
118	N	31.5	Very low	32.9	Very low	140 Å²	140	120.5 Å²	120.5	75%	0.749	71%	0.712	S	S	*	*			cis	-158.3	165.8	-4.8	-119.2	-13.5	0	0	0	112.7
119	S	31.2	Very low	33.1	Very low	93 Å²	93	117.9 Å²	117.9	65%	0.65	71%	0.707	S	S	*	*			trans	10.6	157.5	147.3	70.4	0	0	0	0	123.1
120	L	31.3	Very low	33	Very low	154 Å²	154	115.4 Å²	115.4	81%	0.806	71%	0.708	S	S	*	*			cis	-169.6	160.8	19.4	-152.8	69.2	0	0	0	113.7
121	S	31.4	Very low	32.8	Very low	84 Å²	84	115.3 Å²	115.3	59%	0.587	71%	0.709	S	S	*	*			trans	51.4	111.2	143	58.1	0	0	0	0	126.4
122	T	31.4	Very low	32.8	Very low	130 Å²	130	116 Å²	116	80%	0.798	72%	0.718	S	S	*	*				40.7	166.1	113.8	59.3	0	0	0	0	124.4
123	P	41	Very low	33	Very low	109 Å²	109	114.6 Å²	114.6	71%	0.708	72%	0.716	S	S	*	*			cis	-144	-156.8	-31.7	38.6	-16.1	0	0	0	115.2
124	S	34.7	Very low	32.8	Very low	99 Å²	99	115 Å²	115	69%	0.692	71%	0.714	S	S	*	*			trans	94.5	114.8	157.5	-53.3	0	0	0	0	119
125	S	34	Very low	32.5	Very low	106 Å²	106	118 Å²	118	74%	0.741	72%	0.724	S	S	*	*				93.9	146.9	89.7	75.5	0	0	0	0	113.3
126	L	33.2	Very low	32.2	Very low	146 Å²	146	113 Å²	113	76%	0.764	72%	0.719	S	S	*	*			cis	-170.3	154.9	28.3	-132.9	157.5	0	0	0	110.6
127	S	32.6	Very low	32.2	Very low	101 Å²	101	112.5 Å²	112.5	71%	0.706	72%	0.72	S	S	*	*			trans	47.6	150.9	151.2	52	0	0	0	0	122.9
128	S	34.3	Very low	32.1	Very low	111 Å²	111	112.1 Å²	112.1	78%	0.776	72%	0.722	S	S	*	*			cis	-167.9	177.1	-3.2	43.7	0	0	0	0	112.5
129	S	32.9	Very low	31.9	Very low	105 Å²	105	111.4 Å²	111.4	73%	0.734	72%	0.723	S	S	*	*			trans	-37.7	177.4	174.6	61.5	0	0	0	0	119.8
130	S	33.3	Very low	31.8	Very low	97 Å²	97	114.4 Å²	114.4	68%	0.678	73%	0.731	S	S	*	*			cis	-164.1	144.9	26.9	-23.8	0	0	0	0	115.8
131	S	31.8	Very low	31.9	Very low	100 Å²	100	115.1 Å²	115.1	70%	0.699	73%	0.732	S	S	*	*			trans	33	130.3	135.3	63.4	0	0	0	0	125.5
132	S	30.6	Very low	31.9	Very low	106 Å²	106	115.6 Å²	115.6	74%	0.741	73%	0.733	S	S	*	*				76.6	163.2	125.4	73.6	0	0	0	0	120.1
133	T	31.1	Very low	31.7	Very low	114 Å²	114	117.6 Å²	117.6	70%	0.699	73%	0.733	S	S	*	*			cis	-148.8	136.9	14.5	25	0	0	0	0	108.5
134	S	28.5	Very low	31.1	Very low	98 Å²	98	117.8 Å²	117.8	69%	0.685	73%	0.733	S	S	*	*				69.7	169.5	77.7	83	0	0	0	0	116.7
135	I	32.4	Very low	30.8	Very low	151 Å²	151	117 Å²	117	77%	0.774	73%	0.732	S	S	*	*			trans	87	101.9	-169.5	-55.4	167.6	0	0	0	111.1
136	S	27.9	Very low	30.5	Very low	101 Å²	101	119 Å²	119	71%	0.706	73%	0.733	S	S	*	*				72.2	142.5	59.3	81.9	0	0	0	0	113.3
137	S	30.9	Very low	30.1	Very low	100 Å²	100	117.9 Å²	117.9	70%	0.699	73%	0.728	S	S	*	*			cis	-143.6	150.2	17.7	-69.2	0	0	0	0	108.7
138	S	28.5	Very low	29.7	Very low	110 Å²	110	122.1 Å²	122.1	77%	0.769	73%	0.729	S	S	*	*				69.3	141.9	59.8	-55.4	0	0	0	0	116.3
139	T	27.2	Very low	29.3	Very low	124 Å²	124	122.9 Å²	122.9	76%	0.761	73%	0.725	S	S	*	*			trans	83.6	133.5	159.1	15.1	0	0	0	0	121.8
140	L	29.8	Very low	29.1	Very low	156 Å²	156	123.3 Å²	123.3	82%	0.817	72%	0.719	S	S	*	*			trans	70.5	115.5	155.8	-61.6	164.3	0	0	0	116.3
141	M	32.4	Very low	28.8	Very low	170 Å²	170	130.7 Å²	130.7	84%	0.837	73%	0.732	S	S	*	*			cis	54.1	136.4	43.5	-66.6	-75.4	176.4	0	0	113.1
142	P	30.7	Very low	28.7	Very low	93 Å²	93	129.1 Å²	129.1	60%	0.604	73%	0.732	S	S	*	*			cis	-135.6	-156.7	28.9	41.7	-22.4	0	0	0	114
143	E	27.2	Very low	28.5	Very low	173 Å²	173	129.7 Å²	129.7	81%	0.808	72%	0.722	S	S	*	*			trans	65.1	143	157.9	-69	159.7	-166	0	0	117.8
144	T	30.2	Very low	28.3	Very low	113 Å²	113	131 Å²	131	69%	0.693	72%	0.724	S	S	*	*			cis	-143.4	140.3	-14.4	30.1	0	0	0	0	105.5
145	A	27	Very low	28.3	Very low	82 Å²	82	134.1 Å²	134.1	68%	0.678	73%	0.733	S	S	*	*				59.6	151.7	68.1	0	0	0	0	0	113.8
146	I	27.4	Very low	28	Very low	148 Å²	148	136.7 Å²	136.7	76%	0.759	74%	0.735	S	S	*	*			trans	78.2	125.2	177.2	-48.5	169.7	0	0	0	115
147	D	25.6	Very low	28	Very low	123 Å²	123	135.4 Å²	135.4	66%	0.658	73%	0.731	S	S	*	*			cis	-164.3	149	-26.8	-108.7	-7.3	0	0	0	111.4
148	Y	24.8	Very low	27.7	Very low	189 Å²	189	139 Å²	139	74%	0.741	74%	0.741	S	S	*	*			trans	43.3	157.9	141.4	-79.2	-110.1	0	0	0	124.5
149	N	25.7	Very low	27.6	Very low	128 Å²	128	139.2 Å²	139.2	68%	0.684	74%	0.742	S	S	*	*			trans	79.5	122.2	158.7	-60.8	-46.8	0	0	0	117.1
150	N	28.2	Very low	27.6	Very low	113 Å²	113	143.9 Å²	143.9	60%	0.604	75%	0.748	S	S	*	*				61.3	91.3	63.1	-70	-29.9	0	0	0	113.4
151	R	27.6	Very low	27.4	Very low	252 Å²	252	142.7 Å²	142.7	95%	0.951	74%	0.742	S	S	*	*			trans	-169.1	130.9	148.4	-113.5	161.5	179.5	147.9	0.6	113.6
152	G	28.4	Very low	27.2	Very low	68 Å²	68	136.9 Å²	136.9	70%	0.701	72%	0.718	S	S	*	*			trans	78.5	150	165.3	0	0	0	0	0	116.2
153	H	26.9	Very low	27.1	Very low	117 Å²	117	136.4 Å²	136.4	54%	0.542	71%	0.71	S	S	.	*	S	Bend	cis	49.6	123	5.5	-77.2	-64.6	0	0	0	116.8	P416 G417	H153-P416 PolarHBondContact CE1-O 3.26Å; H153-P416 PolarHBondContact ND1-O 2.88Å; H153-G417 VanDerWaalsContact CE1-C 3.48Å
154	L	26.9	Very low	27.4	Very low	141 Å²	141	135.8 Å²	135.8	74%	0.738	71%	0.707	S	S	*	*			trans	73	72.7	175.3	-56.4	169.9	0	0	0	116.3	Y156	L154-Y156 HydrophobicContact CD2-CD2 4.43Å
155	N	27.8	Very low	27.2	Very low	164 Å²	164	136.4 Å²	136.4	88%	0.877	71%	0.711	S	S	*	*				-126.8	122.5	103.5	-82.4	-41.3	0	0	0	105.6
156	Y	27	Very low	27.4	Very low	205 Å²	205	137.1 Å²	137.1	80%	0.804	71%	0.711	S	S	*	*			cis	68.1	145.2	33.4	-142.3	-90.7	0	0	0	113.1	L154	L154-Y156 HydrophobicContact CD2-CD2 4.43Å
157	A	27.1	Very low	27.6	Very low	75 Å²	75	136.7 Å²	136.7	62%	0.62	71%	0.71	S	S	*	*	S	Bend	trans	-86.9	163.1	-158.8	0	0	0	0	0	114.5
158	L	26.2	Very low	28	Very low	175 Å²	175	136.1 Å²	136.1	92%	0.916	71%	0.707	S	S	*	*			trans	72.8	95.3	164.1	-54	172.7	0	0	0	117.9
159	S	26.1	Very low	28.3	Very low	114 Å²	114	134.5 Å²	134.5	80%	0.797	70%	0.704	S	S	*	*			trans	-163.1	156.7	139.8	55	0	0	0	0	112.7
160	Y	26.2	Very low	28.5	Very low	222 Å²	222	134.4 Å²	134.4	87%	0.871	70%	0.703	S	S	*	*	S	Bend	trans	78.7	61.1	170.6	-84.6	-83.5	0	0	0	121.1
161	L	26.3	Very low	28.6	Very low	132 Å²	132	137.4 Å²	137.4	69%	0.691	71%	0.712	S	S	*	*	S	Bend	trans	-158	69.4	135	-124	175.6	0	0	0	112.8
162	S	28.6	Very low	28.9	Very low	48 Å²	48	131.4 Å²	131.4	34%	0.336	70%	0.697	S	S	.	*			trans	-158.4	129.4	174.2	42.6	0	0	0	0	113.9	T211	S162-T211 VanDerWaalsContact C-OG1 3.28Å; S162-T211 VanDerWaalsContact CB-OG1 3.25Å; S162-T211 WeakPolarHBondContact CB-OG1 3.42Å; S162-T211 PolarHBondContact O-OG1 3.14Å; S162-T211 WeakPolarHBondContact OG-CG2 3.49Å; S162-T211 PolarHBondContact OG-OG1 3.42Å
163	N	27.6	Very low	29	Very low	83 Å²	83	135 Å²	135	44%	0.444	70%	0.7	S	S	.	*			trans	53.7	115.5	167.9	-54.7	-14.2	0	0	0	119.1	P210 T211	N163-P210 WeakPolarHBondContact ND2-CB 3.43Å; N163-T211 WeakPolarHBondContact CB-OG1 3.43Å; N163-T211 PolarHBondContact ND2-N 2.76Å; N163-T211 VanDerWaalsContact ND2-N 3.19Å; N163-T211 PolarHBondContact ND2-O 2.96Å; N163-T211 PolarHBondContact ND2-OG1 2.95Å
164	Q	33.2	Very low	29.2	Very low	160 Å²	160	133.2 Å²	133.2	75%	0.748	70%	0.701	S	S	*	*				-147.3	159.6	100.2	-104.9	-179.4	46	0	0	110.6	N213	Q164-N213 PolarHBondContact NE2-ND2 3.38Å; Q164-N213 VanDerWaalsContact NE2-ND2 3.11Å; Q164-N213 PolarHBondContact NE2-OD1 3.36Å
165	T	27.3	Very low	29.4	Very low	125 Å²	125	133.8 Å²	133.8	77%	0.767	70%	0.704	S	S	*	*			trans	-125.6	137.9	-161.1	52	0	0	0	0	112.8
166	S	29.9	Very low	29.7	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	70%	0.701	S	S	*	*			trans	-177.1	136.5	145.5	55.4	0	0	0	0	113.1
167	N	32.7	Very low	29.8	Very low	138 Å²	138	130 Å²	130	74%	0.738	70%	0.701	S	S	*	*			trans	66.3	141.8	154.5	-49.4	-17.9	0	0	0	117.8
168	D	33.7	Very low	30	Very low	111 Å²	111	134.9 Å²	134.9	59%	0.594	71%	0.711	S	S	*	*			cis	-151.8	133.9	-9.6	-122	-27.4	0	0	0	114.5
169	K	30.5	Very low	30.3	Very low	155 Å²	155	131.3 Å²	131.3	67%	0.674	70%	0.7	S	S	*	*			trans	35.3	123.3	133.9	-74.8	-175.8	-152.5	85.3	0	123.2
170	N	31.2	Very low	30.5	Very low	126 Å²	126	133.2 Å²	133.2	67%	0.674	70%	0.701	S	S	*	*				101.9	151.7	125.9	-63.2	-11.5	0	0	0	122.3
171	F	30.4	Very low	30.6	Very low	177 Å²	177	129.2 Å²	129.2	78%	0.776	69%	0.694	S	S	*	*			trans	80.3	140.5	164.2	-65.4	-87.9	0	0	0	120.6
172	I	33.1	Very low	30.9	Very low	126 Å²	126	130.5 Å²	130.5	65%	0.646	70%	0.696	S	S	*	*			cis	-171.8	143.7	-44.1	-116.1	168.4	0	0	0	111.6
173	N	29.5	Very low	30.9	Very low	144 Å²	144	134 Å²	134	77%	0.77	71%	0.711	S	S	*	*			trans	57.8	162.1	155.8	-74.9	-0.8	0	0	0	121.9
174	S	32.1	Very low	31	Very low	78 Å²	78	136.7 Å²	136.7	55%	0.545	72%	0.721	S	S	.	*			cis	-176.9	156.8	-24.9	58.6	0	0	0	0	112.8
175	N	31	Very low	30.9	Very low	153 Å²	153	136.3 Å²	136.3	82%	0.818	72%	0.719	S	S	*	*			trans	71.4	159.6	155.2	-55.1	-26.4	0	0	0	117.5
176	S	33.3	Very low	31	Very low	114 Å²	114	137.2 Å²	137.2	80%	0.797	72%	0.718	S	S	*	*			cis	-144.6	168.5	12.7	57.5	0	0	0	0	115.1
177	H	30.5	Very low	31	Very low	177 Å²	177	139.5 Å²	139.5	82%	0.819	72%	0.722	S	S	*	*			trans	-86	161.3	179.3	-69.5	-125.3	0	0	0	114.5
178	H	31.5	Very low	30.8	Very low	177 Å²	177	138.7 Å²	138.7	82%	0.819	73%	0.727	S	S	*	*				-169.7	149.8	115.6	-123.3	-78.1	0	0	0	117.2
179	S	32.7	Very low	30.7	Very low	100 Å²	100	139.1 Å²	139.1	70%	0.699	74%	0.739	S	S	*	*			trans	50.4	130.3	158.9	-57.9	0	0	0	0	121.2
180	L	29.8	Very low	30.7	Very low	153 Å²	153	141.2 Å²	141.2	80%	0.801	75%	0.748	S	S	*	*			cis	92	132	25.2	-91.3	164.8	0	0	0	119
181	N	28	Very low	30.6	Very low	138 Å²	138	144.5 Å²	144.5	74%	0.738	76%	0.759	S	S	*	*			trans	73.9	150.6	170	-60.5	-41.9	0	0	0	116.7
182	H	31.6	Very low	30.4	Very low	159 Å²	159	141 Å²	141	74%	0.736	76%	0.757	S	S	*	*			cis	-150.8	139.5	22.4	-159.5	-114.3	0	0	0	112.7
183	L	28.8	Very low	30.2	Very low	122 Å²	122	143.2 Å²	143.2	64%	0.639	77%	0.768	S	S	*	*			trans	18.6	146.2	141.6	-67.5	173.8	0	0	0	121.2
184	Q	30.4	Very low	30.1	Very low	140 Å²	140	141.5 Å²	141.5	65%	0.654	77%	0.768	S	S	*	*			cis	-177.9	172.6	-5.6	-150.9	-176.9	27.1	0	0	109.8
185	Q	30.8	Very low	29.9	Very low	151 Å²	151	142.4 Å²	142.4	71%	0.706	78%	0.78	S	S	*	*			trans	70.3	150	160.4	-62.9	174.8	49.4	0	0	116.8
186	I	30.6	Very low	29.7	Very low	144 Å²	144	142.2 Å²	142.2	74%	0.738	78%	0.779	S	S	*	*			cis	-142.5	172.6	1.7	-126	158.8	0	0	0	111.4
187	N	28.5	Very low	29.4	Very low	147 Å²	147	144.6 Å²	144.6	79%	0.786	78%	0.777	S	S	*	*			trans	-91.9	174.8	-163.5	-62.6	-58.1	0	0	0	117.3
188	S	28.4	Very low	29.3	Very low	120 Å²	120	141 Å²	141	84%	0.839	76%	0.763	S	S	*	*			trans	94.3	142.4	152	-55.5	0	0	0	0	117.3
189	S	31.9	Very low	29.4	Very low	120 Å²	120	140.7 Å²	140.7	84%	0.839	76%	0.76	S	S	*	*			cis	-141.9	173.1	-0.9	51.2	0	0	0	0	112.1
190	K	30.2	Very low	29.3	Very low	200 Å²	200	140.3 Å²	140.3	87%	0.87	75%	0.749	S	S	*	*			trans	-101.4	153.9	-177.1	-56.7	170.9	-179.7	173.8	0	111.4
191	E	28.7	Very low	29.3	Very low	194 Å²	194	138.5 Å²	138.5	91%	0.907	74%	0.74	S	S	*	*				-151.1	178	129.7	-128.7	167.8	-142.1	0	0	113.2
192	S	27.6	Very low	29.4	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	75%	0.746	S	S	*	*			trans	-77.2	138	-150.9	53.8	0	0	0	0	117.6
193	I	28	Very low	29.5	Very low	172 Å²	172	139.9 Å²	139.9	88%	0.882	74%	0.743	S	S	*	*			trans	-127.1	118.2	147.9	-60.8	178.8	0	0	0	107.9
194	S	28.8	Very low	29.4	Very low	109 Å²	109	141.8 Å²	141.8	76%	0.762	75%	0.749	S	S	*	*			trans	-102.7	115.9	179.4	47.5	0	0	0	0	112.4	N196	S194-N196 PolarHBondContact O-N 3.21Å
195	A	26.6	Very low	29.2	Very low	96 Å²	96	141.2 Å²	141.2	79%	0.793	76%	0.759	S	S	*	*	S	Bend	trans	42.9	74.8	150.5	0	0	0	0	0	118
196	N	26.4	Very low	28.9	Very low	149 Å²	149	143.5 Å²	143.5	80%	0.797	76%	0.763	S	S	*	*			trans	-152.5	134.3	143.9	-107.3	-37.7	0	0	0	111.9	S194	S194-N196 PolarHBondContact O-N 3.21Å
197	H	27.8	Very low	28.9	Very low	165 Å²	165	143.6 Å²	143.6	76%	0.764	77%	0.769	S	S	*	*			trans	50.9	106.1	174.8	-68.5	-86.6	0	0	0	119.5
198	L	28.5	Very low	28.9	Very low	101 Å²	101	140.6 Å²	140.6	53%	0.529	76%	0.756	S	S	.	*				-175.4	115.5	128.2	-106	168	0	0	0	112.1	N1217	L198-N1217 HydrophobicContact CD2-CB 4.41Å
199	K	33.6	Very low	29	Very low	171 Å²	171	140.3 Å²	140.3	74%	0.743	75%	0.752	S	S	*	*				180	145.5	116.4	-104.1	-173.8	175.8	-173.2	0	115.5
200	L	31.1	Very low	29.1	Very low	91 Å²	91	139.7 Å²	139.7	48%	0.476	75%	0.745	S	S	.	*			trans	-144.4	175.3	161.8	-62.8	96.6	0	0	0	106	N1217	L200-N1217 HydrophobicContact CD1-CB 4.24Å
201	L	30	Very low	29	Very low	116 Å²	116	133.2 Å²	133.2	61%	0.607	72%	0.722	S	S	*	*			cis	-130.2	137.4	-1.7	-80.2	84.7	0	0	0	108.9
202	Y	29.3	Very low	29.4	Very low	220 Å²	220	132.4 Å²	132.4	86%	0.863	72%	0.723	S	S	*	*			trans	60.6	178.2	153.6	-83.1	-104.5	0	0	0	117.4
203	P	33.8	Very low	29.6	Very low	106 Å²	106	131.3 Å²	131.3	69%	0.688	71%	0.709	S	S	*	*			cis	-121.3	176.4	-14.8	38.4	-24.1	0	0	0	114.6
204	Q	26.8	Very low	29.9	Very low	161 Å²	161	131.6 Å²	131.6	75%	0.752	71%	0.707	S	S	*	*			trans	34.8	113.8	145.4	-66.4	-75.1	9.1	0	0	120.7
205	C	25.3	Very low	30.1	Very low	128 Å²	128	130 Å²	130	87%	0.865	71%	0.707	S	S	*	*				176.5	149.5	117.8	-98.9	0	0	0	0	113.7
206	Y	25.7	Very low	30.4	Very low	200 Å²	200	133 Å²	133	78%	0.784	71%	0.71	S	S	*	*			trans	-89.2	140.9	174	-78.9	-116.1	0	0	0	112
207	V	29.7	Very low	30.8	Very low	145 Å²	145	132.8 Å²	132.8	88%	0.879	71%	0.708	S	S	*	*			trans	-150.2	141.9	146.4	-174.5	0	0	0	0	109.7
208	T	28.2	Very low	30.9	Very low	84 Å²	84	131 Å²	131	52%	0.515	70%	0.703	S	S	.	*			trans	-112.2	150.6	179.5	48.4	0	0	0	0	113.4
209	P	31.2	Very low	31	Very low	114 Å²	114	131.6 Å²	131.6	74%	0.74	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-83.6	164.3	161.5	-13.3	31.2	0	0	0	113.3
210	P	33.5	Very low	30.9	Very low	107 Å²	107	127.9 Å²	127.9	70%	0.695	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-101.1	164.3	-152.7	37.8	-37.4	0	0	0	117.5	N163	N163-P210 WeakPolarHBondContact ND2-CB 3.43Å
211	T	28.9	Very low	31.1	Very low	65 Å²	65	132.2 Å²	132.2	40%	0.399	73%	0.725	S	S	.	*	P	Polyproline II helix	trans	-101.5	158.6	169.8	27.9	0	0	0	0	113.3	S162 N163	S162-T211 VanDerWaalsContact C-OG1 3.28Å; S162-T211 VanDerWaalsContact CB-OG1 3.25Å; S162-T211 WeakPolarHBondContact CB-OG1 3.42Å; S162-T211 PolarHBondContact O-OG1 3.14Å; S162-T211 WeakPolarHBondContact OG-CG2 3.49Å; S162-T211 PolarHBondContact OG-OG1 3.42Å; N163-T211 WeakPolarHBondContact CB-OG1 3.43Å; N163-T211 PolarHBondContact ND2-N 2.76Å; N163-T211 VanDerWaalsContact ND2-N 3.19Å; N163-T211 PolarHBondContact ND2-O 2.96Å; N163-T211 PolarHBondContact ND2-OG1 2.95Å
212	L	36	Very low	31.2	Very low	176 Å²	176	130.6 Å²	130.6	92%	0.921	72%	0.723	S	S	*	*			trans	-126.5	167.8	162.1	-98.4	166.5	0	0	0	110
213	N	32	Very low	31.3	Very low	82 Å²	82	128.2 Å²	128.2	44%	0.439	72%	0.724	S	S	.	*			trans	-113.3	164.7	-143	-119.9	23.7	0	0	0	116.4	Q164	Q164-N213 PolarHBondContact NE2-ND2 3.38Å; Q164-N213 VanDerWaalsContact NE2-ND2 3.11Å; Q164-N213 PolarHBondContact NE2-OD1 3.36Å
214	E	33.9	Very low	31.4	Very low	177 Å²	177	126.8 Å²	126.8	83%	0.827	73%	0.728	S	S	*	*			trans	70.2	144.3	146.3	-72.7	161.6	-119.9	0	0	122.7
215	G	34.2	Very low	31.6	Very low	75 Å²	75	124.4 Å²	124.4	77%	0.773	73%	0.73	S	S	*	*			trans	149.9	78.6	143.6	0	0	0	0	0	120.5
216	L	32.4	Very low	31.9	Very low	161 Å²	161	125 Å²	125	84%	0.843	73%	0.734	S	S	*	*			trans	48.9	116	148.6	-102.3	65.6	0	0	0	123.7
217	L	34.1	Very low	32	Very low	144 Å²	144	122.6 Å²	122.6	75%	0.754	73%	0.734	S	S	*	*				50	144.5	123.1	-88.4	71.8	0	0	0	125.7
218	D	31.3	Very low	32.2	Very low	126 Å²	126	121.1 Å²	121.1	67%	0.674	73%	0.726	S	S	*	*			trans	89	100.1	142.8	-77.9	-31.3	0	0	0	124.4
219	T	30.2	Very low	32.1	Very low	114 Å²	114	122.2 Å²	122.2	70%	0.699	74%	0.737	S	S	*	*				21.8	128.3	126.6	66.4	0	0	0	0	120.4
220	S	32.3	Very low	32.3	Very low	94 Å²	94	124 Å²	124	66%	0.657	75%	0.745	S	S	*	*				159	148.5	92.4	57.1	0	0	0	0	113.5
221	Q	33.8	Very low	32.3	Very low	181 Å²	181	122.4 Å²	122.4	85%	0.846	74%	0.741	S	S	*	*			trans	59.9	160.2	149	-68.8	168.9	19.9	0	0	119.8
222	S	32.5	Very low	32.3	Very low	82 Å²	82	126.7 Å²	126.7	57%	0.573	76%	0.761	S	S	*	*			cis	-171.5	151.1	-32.5	59.2	0	0	0	0	110.3
223	I	32.3	Very low	32.2	Very low	170 Å²	170	125.8 Å²	125.8	87%	0.872	76%	0.756	S	S	*	*			trans	65.6	138.2	154.9	-61.7	155	0	0	0	116.7
224	G	35	Very low	32.1	Very low	76 Å²	76	132.9 Å²	132.9	78%	0.784	78%	0.777	S	S	*	*			trans	168.4	29.5	175.7	0	0	0	0	0	118
225	S	30.8	Very low	32.4	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	77%	0.766	S	S	*	*			trans	-80.2	131.8	175.5	54	0	0	0	0	112.3
226	C	32.5	Very low	32.5	Very low	141 Å²	141	133.2 Å²	133.2	95%	0.953	77%	0.766	S	S	*	*			trans	-159	159.3	148.4	-100.5	0	0	0	0	110.2
227	D	27.9	Very low	32.4	Very low	149 Å²	149	129.5 Å²	129.5	80%	0.797	75%	0.754	S	S	*	*			trans	-123.1	-177.4	-156	-145.8	-35	0	0	0	112.6
228	T	33.3	Very low	32.4	Very low	114 Å²	114	130.4 Å²	130.4	70%	0.699	76%	0.757	S	S	*	*			trans	65.4	104.4	160.2	51.9	0	0	0	0	119.2
229	S	26.8	Very low	32.4	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	76%	0.763	S	S	*	*				23.6	131.2	126.9	61.7	0	0	0	0	121.2
230	V	33.9	Very low	32.6	Very low	151 Å²	151	131.5 Å²	131.5	92%	0.915	77%	0.766	S	S	*	*				-162.9	161.3	119.1	134	0	0	0	0	110.7
231	A	33.5	Very low	32.6	Very low	74 Å²	74	131.8 Å²	131.8	61%	0.612	77%	0.774	S	S	*	*			trans	-85.3	170.7	-161.7	0	0	0	0	0	117.4
232	N	28.5	Very low	32.5	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	77%	0.768	S	S	*	*			trans	87.7	160	151.5	-61.2	-36.1	0	0	0	120.9
233	I	34.8	Very low	32.4	Very low	157 Å²	157	136.1 Å²	136.1	81%	0.805	78%	0.778	S	S	*	*			trans	91.7	98.7	172.9	-52.7	164.6	0	0	0	113.4
234	W	30.3	Very low	32.4	Very low	232 Å²	232	132 Å²	132	88%	0.879	77%	0.765	S	S	*	*				75	147.5	68.1	-94.5	61.8	0	0	0	114.8
235	P	39.9	Very low	32.1	Very low	92 Å²	92	133.6 Å²	133.6	60%	0.597	76%	0.759	S	S	*	*				-139.2	-137.5	-109.9	41.8	-19.6	0	0	0	113.1
236	Q	35.7	Very low	32	Very low	167 Å²	167	135 Å²	135	78%	0.78	76%	0.758	S	S	*	*			trans	77.4	136.5	174.7	-59.9	-151.1	-0.6	0	0	115.8
237	S	29.8	Very low	31.9	Very low	83 Å²	83	137 Å²	137	58%	0.58	75%	0.751	S	S	*	*			cis	109.2	92.6	15.2	77.8	0	0	0	0	114.9
238	I	35.8	Very low	32.3	Very low	162 Å²	162	136.1 Å²	136.1	83%	0.831	75%	0.745	S	S	*	*			trans	-141.8	112.9	169.5	-60.1	177.7	0	0	0	103.6
239	I	31.7	Very low	32.2	Very low	155 Å²	155	135.4 Å²	135.4	80%	0.795	75%	0.745	S	S	*	*				63	84.9	51.8	-48.3	-177.7	0	0	0	113.7
240	S	33.5	Very low	32.6	Very low	109 Å²	109	135 Å²	135	76%	0.762	74%	0.742	S	S	*	*			trans	-164.7	112.5	140.6	57.2	0	0	0	0	110.7
241	A	31.9	Very low	32.8	Very low	100 Å²	100	138.6 Å²	138.6	83%	0.826	74%	0.741	S	S	*	*			trans	-92.7	126.1	163.3	0	0	0	0	0	108.5
242	Q	32.2	Very low	32.8	Very low	154 Å²	154	139.7 Å²	139.7	72%	0.72	74%	0.744	S	S	*	*			trans	-168	157.1	170.9	-110.3	167.4	9.3	0	0	110.9
243	Y	30.9	Very low	33.2	Very low	199 Å²	199	138.5 Å²	138.5	78%	0.78	74%	0.743	S	S	*	*			trans	30.1	135.6	155.4	-55.9	-56.7	0	0	0	120.3
244	S	30.6	Very low	33.3	Very low	84 Å²	84	134 Å²	134	59%	0.587	73%	0.734	S	S	*	*			cis	158.4	142.4	-8.4	45.8	0	0	0	0	105.6
245	T	29.3	Very low	33.3	Very low	110 Å²	110	131.5 Å²	131.5	68%	0.675	74%	0.735	S	S	*	*			trans	43.5	128	147.1	60.4	0	0	0	0	121.6
246	N	28.2	Very low	32.8	Very low	140 Å²	140	132 Å²	132	75%	0.749	75%	0.747	S	S	*	*			trans	82	155.4	147.5	-54.3	-24	0	0	0	120
247	F	32.4	Very low	32.6	Very low	183 Å²	183	128.5 Å²	128.5	80%	0.803	75%	0.746	S	S	*	*			trans	109.7	123.7	163.4	-78.4	-104.3	0	0	0	115.4
248	L	34.5	Very low	32.6	Very low	131 Å²	131	129 Å²	129	69%	0.686	76%	0.755	S	S	*	*			cis	-166.4	159.7	-22.7	-123.5	-166.4	0	0	0	108
249	S	31.1	Very low	32.3	Very low	100 Å²	100	124.8 Å²	124.8	70%	0.699	75%	0.745	S	S	*	*			trans	30.1	142.5	151	59.6	0	0	0	0	121.8
250	S	36.9	Very low	32.1	Very low	97 Å²	97	119.7 Å²	119.7	68%	0.678	73%	0.726	S	S	*	*			cis	-161.3	151.6	6.7	43.3	0	0	0	0	107.7
251	Y	36.9	Very low	31.9	Very low	227 Å²	227	116.4 Å²	116.4	89%	0.89	71%	0.705	S	S	*	*				-150.1	159.6	63.4	-110.8	-101.8	0	0	0	113.1
252	S	33.8	Very low	31.8	Very low	97 Å²	97	114.2 Å²	114.2	68%	0.678	69%	0.687	S	S	*	*			trans	-93.9	177.3	178.5	62.2	0	0	0	0	111.6
253	T	36.3	Very low	31.9	Very low	130 Å²	130	109.7 Å²	109.7	80%	0.798	68%	0.676	S	S	*	*			cis	-161.3	157.4	20.2	-27.5	0	0	0	0	110.9
254	G	37.9	Very low	32	Very low	61 Å²	61	103.9 Å²	103.9	63%	0.629	66%	0.661	S	S	*	*			trans	90.6	103.6	170.1	0	0	0	0	0	113.6
255	M	29.7	Very low	32.3	Very low	181 Å²	181	104.1 Å²	104.1	89%	0.892	67%	0.668	S	S	*	*			cis	59	105.3	48.3	-50	-173.9	-178.3	0	0	111.5
256	A	30.6	Very low	32.6	Very low	103 Å²	103	103.6 Å²	103.6	85%	0.851	67%	0.665	S	S	*	*				79.4	150	82.4	0	0	0	0	0	112.3
257	A	31.3	Very low	32.9	Very low	92 Å²	92	104.7 Å²	104.7	76%	0.76	67%	0.665	S	S	*	*			cis	-154.4	-179.6	11.3	0	0	0	0	0	111.7
258	A	29.7	Very low	32.9	Very low	93 Å²	93	100.6 Å²	100.6	77%	0.769	66%	0.659	S	S	*	*			trans	64.7	144.3	163.2	0	0	0	0	0	116.4
259	A	28.3	Very low	33	Very low	74 Å²	74	101.1 Å²	101.1	61%	0.612	67%	0.668	S	S	*	*			cis	73.8	120.6	31.5	0	0	0	0	0	114.7
260	A	28.4	Very low	33.1	Very low	48 Å²	48	101.4 Å²	101.4	40%	0.397	67%	0.67	S	S	.	*			cis	-166.9	177.9	-21.4	0	0	0	0	0	109	Y347	A260-Y347 WeakPolarHBondContact O-CE1 3.32Å
261	A	28.9	Very low	33.2	Very low	40 Å²	40	107 Å²	107	33%	0.331	68%	0.683	S	S	.	*			trans	68.6	140.3	-171.8	0	0	0	0	0	114.9	Y347 S348	A261-Y347 HydrophobicContact CB-CD1 3.44Å; A261-Y347 VanDerWaalsContact CB-CD1 3.44Å; A261-Y347 HydrophobicContact CB-CE1 3.69Å; A261-Y347 HydrophobicContact CB-CG 3.89Å; A261-S348 VanDerWaalsContact CB-OG 3.26Å; A261-S348 WeakPolarHBondContact CB-OG 3.37Å; A261-S348 PolarHBondContact N-OG 2.94Å
262	A	30.9	Very low	32.9	Very low	55 Å²	55	103 Å²	103	46%	0.455	68%	0.677	S	S	.	*			cis	82.9	131.7	46.3	0	0	0	0	0	111.9	T346 Y347	A262-T346 HydrophobicContact CB-CG2 4.16Å; A262-T346 WeakPolarHBondContact CB-OG1 3.31Å; A262-Y347 WeakPolarHBondContact O-CE2 3.26Å; A262-Y347 PolarHBondContact O-OH 3.03Å
263	A	33.8	Very low	33.1	Very low	58 Å²	58	108.4 Å²	108.4	48%	0.479	68%	0.683	S	S	.	*			cis	-164.2	167	35.6	0	0	0	0	0	116.1	T346	A263-T346 HydrophobicContact CB-CG2 4.21Å; A263-T346 WeakPolarHBondContact CB-OG1 3.25Å
264	V	33.2	Very low	33	Very low	77 Å²	77	107.5 Å²	107.5	47%	0.467	68%	0.678	S	S	.	*			trans	54	121.8	136.4	176.2	0	0	0	0	121.9	V266 L344	V264-V266 HydrophobicContact CG1-CG2 4.35Å; V264-L344 HydrophobicContact CB-CD1 4.43Å; V264-L344 HydrophobicContact CG1-CB 4.15Å; V264-L344 HydrophobicContact CG1-CD1 3.7Å; V264-L344 HydrophobicContact CG1-CG 4.48Å; V264-L344 HydrophobicContact CG2-CB 4.16Å; V264-L344 HydrophobicContact CG2-CD1 3.74Å; V264-L344 HydrophobicContact CG2-CD2 3.91Å; V264-L344 HydrophobicContact CG2-CG 4.13Å
265	A	36.6	Very low	32.9	Very low	89 Å²	89	112.1 Å²	112.1	74%	0.736	68%	0.683	S	S	*	*				-170.7	116.2	129	0	0	0	0	0	108.5
266	V	34.5	Very low	32.9	Very low	100 Å²	100	108.9 Å²	108.9	61%	0.606	68%	0.675	S	S	*	*				78.1	134.5	77.3	167.6	0	0	0	0	111.7	V264	V264-V266 HydrophobicContact CG1-CG2 4.35Å
267	H	35.5	Very low	33.1	Very low	162 Å²	162	109 Å²	109	75%	0.75	67%	0.67	S	S	*	*			cis	-125.8	150.6	9.1	-100	-57.1	0	0	0	110.7
268	S	32.7	Very low	32.9	Very low	97 Å²	97	113.1 Å²	113.1	68%	0.678	68%	0.676	S	S	*	*				63.1	145.2	81.7	-43.2	0	0	0	0	114.7
269	T	35.9	Very low	32.9	Very low	143 Å²	143	117.2 Å²	117.2	88%	0.877	68%	0.681	S	S	*	*			cis	-137.5	-177.6	29.5	49.7	0	0	0	0	114.9
270	S	32.7	Very low	33	Very low	105 Å²	105	121.7 Å²	121.7	73%	0.734	69%	0.694	S	S	*	*			trans	-125.8	176.9	-165.2	52.4	0	0	0	0	114.5
271	F	39.9	Very low	33	Very low	216 Å²	216	124.6 Å²	124.6	95%	0.947	71%	0.711	S	S	*	*			trans	-143.4	146.8	155.8	-106.8	-81.8	0	0	0	109.6
272	D	30.7	Very low	33.3	Very low	143 Å²	143	128.1 Å²	128.1	77%	0.765	73%	0.731	S	S	*	*			trans	-153.3	149.6	-163.6	-168.8	5.7	0	0	0	112.6
273	Y	37.9	Very low	33.1	Very low	209 Å²	209	130.5 Å²	130.5	82%	0.82	74%	0.744	S	S	*	*			trans	173.5	141.3	172.6	-123.9	-126	0	0	0	108.1
274	T	33.5	Very low	32.9	Very low	112 Å²	112	137.6 Å²	137.6	69%	0.687	76%	0.759	S	S	*	*			cis	-160.2	-179.3	-10.9	16.8	0	0	0	0	108.5
275	Q	35.7	Very low	32.7	Very low	158 Å²	158	137 Å²	137	74%	0.738	76%	0.758	S	S	*	*			trans	-139.4	171.4	172.5	-146.3	-159	78.1	0	0	111.2
276	P	31	Very low	32.4	Very low	112 Å²	112	139 Å²	139	73%	0.727	76%	0.756	S	S	*	*				-150.3	173.1	85.3	40.2	-22.3	0	0	0	117.2
277	S	33.2	Very low	32.2	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	75%	0.746	S	S	*	*			trans	104.6	68	150.5	-53	0	0	0	0	118.9
278	M	27	Very low	32	Very low	178 Å²	178	134.5 Å²	134.5	88%	0.877	74%	0.74	S	S	*	*			trans	-89.5	142.1	133.9	-77.4	-171.7	171.1	0	0	109.5
279	M	31.5	Very low	31.9	Very low	180 Å²	180	137.8 Å²	137.8	89%	0.887	75%	0.745	S	S	*	*			trans	-136	117.2	161.7	-105.8	-164.1	164.5	0	0	111.6
280	L	30.4	Very low	31.4	Very low	168 Å²	168	138 Å²	138	88%	0.88	74%	0.74	S	S	*	*			trans	-109.6	128.7	162.6	-88.5	162.7	0	0	0	107.6
281	S	28.4	Very low	31	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	73%	0.734	S	S	*	*			trans	-126.5	103.1	177.8	-62.3	0	0	0	0	109.6
282	P	35.1	Very low	30.4	Very low	114 Å²	114	137.9 Å²	137.9	74%	0.74	73%	0.73	S	S	*	*			trans	-108.5	-166.2	-171	41.5	-36.3	0	0	0	113.9
283	S	26.7	Very low	30.1	Very low	106 Å²	106	140.8 Å²	140.8	74%	0.741	73%	0.732	S	S	*	*			trans	79.9	151.7	173.7	84.8	0	0	0	0	115
284	R	28.3	Very low	29.6	Very low	207 Å²	207	137.1 Å²	137.1	78%	0.781	73%	0.725	S	S	*	*			cis	-168.2	175.6	0.9	-120.1	168.8	-168	161	3.4	106.6
285	S	29	Very low	29.2	Very low	64 Å²	64	137.9 Å²	137.9	45%	0.448	73%	0.725	S	S	.	*			cis	-173.6	167.2	-26.7	32.3	0	0	0	0	107.6
286	N	31.2	Very low	29	Very low	130 Å²	130	134.4 Å²	134.4	70%	0.695	71%	0.712	S	S	*	*			cis	-177.3	175.7	-27.2	-170.6	11.3	0	0	0	106.3
287	T	30.6	Very low	29.1	Very low	64 Å²	64	135 Å²	135	39%	0.393	70%	0.7	S	S	.	*			trans	67.2	106.2	157	45.6	0	0	0	0	123.1
288	T	30.4	Very low	29.1	Very low	104 Å²	104	133.6 Å²	133.6	64%	0.638	68%	0.681	S	S	*	*				101.4	116.7	108	-58.9	0	0	0	0	123.2
289	Q	31.1	Very low	29.4	Very low	166 Å²	166	129 Å²	129	78%	0.776	66%	0.66	S	S	*	*			trans	66.1	111.1	147.1	-75.5	179.9	46.1	0	0	124.9
290	L	25.3	Very low	29.4	Very low	149 Å²	149	123.6 Å²	123.6	78%	0.78	65%	0.65	S	S	*	*				75.2	134.5	105.7	-150.9	83.3	0	0	0	121.9
291	C	24.6	Very low	29.5	Very low	87 Å²	87	121.8 Å²	121.8	59%	0.588	64%	0.641	S	S	*	*			trans	89.3	115.5	147.8	-106.3	0	0	0	0	120.5
292	R	25.8	Very low	29.6	Very low	230 Å²	230	122.1 Å²	122.1	87%	0.868	63%	0.634	S	S	*	*			trans	74.1	149.4	152.9	-56.5	163.6	-175.1	159.9	1.2	116.4
293	Y	24.7	Very low	29.5	Very low	205 Å²	205	122.5 Å²	122.5	80%	0.804	63%	0.63	S	S	*	*			cis	169.9	148.4	-28.3	-139.3	-65.9	0	0	0	103.4
294	L	27.3	Very low	29.7	Very low	132 Å²	132	123.1 Å²	123.1	69%	0.691	63%	0.625	S	S	*	*			trans	75.1	122.1	166.1	-54.6	175.8	0	0	0	118.4
295	N	26.5	Very low	29.7	Very low	128 Å²	128	120.2 Å²	120.2	68%	0.684	63%	0.625	S	S	*	*				64.7	147.5	128.6	-60.8	32.7	0	0	0	120
296	D	31.7	Very low	29.7	Very low	84 Å²	84	121.2 Å²	121.2	45%	0.449	63%	0.632	S	S	.	*			cis	-151.4	161.2	-6.7	-118	-48.5	0	0	0	109.5
297	R	31.6	Very low	29.6	Very low	126 Å²	126	121.1 Å²	121.1	48%	0.475	63%	0.632	S	S	.	*			trans	3.8	148.2	154.3	-43.5	144.8	-158.9	-151.7	5.1	119.5	N1111 V1112	R297-N1111 WeakPolarHBondContact CB-O 3.43Å; R297-N1111 WeakPolarHBondContact CG-O 3.42Å; R297-V1112 HydrophobicContact CB-CG2 4.39Å; R297-V1112 HydrophobicContact CG-CB 3.7Å; R297-V1112 HydrophobicContact CG-CG1 4.43Å; R297-V1112 HydrophobicContact CG-CG2 3.8Å
298	H	34.4	Very low	29.4	Very low	76 Å²	76	125 Å²	125	35%	0.352	65%	0.649	S	S	.	*				-177.7	142.5	70.2	-93.2	-60	0	0	0	117.3	M1109 T1110	H298-M1109 HydrophobicContact CB-CE 4.18Å; H298-M1109 HydrophobicContact CB-SD 4.28Å; H298-M1109 PolarHBondContact CD2-SD 3.45Å; H298-M1109 WeakPolarHBondContact CE1-CA 3.12Å; H298-M1109 PolarHBondContact CE1-O 2.76Å; H298-M1109 VanDerWaalsContact CG-SD 3.54Å; H298-M1109 WeakPolarHBondContact ND1-CA 3.06Å; H298-M1109 PolarHBondContact NE2-SD 3.17Å; H298-M1109 VanDerWaalsContact NE2-SD 3.39Å; H298-T1110 PolarHBondContact CE1-N 3.15Å
299	L	31.8	Very low	29.1	Very low	82 Å²	82	124.7 Å²	124.7	43%	0.429	65%	0.65	S	S	.	*			trans	31.8	146	138.5	-88	171.5	0	0	0	126.3	M1109 T1110 N1111	L299-M1109 VanDerWaalsContact CD1-N 3.29Å; L299-T1110 VanDerWaalsContact CD1-N 3.27Å; L299-T1110 VanDerWaalsContact CD1-O 3.28Å; L299-T1110 WeakPolarHBondContact CD1-O 3.05Å; L299-T1110 VanDerWaalsContact CG-O 3.24Å; L299-T1110 WeakPolarHBondContact CG-O 3.4Å; L299-N1111 HydrophobicContact CG-CB 4.15Å
300	G	31.5	Very low	29	Very low	66 Å²	66	123 Å²	123	68%	0.68	65%	0.645	S	S	*	*			trans	125.1	92.4	156.1	0	0	0	0	0	112.9
301	N	33.8	Very low	29.2	Very low	129 Å²	129	124.7 Å²	124.7	69%	0.69	65%	0.647	S	S	*	*			cis	74.3	105.7	41.8	-171	46.9	0	0	0	116.2
302	N	30.6	Very low	29.4	Very low	115 Å²	115	126 Å²	126	62%	0.615	65%	0.652	S	S	*	*				168.4	143.5	122	-95.1	-41.6	0	0	0	114.4
303	N	32.5	Very low	29.5	Very low	122 Å²	122	123.1 Å²	123.1	65%	0.652	65%	0.652	S	S	*	*			trans	63	153.4	141.5	-61	-13.2	0	0	0	121
304	N	30.1	Very low	29.8	Very low	119 Å²	119	116.9 Å²	116.9	64%	0.636	65%	0.65	S	S	*	*			cis	-167.5	154.9	-24.3	-104.6	-17.8	0	0	0	109.4
305	N	28.4	Very low	29.8	Very low	146 Å²	146	122.1 Å²	122.1	78%	0.781	66%	0.661	S	S	*	*			trans	64.6	152.1	151.3	-69.8	-10.7	0	0	0	119.1
306	S	30.2	Very low	29.9	Very low	85 Å²	85	122 Å²	122	59%	0.594	67%	0.665	S	S	*	*			cis	-167.7	169.8	-15	50.4	0	0	0	0	111.3
307	N	28.8	Very low	29.8	Very low	129 Å²	129	127.1 Å²	127.1	69%	0.69	68%	0.683	S	S	*	*			trans	75.7	127.9	152.9	-66.4	-7.8	0	0	0	118
308	I	26.6	Very low	29.6	Very low	146 Å²	146	124.6 Å²	124.6	75%	0.749	68%	0.684	S	S	*	*				77	126.5	62.5	-73	172.2	0	0	0	110.7
309	C	24.7	Very low	29.3	Very low	97 Å²	97	125.3 Å²	125.3	66%	0.655	69%	0.69	S	S	*	*			cis	-160.9	154.3	4.9	-126.8	0	0	0	0	115.4
310	N	27.3	Very low	29.2	Very low	129 Å²	129	123.2 Å²	123.2	69%	0.69	68%	0.679	S	S	*	*			trans	33.2	136.6	132.2	-84.4	-59.1	0	0	0	124.6
311	K	30.8	Very low	29	Very low	186 Å²	186	127.1 Å²	127.1	81%	0.809	68%	0.675	S	S	*	*			trans	71.7	157	149.8	-64.3	171.3	-178.1	177.3	0	116.1
312	T	28.6	Very low	28.8	Very low	115 Å²	115	126.1 Å²	126.1	71%	0.706	67%	0.669	S	S	*	*			cis	-145.9	148.8	19.4	4.9	0	0	0	0	113.4
313	I	26.7	Very low	28.8	Very low	169 Å²	169	126.7 Å²	126.7	87%	0.867	68%	0.676	S	S	*	*			trans	42.8	120.8	141.3	-56	166.2	0	0	0	119.9
314	G	31.4	Very low	28.6	Very low	73 Å²	73	125.5 Å²	125.5	75%	0.753	68%	0.677	S	S	*	*			trans	-172	146.3	161.7	0	0	0	0	0	114.7
315	R	27.6	Very low	28.8	Very low	243 Å²	243	126 Å²	126	92%	0.917	69%	0.685	S	S	*	*			trans	-101.4	161.5	163.6	-59.8	169	174.2	146.4	-4.2	106.4
316	T	28	Very low	29	Very low	125 Å²	125	124 Å²	124	77%	0.767	68%	0.68	S	S	*	*			cis	-165	-178.8	35	-37.1	0	0	0	0	110.8
317	K	29.7	Very low	28.9	Very low	191 Å²	191	127.2 Å²	127.2	83%	0.83	69%	0.689	S	S	*	*			trans	-44	159.5	155.5	-51.5	167.5	-176.9	173.9	0	112.3
318	S	27.7	Very low	28.8	Very low	73 Å²	73	126.1 Å²	126.1	51%	0.51	69%	0.691	S	S	.	*			cis	176.1	133.8	-14.8	53.7	0	0	0	0	109.7
319	I	29.3	Very low	28.8	Very low	91 Å²	91	123.8 Å²	123.8	47%	0.467	69%	0.688	S	S	.	*			trans	66	155	149.1	-57.3	-174.5	0	0	0	120.4	Y6	Y6-I319 HydrophobicContact CD1-CG2 3.65Å; Y6-I319 HydrophobicContact CD2-CG2 3.63Å; Y6-I319 HydrophobicContact CE1-CG2 3.42Å; Y6-I319 VanDerWaalsContact CE1-CG2 3.42Å; Y6-I319 HydrophobicContact CE2-CG2 3.41Å; Y6-I319 VanDerWaalsContact CE2-CG2 3.41Å; Y6-I319 HydrophobicContact CG-CG2 3.76Å
320	N	29.5	Very low	29	Very low	39 Å²	39	127.7 Å²	127.7	21%	0.209	70%	0.697	C	S	.	*			cis	-176.3	162.8	-15	-92	-11.7	0	0	0	110.9	Q4 L5	Q4-N320 WeakPolarHBondContact CA-ND2 3.32Å; Q4-N320 HydrophobicContact CB-CB 3.47Å; Q4-N320 VanDerWaalsContact CB-CB 3.47Å; Q4-N320 HydrophobicContact CG-CB 3.99Å; Q4-N320 VanDerWaalsContact CG-OD1 3.27Å; Q4-N320 WeakPolarHBondContact CG-OD1 3.4Å; Q4-N320 PolarHBondContact OE1-OD1 3.32Å; Q4-N320 VanDerWaalsContact OE1-OD1 3.09Å; L5-N320 VanDerWaalsContact C-CB 3.47Å; L5-N320 HydrophobicContact CB-CB 3.78Å; L5-N320 WeakPolarHBondContact CB-ND2 3.38Å; L5-N320 CarbonylContact O-C 3.5Å; L5-N320 WeakPolarHBondContact O-CB 3.34Å
321	Y	27.7	Very low	29	Very low	148 Å²	148	127.1 Å²	127.1	58%	0.58	70%	0.697	S	S	*	*				-162.6	-177.1	106.8	-146	-4.3	0	0	0	118.4	Q4 L5 Y6	Q4-Y321 WeakPolarHBondContact CB-O 3.47Å; Q4-Y321 VanDerWaalsContact NE2-N 3.2Å; Q4-Y321 PolarHBondContact NE2-O 3.44Å; L5-Y321 WeakPolarHBondContact O-CA 3.41Å; L5-Y321 WeakPolarHBondContact O-CB 3.44Å; L5-Y321 WeakPolarHBondContact O-CD1 3.46Å; L5-Y321 PolarHBondContact O-N 3.15Å; Y6-Y321 WeakPolarHBondContact O-CD2 3.36Å; Y6-Y321 VanDerWaalsContact O-CE2 3.23Å; Y6-Y321 WeakPolarHBondContact O-CE2 3.42Å
322	L	28.9	Very low	28.8	Very low	108 Å²	108	124.4 Å²	124.4	57%	0.565	69%	0.692	S	S	*	*			trans	-77.5	175.7	-157.9	-110.4	177.8	0	0	0	119.2	Q4	Q4-L322 WeakPolarHBondContact O-CG 3.37Å
323	T	29.7	Very low	28.7	Very low	127 Å²	127	124.1 Å²	124.1	78%	0.779	69%	0.69	S	S	*	*			trans	67.5	169.8	154.9	46.6	0	0	0	0	118.5
324	S	28.2	Very low	28.6	Very low	96 Å²	96	122 Å²	122	67%	0.671	68%	0.68	S	S	*	*			cis	-154.2	145.8	15.9	48.1	0	0	0	0	115.4
325	T	34.3	Very low	28.4	Very low	130 Å²	130	123.1 Å²	123.1	80%	0.798	68%	0.676	S	S	*	*			trans	43.9	-174.3	139.6	61.9	0	0	0	0	121.5
326	P	33.5	Very low	28.4	Very low	103 Å²	103	118.6 Å²	118.6	67%	0.669	67%	0.665	S	S	*	*			cis	-140.7	156.3	-1.9	43.7	-24.4	0	0	0	120.5
327	I	28.7	Very low	28.4	Very low	154 Å²	154	118.1 Å²	118.1	79%	0.79	66%	0.657	S	S	*	*				62.4	142.5	129.5	-62.8	170.3	0	0	0	123.5
328	S	26.8	Very low	28.3	Very low	106 Å²	106	110.6 Å²	110.6	74%	0.741	63%	0.628	S	S	*	*			trans	78.6	148.9	158.4	-81.8	0	0	0	0	120.2
329	S	27	Very low	28.4	Very low	97 Å²	97	113.9 Å²	113.9	68%	0.678	64%	0.636	S	S	*	*			cis	-167.5	149.6	-10.3	47.1	0	0	0	0	115.3
330	Q	28.2	Very low	28.4	Very low	179 Å²	179	114.4 Å²	114.4	84%	0.836	64%	0.643	S	S	*	*			trans	79.8	137.3	139.6	-86.7	-172.5	13	0	0	124.5
331	V	26.8	Very low	28.4	Very low	116 Å²	116	119.2 Å²	119.2	70%	0.703	67%	0.669	S	S	*	*			trans	80.7	96.4	142.1	173.5	0	0	0	0	120.2
332	N	26.2	Very low	28.6	Very low	130 Å²	130	121.4 Å²	121.4	70%	0.695	68%	0.682	S	S	*	*				42.4	138.8	103.7	-135.3	14.8	0	0	0	117.7
333	V	26.8	Very low	29	Very low	109 Å²	109	120.7 Å²	120.7	66%	0.661	68%	0.683	S	S	*	*				-165.7	145	62.7	163.5	0	0	0	0	111.1
334	N	25.3	Very low	29.2	Very low	124 Å²	124	120.3 Å²	120.3	66%	0.663	68%	0.676	S	S	*	*			trans	15.2	156.8	146.7	-48.3	-6.9	0	0	0	120.5
335	S	26.4	Very low	29.3	Very low	96 Å²	96	119.3 Å²	119.3	67%	0.671	67%	0.669	S	S	*	*			cis	174.8	173.5	2.5	39.4	0	0	0	0	107.7
336	H	28.6	Very low	29.1	Very low	149 Å²	149	116.9 Å²	116.9	69%	0.69	65%	0.654	S	S	*	*			cis	-177.2	166.3	-29.7	-82.3	-42.8	0	0	0	107.3
337	I	27.3	Very low	29.1	Very low	114 Å²	114	120.8 Å²	120.8	59%	0.585	66%	0.657	S	S	*	*			trans	65	138.2	145.7	-75.1	164.8	0	0	0	118.3	N1142	I337-N1142 PolarHBondContact O-N 3.18Å; I337-N1142 PolarHBondContact O-OD1 3.31Å
338	S	27.8	Very low	29.2	Very low	33 Å²	33	117.3 Å²	117.3	23%	0.231	65%	0.646	C	S	.	*			cis	-164.7	178.9	-1.1	42.1	0	0	0	0	111.4	Q1140 L1141 N1142	S338-Q1140 CarbonylContact O-C 3.6Å; S338-Q1140 VanDerWaalsContact O-C 3.29Å; S338-L1141 VanDerWaalsContact N-C 3.34Å; S338-L1141 PolarHBondContact O-N 3.47Å; S338-L1141 PolarHBondContact OG-O 3.16Å; S338-N1142 PolarHBondContact OG-N 3.01Å; S338-N1142 VanDerWaalsContact OG-N 3.13Å
339	E	28.8	Very low	29.5	Very low	143 Å²	143	115.9 Å²	115.9	67%	0.668	64%	0.636	S	S	*	*			trans	41.6	155.2	131.9	-69.2	166.4	-124.9	0	0	122.5	Q1140	E339-Q1140 CarbonylContact O-C 3.23Å
340	T	29.3	Very low	29.8	Very low	102 Å²	102	118.5 Å²	118.5	63%	0.626	65%	0.648	S	S	*	*			cis	-156.7	159.1	3.2	7.9	0	0	0	0	115.1
341	N	29.2	Very low	29.8	Very low	140 Å²	140	114.8 Å²	114.8	75%	0.749	64%	0.642	S	S	*	*			trans	66.7	105.5	144.1	-62	-26.1	0	0	0	126
342	F	33.9	Very low	30	Very low	194 Å²	194	116.1 Å²	116.1	85%	0.851	65%	0.65	S	S	*	*				14.8	168.6	110.8	-82.5	-69.9	0	0	0	122.8
343	P	37	Very low	30.2	Very low	92 Å²	92	114.8 Å²	114.8	60%	0.597	65%	0.651	S	S	*	*			cis	-148.3	167.9	-2.1	27.8	-1.3	0	0	0	122.4
344	L	32.5	Very low	30.6	Very low	119 Å²	119	115.6 Å²	115.6	62%	0.623	66%	0.662	S	S	*	*			trans	80.3	137.4	134.3	-75.6	161.2	0	0	0	128.7	V264	V264-L344 HydrophobicContact CB-CD1 4.43Å; V264-L344 HydrophobicContact CG1-CB 4.15Å; V264-L344 HydrophobicContact CG1-CD1 3.7Å; V264-L344 HydrophobicContact CG1-CG 4.48Å; V264-L344 HydrophobicContact CG2-CB 4.16Å; V264-L344 HydrophobicContact CG2-CD1 3.74Å; V264-L344 HydrophobicContact CG2-CD2 3.91Å; V264-L344 HydrophobicContact CG2-CG 4.13Å
345	S	31	Very low	30.8	Very low	75 Å²	75	115.1 Å²	115.1	52%	0.524	67%	0.668	S	S	.	*			trans	73.3	160.1	142.3	58.6	0	0	0	0	124.4
346	T	31.1	Very low	31	Very low	80 Å²	80	116.8 Å²	116.8	49%	0.491	68%	0.678	S	S	.	*			cis	-175.1	155.9	-40.3	46.8	0	0	0	0	110.5	A262 A263	A262-T346 HydrophobicContact CB-CG2 4.16Å; A262-T346 WeakPolarHBondContact CB-OG1 3.31Å; A263-T346 HydrophobicContact CB-CG2 4.21Å; A263-T346 WeakPolarHBondContact CB-OG1 3.25Å
347	Y	33.1	Very low	31.1	Very low	185 Å²	185	118 Å²	118	73%	0.725	69%	0.689	S	S	*	*			trans	-166.1	-168.4	143.6	-113.7	-75.7	0	0	0	113.7	A260 A261 A262	A260-Y347 WeakPolarHBondContact O-CE1 3.32Å; A261-Y347 HydrophobicContact CB-CD1 3.44Å; A261-Y347 VanDerWaalsContact CB-CD1 3.44Å; A261-Y347 HydrophobicContact CB-CE1 3.69Å; A261-Y347 HydrophobicContact CB-CG 3.89Å; A262-Y347 WeakPolarHBondContact O-CE2 3.26Å; A262-Y347 PolarHBondContact O-OH 3.03Å
348	S	30.1	Very low	31.9	Very low	81 Å²	81	117.7 Å²	117.7	57%	0.566	69%	0.694	S	S	*	*			trans	-146.5	-146.8	-162.4	-63.4	0	0	0	0	119.7	A261	A261-S348 VanDerWaalsContact CB-OG 3.26Å; A261-S348 WeakPolarHBondContact CB-OG 3.37Å; A261-S348 PolarHBondContact N-OG 2.94Å
349	S	33.7	Very low	32	Very low	76 Å²	76	122 Å²	122	53%	0.531	72%	0.724	S	S	.	*			trans	-122.6	163.2	-135.4	54	0	0	0	0	119.3
350	V	32.7	Very low	32.3	Very low	152 Å²	152	119.3 Å²	119.3	92%	0.921	73%	0.726	S	S	*	*			trans	-147.3	164.2	172	-175.2	0	0	0	0	111.4
351	S	28.9	Very low	32.3	Very low	101 Å²	101	120.6 Å²	120.6	71%	0.706	74%	0.735	S	S	*	*			trans	-143.4	161.8	-177.7	60.7	0	0	0	0	113.8
352	T	30.8	Very low	32.4	Very low	144 Å²	144	120.6 Å²	120.6	88%	0.883	74%	0.744	S	S	*	*			trans	177.3	160.5	142.8	25.1	0	0	0	0	116.5
353	S	31	Very low	32.1	Very low	102 Å²	102	119.8 Å²	119.8	71%	0.713	74%	0.743	S	S	*	*			trans	-57.3	162.3	-176.4	54.2	0	0	0	0	122.1
354	S	34.2	Very low	31.9	Very low	126 Å²	126	122 Å²	122	88%	0.881	75%	0.749	S	S	*	*				178.4	175.6	115.8	45.2	0	0	0	0	113.7
355	S	30.4	Very low	32	Very low	113 Å²	113	125.6 Å²	125.6	79%	0.79	76%	0.755	S	S	*	*			trans	-143.8	162.3	-165	57.1	0	0	0	0	114.9
356	C	30.2	Very low	32	Very low	132 Å²	132	128.4 Å²	128.4	89%	0.892	77%	0.765	S	S	*	*			trans	-164.6	167.1	161.1	-100.6	0	0	0	0	113.1
357	L	31.1	Very low	31.9	Very low	174 Å²	174	130.7 Å²	130.7	91%	0.911	78%	0.778	S	S	*	*			trans	-139.6	172.6	-170.5	-95	127.5	0	0	0	113.5
358	P	42.6	Very low	31.9	Very low	107 Å²	107	127 Å²	127	70%	0.695	78%	0.777	S	S	*	*			trans	-112.5	-178.6	-158.7	43.5	-38.1	0	0	0	116.5
359	S	30.2	Very low	31.9	Very low	124 Å²	124	131 Å²	131	87%	0.867	79%	0.786	S	S	*	*			trans	-172.1	174.7	157.7	-89.6	0	0	0	0	115.4
360	A	34.8	Very low	31.6	Very low	86 Å²	86	135.2 Å²	135.2	71%	0.711	80%	0.798	S	S	*	*			trans	76.8	119.7	173.6	0	0	0	0	0	117.6
361	T	29.9	Very low	31.4	Very low	130 Å²	130	135.4 Å²	135.4	80%	0.798	79%	0.792	S	S	*	*			cis	94.2	111.6	27.8	68.3	0	0	0	0	116.4
362	C	31.2	Very low	31.3	Very low	139 Å²	139	136.5 Å²	136.5	94%	0.939	79%	0.789	S	S	*	*			trans	-169.2	154	139.8	-96.6	0	0	0	0	110.9
363	E	27.9	Very low	31.3	Very low	178 Å²	178	135.5 Å²	135.5	83%	0.832	79%	0.788	S	S	*	*			trans	-108.2	175	-179.2	-57.2	174.6	130.6	0	0	111.4
364	L	33.4	Very low	31.2	Very low	138 Å²	138	136.1 Å²	136.1	72%	0.723	78%	0.783	S	S	*	*				153.4	129.4	120.7	-77.9	-173.4	0	0	0	116.5
365	Y	32.8	Very low	31.1	Very low	194 Å²	194	140.9 Å²	140.9	76%	0.761	78%	0.782	S	S	*	*			trans	70.3	137.1	149.7	-74.8	-63	0	0	0	125.9
366	N	32.7	Very low	31.1	Very low	135 Å²	135	141.2 Å²	141.2	72%	0.722	77%	0.774	S	S	*	*			trans	73.7	106.6	154.8	-59.1	-18.2	0	0	0	119.9
367	V	29	Very low	31	Very low	128 Å²	128	139.9 Å²	139.9	78%	0.776	77%	0.766	S	S	*	*			cis	79.5	128.1	41.7	-178.3	0	0	0	0	113
368	P	31.5	Very low	30.8	Very low	107 Å²	107	137.6 Å²	137.6	70%	0.695	75%	0.752	S	S	*	*			cis	-145.8	173.9	-24.5	41.7	-22.5	0	0	0	117.6
369	Q	30.4	Very low	30.2	Very low	164 Å²	164	140.7 Å²	140.7	77%	0.766	76%	0.763	S	S	*	*			trans	51.6	101.3	142.7	-67	-84.1	9.2	0	0	121.9
370	H	28.9	Very low	30.2	Very low	166 Å²	166	141.7 Å²	141.7	77%	0.769	75%	0.754	S	S	*	*				-173.1	136.9	103.6	-119.6	-94.6	0	0	0	114.1
371	I	27.8	Very low	30	Very low	155 Å²	155	146.4 Å²	146.4	80%	0.795	76%	0.761	S	S	*	*	S	Bend	trans	54.1	71.1	166.5	-35.3	-175.1	0	0	0	117.4
372	L	27.6	Very low	29.9	Very low	125 Å²	125	146.1 Å²	146.1	65%	0.654	76%	0.759	S	S	*	*			trans	-145.2	121	154.5	-119.4	170.9	0	0	0	110.8	N374	L372-N374 WeakPolarHBondContact CD2-OD1 3.3Å
373	S	30.4	Very low	29.9	Very low	123 Å²	123	143.3 Å²	143.3	86%	0.86	75%	0.745	S	S	*	*			trans	-171.4	108.6	173.6	-82.5	0	0	0	0	112.4
374	N	29.2	Very low	30	Very low	115 Å²	115	140.1 Å²	140.1	62%	0.615	74%	0.743	S	S	*	*			cis	-151.3	113.4	-34.7	-112	-6	0	0	0	109.8	L372	L372-N374 WeakPolarHBondContact CD2-OD1 3.3Å
375	R	30.5	Very low	29.9	Very low	226 Å²	226	139.3 Å²	139.3	85%	0.853	74%	0.744	S	S	*	*			trans	-78	134	138.3	-101.8	-174.4	165.7	-155	-2.8	106.1
376	L	31.4	Very low	29.8	Very low	119 Å²	119	135.7 Å²	135.7	62%	0.623	74%	0.742	S	S	*	*			trans	160.7	122.6	162.5	-89.4	155.9	0	0	0	104.2
377	S	28.3	Very low	29.6	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	75%	0.748	S	S	*	*			cis	61.7	61.1	16.9	90.6	0	0	0	0	115.5
378	M	27.4	Very low	29.8	Very low	126 Å²	126	137.2 Å²	137.2	62%	0.621	75%	0.75	S	S	*	*			trans	-162.6	135.1	137.5	-101.5	-48	175.5	0	0	112	Q380	M378-Q380 HydrophobicContact CE-CB 4.5Å; M378-Q380 HydrophobicContact CE-CG 4.42Å; M378-Q380 HydrophobicContact SD-CB 3.85Å; M378-Q380 HydrophobicContact SD-CG 3.91Å
379	N	29.8	Very low	29.9	Very low	172 Å²	172	137.5 Å²	137.5	92%	0.92	76%	0.755	S	S	*	*			trans	-158.6	61.1	134.8	-103.7	-11.7	0	0	0	108.3
380	Q	29.7	Very low	30.3	Very low	146 Å²	146	137.3 Å²	137.3	68%	0.682	76%	0.757	S	S	*	*			trans	-79.6	123.4	154.7	-69.8	-176.5	-27	0	0	107.6	M378	M378-Q380 HydrophobicContact CE-CB 4.5Å; M378-Q380 HydrophobicContact CE-CG 4.42Å; M378-Q380 HydrophobicContact SD-CB 3.85Å; M378-Q380 HydrophobicContact SD-CG 3.91Å
381	H	29.7	Very low	30.5	Very low	184 Å²	184	135.4 Å²	135.4	85%	0.852	76%	0.76	S	S	*	*			trans	162.9	138.7	151.1	-89.5	-61.8	0	0	0	108.2
382	V	29.4	Very low	30.8	Very low	125 Å²	125	135 Å²	135	76%	0.758	77%	0.765	S	S	*	*			cis	-161.6	168.9	-22.2	98.1	0	0	0	0	108
383	A	31.2	Very low	30.9	Very low	79 Å²	79	132.8 Å²	132.8	65%	0.653	77%	0.772	S	S	*	*			trans	69.7	125.3	-175.8	0	0	0	0	0	113.8
384	S	28.5	Very low	30.9	Very low	111 Å²	111	134 Å²	134	78%	0.776	76%	0.764	S	S	*	*				68.9	129.1	62.6	-54.1	0	0	0	0	111.5
385	T	31	Very low	31.1	Very low	121 Å²	121	135.7 Å²	135.7	74%	0.742	78%	0.778	S	S	*	*			cis	-156.1	173.7	28.2	-29.2	0	0	0	0	112.1
386	T	31.6	Very low	31.1	Very low	119 Å²	119	133.8 Å²	133.8	73%	0.73	77%	0.771	S	S	*	*			trans	57	102	163.8	50	0	0	0	0	117.9
387	L	29.5	Very low	31	Very low	160 Å²	160	134.8 Å²	134.8	84%	0.838	78%	0.777	S	S	*	*				73	105.7	70.7	-70	171.7	0	0	0	115.8
388	T	33	Very low	31.1	Very low	135 Å²	135	134.6 Å²	134.6	83%	0.828	78%	0.775	S	S	*	*				-174.8	113.5	111.6	29.8	0	0	0	0	114.3
389	S	32.6	Very low	31.6	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	77%	0.765	S	S	*	*			trans	17.4	119.5	149.2	56	0	0	0	0	122.8
390	I	39.2	Very low	32	Very low	160 Å²	160	127.6 Å²	127.6	82%	0.821	74%	0.74	S	S	*	*			trans	-131.7	136.5	145.6	-63.7	-179	0	0	0	107.3
391	P	32.7	Very low	32.8	Very low	125 Å²	125	126.4 Å²	126.4	81%	0.812	74%	0.738	S	S	*	*			trans	-81	145.3	-170.2	31.4	-35.8	0	0	0	114.4	G393	P391-G393 PolarHBondContact O-N 3.09Å
392	T	33.8	Very low	34.5	Very low	147 Å²	147	123.8 Å²	123.8	90%	0.902	73%	0.726	S	S	*	*			trans	-85.3	109.3	-179.2	50.6	0	0	0	0	112.5
393	G	30.1	Very low	37	Very low	78 Å²	78	122.9 Å²	122.9	80%	0.804	72%	0.717	S	S	*	*			trans	-116.8	-1.7	178.8	0	0	0	0	0	116.2	P391	P391-G393 PolarHBondContact O-N 3.09Å
394	E	31.3	Very low	39.5	Very low	150 Å²	150	122.6 Å²	122.6	70%	0.701	70%	0.699	S	S	*	*			trans	-126.1	101.3	179.5	-70.9	-172	168.7	0	0	111.4	R396	E394-R396 VanDerWaalsContact C-N 3.32Å; E394-R396 HydrophobicContact CB-CG 4.49Å; E394-R396 PolarHBondContact O-N 3.29Å; E394-R396 VanDerWaalsContact O-N 3.12Å; E394-R396 IonicContact OE2-NE 2.66Å; E394-R396 IonicContact OE2-NH2 3.25Å
395	V	31.7	Very low	42.3	Very low	150 Å²	150	123.9 Å²	123.9	91%	0.909	69%	0.688	S	S	*	*			trans	-80	89.6	159.8	-179.1	0	0	0	0	107.3	N397	V395-N397 PolarHBondContact O-N 2.91Å
396	R	31.6	Very low	45.1	Very low	186 Å²	186	118.3 Å²	118.3	70%	0.702	65%	0.654	S	S	*	*			trans	-57.8	121.2	177.1	-70.2	-179.7	176.5	173.4	-3.6	110.1	E394 S398	E394-R396 VanDerWaalsContact C-N 3.32Å; E394-R396 HydrophobicContact CB-CG 4.49Å; E394-R396 PolarHBondContact O-N 3.29Å; E394-R396 VanDerWaalsContact O-N 3.12Å; E394-R396 IonicContact OE2-NE 2.66Å; E394-R396 IonicContact OE2-NH2 3.25Å; R396-S398 PolarHBondContact O-N 3.03Å
397	N	29.1	Very low	47.7	Very low	139 Å²	139	115.3 Å²	115.3	74%	0.743	63%	0.631	S	S	*	*			trans	-69.7	70.6	156.9	-89	-29.6	0	0	0	109	V395 I399	V395-N397 PolarHBondContact O-N 2.91Å; N397-I399 HydrophobicContact CB-CD1 4.34Å; N397-I399 HydrophobicContact CB-CG1 4.34Å; N397-I399 PolarHBondContact O-N 3.48Å
398	S	30	Very low	50.5	Low	100 Å²	100	107.7 Å²	107.7	70%	0.699	59%	0.592	S	S	*	*			trans	-74.6	50.1	164.5	-65.6	0	0	0	0	110.2	R396	R396-S398 PolarHBondContact O-N 3.03Å
399	I	38.9	Very low	52.9	Low	78 Å²	78	102.8 Å²	102.8	40%	0.4	56%	0.56	S	S	.	*			trans	-83.8	126.9	168.3	-55.5	176.1	0	0	0	105.1	N397 N401	N397-I399 HydrophobicContact CB-CD1 4.34Å; N397-I399 HydrophobicContact CB-CG1 4.34Å; N397-I399 PolarHBondContact O-N 3.48Å; I399-N401 PolarHBondContact O-N 3.01Å
400	N	38.1	Very low	54.8	Low	74 Å²	74	99.9 Å²	99.9	40%	0.396	54%	0.535	S	S	.	.			trans	-54.7	111.8	-164.3	-36.9	-78	0	0	0	112.6	E402 L621	N400-E402 PolarHBondContact O-N 3.07Å; N400-E402 VanDerWaalsContact O-N 3.08Å; N400-L621 WeakPolarHBondContact ND2-CD1 3.35Å; N400-L621 WeakPolarHBondContact OD1-CD1 3.5Å
401	N	46.6	Very low	56.2	Low	121 Å²	121	95.6 Å²	95.6	65%	0.647	52%	0.518	S	S	*	.			trans	-71.3	97.6	160.6	-77.4	10.6	0	0	0	107.2	I399 L403	I399-N401 PolarHBondContact O-N 3.01Å; N401-L403 PolarHBondContact O-N 3.33Å
402	E	64.9	Low	57.5	Low	128 Å²	128	95.1 Å²	95.1	60%	0.598	51%	0.513	S	S	*	.			trans	-64	106.9	168.4	-68.5	-168	149.3	0	0	108.6	N400 Y404	N400-E402 PolarHBondContact O-N 3.07Å; N400-E402 VanDerWaalsContact O-N 3.08Å; E402-Y404 VanDerWaalsContact O-CD2 3.3Å; E402-Y404 WeakPolarHBondContact O-CD2 3.22Å; E402-Y404 WeakPolarHBondContact O-CE2 3.37Å; E402-Y404 PolarHBondContact O-N 2.92Å
403	L	82.8	Confident	58.5	Low	107 Å²	107	89.9 Å²	89.9	56%	0.56	48%	0.481	S	S	*	.			trans	-73	122.1	-176.9	-68.6	176.1	0	0	0	111	N401 Y405 V426	N401-L403 PolarHBondContact O-N 3.33Å; L403-Y405 PolarHBondContact O-N 2.85Å; L403-V426 HydrophobicContact CB-CG1 3.69Å; L403-V426 HydrophobicContact CD1-CG1 4.23Å; L403-V426 HydrophobicContact CD2-CG1 4.23Å; L403-V426 HydrophobicContact CG-CG1 4.27Å
404	Y	83.4	Confident	59.8	Low	72 Å²	72	93 Å²	93	28%	0.282	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	112.1	-177.8	-63	-85.9	0	0	0	110.6	E402 V426 F427 V430 I433	E402-Y404 VanDerWaalsContact O-CD2 3.3Å; E402-Y404 WeakPolarHBondContact O-CD2 3.22Å; E402-Y404 WeakPolarHBondContact O-CE2 3.37Å; E402-Y404 PolarHBondContact O-N 2.92Å; Y404-V426 WeakPolarHBondContact O-CA 3.48Å; Y404-F427 PolarHBondContact N-O 3.4Å; Y404-F427 PolarHBondContact O-N 3.4Å; Y404-V430 HydrophobicContact CD1-CG2 4.36Å; Y404-V430 HydrophobicContact CE1-CG2 3.6Å; Y404-V430 HydrophobicContact CE2-CG2 3.96Å; Y404-V430 WeakPolarHBondContact OH-CG2 3.29Å; Y404-I433 HydrophobicContact CD1-CG2 4.47Å; Y404-I433 HydrophobicContact CG-CG2 4.24Å
405	Y	85.8	Confident	60.9	Low	139 Å²	139	90.5 Å²	90.5	55%	0.545	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.8	178.4	43.6	-100.3	0	0	0	112.3	L403 Q407 I433 W454	L403-Y405 PolarHBondContact O-N 2.85Å; Y405-Q407 HydrophobicContact CD2-CB 4.46Å; Y405-Q407 HydrophobicContact CD2-CG 3.76Å; Y405-Q407 VanDerWaalsContact CE2-CD 3.49Å; Y405-Q407 HydrophobicContact CE2-CG 4.13Å; Y405-Q407 PolarHBondContact O-N 3.21Å; Y405-I433 VanDerWaalsContact O-CD1 3.26Å; Y405-I433 WeakPolarHBondContact O-CD1 3.35Å; Y405-W454 WeakPolarHBondContact O-CH2 3.37Å
406	C	90.2	Very high	61.8	Low	3 Å²	3	88.4 Å²	88.4	2%	0.02	47%	0.465	C	S	.	.			trans	-80.5	108.6	168.7	-169.6	0	0	0	0	110.8	W408 C423 S424 R425 F427 H436	C406-W408 VanDerWaalsContact C-N 3.35Å; C406-C423 HydrophobicContact CB-CB 4.18Å; C406-S424 PolarHBondContact O-N 2.95Å; C406-R425 PolarHBondContact N-O 3.5Å; C406-F427 HydrophobicContact CB-CE2 4.38Å; C406-H436 WeakPolarHBondContact CB-NE2 3.5Å; C406-H436 PolarHBondContact SG-NE2 2.77Å
407	Q	86.1	Confident	63.3	Low	56 Å²	56	82 Å²	82	26%	0.262	46%	0.457	S	S	.	.			trans	-95.9	24.1	176.8	-95.5	177.2	15.2	0	0	113	Y405 W454 K455	Y405-Q407 HydrophobicContact CD2-CB 4.46Å; Y405-Q407 HydrophobicContact CD2-CG 3.76Å; Y405-Q407 VanDerWaalsContact CE2-CD 3.49Å; Y405-Q407 HydrophobicContact CE2-CG 4.13Å; Y405-Q407 PolarHBondContact O-N 3.21Å; Q407-W454 HydrophobicContact CB-CD2 4.08Å; Q407-W454 HydrophobicContact CB-CE3 4.48Å; Q407-W454 HydrophobicContact CB-CH2 4.18Å; Q407-W454 HydrophobicContact CB-CZ2 3.7Å; Q407-K455 HydrophobicContact CB-CB 3.95Å; Q407-K455 HydrophobicContact CG-CB 4.28Å; Q407-K455 HydrophobicContact CG-CD 4.19Å; Q407-K455 WeakPolarHBondContact O-CB 3.23Å; Q407-K455 PolarHBondContact O-N 3.11Å
408	W	88	Confident	64.8	Low	0 Å²	0	77.3 Å²	77.3	0%	0	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-72.7	137	171.3	-158.1	-81.3	0	0	0	110.8	C406 D410 P422 C423 I437 H441 V442 C452 Y453 W454 L470 I474	C406-W408 VanDerWaalsContact C-N 3.35Å; W408-D410 PolarHBondContact NE1-OD1 3.25Å; W408-P422 WeakPolarHBondContact O-CA 3.25Å; W408-C423 PolarHBondContact O-N 3.26Å; W408-I437 HydrophobicContact CE3-CG2 3.84Å; W408-I437 HydrophobicContact CZ3-CG2 3.79Å; W408-H441 AromaticContact CD1-CE1 3.01Å; W408-H441 AromaticContact CD1-CG 3.64Å; W408-H441 AromaticContact CD1-ND1 3.24Å; W408-H441 HydrophobicContact CD2-CB 3.64Å; W408-H441 AromaticContact CD2-CG 3.85Å; W408-H441 HydrophobicContact CE3-CB 4.03Å; W408-H441 HydrophobicContact CG-CB 3.92Å; W408-H441 AromaticContact CG-CD2 3.95Å; W408-H441 AromaticContact CG-CE1 3.72Å; W408-H441 AromaticContact CG-CG 3.56Å; W408-H441 AromaticContact CG-ND1 3.59Å; W408-H441 HydrophobicContact CH2-CB 4.42Å; W408-H441 HydrophobicContact CZ2-CB 4.07Å; W408-H441 WeakPolarHBondContact CZ2-O 3.24Å; W408-H441 HydrophobicContact CZ3-CB 4.41Å; W408-H441 AromaticContact NE1-CE1 3.27Å; W408-H441 PolarHBondContact NE1-CE1 3.43Å; W408-H441 VanDerWaalsContact NE1-CE1 3.27Å; W408-H441 AromaticContact NE1-CG 3.95Å; W408-H441 AromaticContact NE1-ND1 3.71Å; W408-V442 HydrophobicContact CH2-CG2 4.05Å; W408-V442 HydrophobicContact CZ3-CG2 4.42Å; W408-C452 HydrophobicContact CH2-CB 4.49Å; W408-Y453 AromaticContact CZ2-CD2 3.93Å; W408-Y453 HydrophobicContact CZ2-CD2 3.93Å; W408-Y453 AromaticContact NE1-CD2 3.98Å; W408-W454 HydrophobicContact CB-CE3 4.36Å; W408-W454 HydrophobicContact CE3-CE3 4.15Å; W408-L470 HydrophobicContact CH2-CD1 4.4Å; W408-I474 HydrophobicContact CH2-CD1 4.29Å; W408-I474 HydrophobicContact CZ3-CD1 3.89Å; W408-I474 HydrophobicContact CZ3-CG1 4.08Å
409	I	83.9	Confident	66.3	Low	32 Å²	32	78.4 Å²	78.4	16%	0.164	43%	0.432	C	S	.	.	B	Isolated β-bridge	trans	-115.6	110.8	177.1	-56.9	172.4	0	0	0	106.9	P420 P422 Y453 K455	I409-P420 HydrophobicContact CG2-CB 4.05Å; I409-P420 HydrophobicContact CG2-CG 4.38Å; I409-P422 HydrophobicContact CG1-CB 4.46Å; I409-Y453 PolarHBondContact N-O 3.09Å; I409-Y453 WeakPolarHBondContact O-CB 3.46Å; I409-K455 HydrophobicContact CD1-CB 4.17Å; I409-K455 HydrophobicContact CD1-CG 4.21Å
410	D	73	Confident	67.5	Low	52 Å²	52	75.4 Å²	75.4	28%	0.278	42%	0.417	S	S	.	.			trans	-72.9	134.2	-177	-64	-57.2	0	0	0	110.9	W408 V412 H441	W408-D410 PolarHBondContact NE1-OD1 3.25Å; D410-V412 VanDerWaalsContact C-N 3.33Å; D410-V412 PolarHBondContact O-N 2.87Å; D410-H441 IonicContact OD1-CE1 3.16Å; D410-H441 PolarHBondContact OD1-CE1 3.44Å; D410-H441 IonicContact OD1-ND1 2.71Å; D410-H441 PolarHBondContact OD1-ND1 2.66Å; D410-H441 IonicContact OD1-NE2 2.74Å; D410-H441 PolarHBondContact OD1-NE2 3.49Å; D410-H441 IonicContact OD2-CE1 2.11Å; D410-H441 PolarHBondContact OD2-CE1 2.92Å; D410-H441 VanDerWaalsContact OD2-CE1 3.3Å; D410-H441 IonicContact OD2-ND1 2.99Å; D410-H441 IonicContact OD2-NE2 3.24Å; D410-H441 PolarHBondContact OD2-NE2 2.74Å
411	P	67.4	Low	68.9	Low	70 Å²	70	79.8 Å²	79.8	46%	0.455	43%	0.433	S	S	.	.	S	Bend	trans	-77.3	-13.3	-161.5	30.1	-38.3	0	0	0	115.2	Y453	P411-Y453 HydrophobicContact CB-CD1 4.04Å; P411-Y453 HydrophobicContact CB-CE1 3.69Å; P411-Y453 HydrophobicContact CB-CE2 4.22Å; P411-Y453 HydrophobicContact CB-CG 4.43Å; P411-Y453 HydrophobicContact CG-CD2 4.15Å; P411-Y453 HydrophobicContact CG-CE1 4.16Å; P411-Y453 HydrophobicContact CG-CE2 3.75Å
412	V	60.3	Low	70.5	Confident	116 Å²	116	76.7 Å²	76.7	70%	0.703	42%	0.419	S	S	*	.			trans	-132	112.1	-178.4	-178.5	0	0	0	0	109.1	D410	D410-V412 VanDerWaalsContact C-N 3.33Å; D410-V412 PolarHBondContact O-N 2.87Å
413	P	56.1	Low	71.4	Confident	37 Å²	37	71.6 Å²	71.6	24%	0.24	40%	0.397	C	S	.	.			trans	-67.5	133.4	165.7	-10.4	25.2	0	0	0	109.5	I415 S418 P420	P413-I415 PolarHBondContact O-N 3.11Å; P413-I415 VanDerWaalsContact O-N 3.08Å; P413-S418 VanDerWaalsContact CB-O 3.29Å; P413-S418 WeakPolarHBondContact CB-O 3.46Å; P413-S418 WeakPolarHBondContact CB-OG 3.45Å; P413-S418 WeakPolarHBondContact CG-O 3.31Å; P413-P420 HydrophobicContact CG-CB 4.24Å
414	T	57.2	Low	71.2	Confident	142 Å²	142	70.2 Å²	70.2	87%	0.871	40%	0.397	S	S	*	.	S	Bend	trans	-66.8	-8.5	179.9	47.8	0	0	0	0	114.3
415	I	54.1	Low	71.3	Confident	99 Å²	99	72.5 Å²	72.5	51%	0.508	41%	0.405	S	S	.	.	S	Bend	trans	-124.4	120.5	173.9	-57.3	173.5	0	0	0	107.4	P413 G417 S418	P413-I415 PolarHBondContact O-N 3.11Å; P413-I415 VanDerWaalsContact O-N 3.08Å; I415-G417 PolarHBondContact O-N 3.47Å; I415-S418 WeakPolarHBondContact O-CB 3.08Å; I415-S418 PolarHBondContact O-N 3.01Å; I415-S418 VanDerWaalsContact O-N 3.07Å; I415-S418 PolarHBondContact O-OG 3.45Å
416	P	51.6	Low	71.4	Confident	105 Å²	105	70 Å²	70	68%	0.682	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	133.1	175.8	-28.8	35.8	0	0	0	112.2	H153 S418	H153-P416 PolarHBondContact CE1-O 3.26Å; H153-P416 PolarHBondContact ND1-O 2.88Å; P416-S418 VanDerWaalsContact C-N 3.28Å; P416-S418 PolarHBondContact O-N 2.88Å
417	G	61.1	Low	71.4	Confident	52 Å²	52	71.3 Å²	71.3	54%	0.536	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-0.4	-179.4	0	0	0	0	0	116.2	H153 I415	H153-G417 VanDerWaalsContact CE1-C 3.48Å; I415-G417 PolarHBondContact O-N 3.47Å
418	S	61.1	Low	71.4	Confident	40 Å²	40	73.2 Å²	73.2	28%	0.28	42%	0.421	S	S	.	.	S	Bend	trans	-76.7	141.7	167.6	62.9	0	0	0	0	110.9	P413 I415 P416	P413-S418 VanDerWaalsContact CB-O 3.29Å; P413-S418 WeakPolarHBondContact CB-O 3.46Å; P413-S418 WeakPolarHBondContact CB-OG 3.45Å; P413-S418 WeakPolarHBondContact CG-O 3.31Å; I415-S418 WeakPolarHBondContact O-CB 3.08Å; I415-S418 PolarHBondContact O-N 3.01Å; I415-S418 VanDerWaalsContact O-N 3.07Å; I415-S418 PolarHBondContact O-OG 3.45Å; P416-S418 VanDerWaalsContact C-N 3.28Å; P416-S418 PolarHBondContact O-N 2.88Å
419	I	61.3	Low	71.3	Confident	124 Å²	124	75 Å²	75	64%	0.636	43%	0.434	S	S	*	.			trans	-66	131.2	-177.6	-58.1	173.4	0	0	0	109.4	K421	I419-K421 PolarHBondContact O-N 2.96Å
420	P	64.5	Low	71.4	Confident	14 Å²	14	75.2 Å²	75.2	9%	0.091	44%	0.436	C	S	.	.			trans	-60.8	112.2	178	24.6	-33.6	0	0	0	109.7	I409 P413 P422 H944	I409-P420 HydrophobicContact CG2-CB 4.05Å; I409-P420 HydrophobicContact CG2-CG 4.38Å; P413-P420 HydrophobicContact CG-CB 4.24Å; P420-P422 WeakPolarHBondContact O-CD 3.39Å; P420-H944 WeakPolarHBondContact CD-CE1 3.49Å
421	K	67.8	Low	71.9	Confident	167 Å²	167	77 Å²	77	73%	0.726	45%	0.449	S	S	*	.			trans	-75.2	119.7	-173.4	-175.5	177	177.3	-178.6	0	109.2	I419	I419-K421 PolarHBondContact O-N 2.96Å
422	P	80.4	Confident	72.8	Confident	56 Å²	56	78 Å²	78	36%	0.364	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-62.6	143.3	169.3	27.6	-33.2	0	0	0	109.1	W408 I409 P420 S424	W408-P422 WeakPolarHBondContact O-CA 3.25Å; I409-P422 HydrophobicContact CG1-CB 4.46Å; P420-P422 WeakPolarHBondContact O-CD 3.39Å; P422-S424 PolarHBondContact O-N 3.46Å; P422-S424 PolarHBondContact O-OG 3.11Å
423	C	84	Confident	74.2	Confident	21 Å²	21	72.7 Å²	72.7	14%	0.142	42%	0.415	C	S	.	.			trans	-56.5	-38.9	-172.8	179	0	0	0	0	112.8	C406 W408 R425 H436 H441	C406-C423 HydrophobicContact CB-CB 4.18Å; W408-C423 PolarHBondContact O-N 3.26Å; C423-R425 PolarHBondContact O-N 3.49Å; C423-H436 PolarHBondContact SG-CE1 2.97Å; C423-H436 PolarHBondContact SG-NE2 3.41Å; C423-H441 WeakPolarHBondContact CB-NE2 3.18Å
424	S	78.4	Confident	75.6	Confident	78 Å²	78	71.5 Å²	71.5	55%	0.545	41%	0.407	S	S	.	.			trans	58.3	9.1	170.1	-63.8	0	0	0	0	116.2	C406 P422	C406-S424 PolarHBondContact O-N 2.95Å; P422-S424 PolarHBondContact O-N 3.46Å; P422-S424 PolarHBondContact O-OG 3.11Å
425	R	86.1	Confident	76.9	Confident	120 Å²	120	68.9 Å²	68.9	45%	0.453	39%	0.388	S	S	.	.			trans	-66.8	145.6	169.6	-62.4	-173.1	-159.8	174.2	12	110.2	C406 C423 F427 E440	C406-R425 PolarHBondContact N-O 3.5Å; C423-R425 PolarHBondContact O-N 3.49Å; R425-F427 HydrophobicContact CB-CE2 3.59Å; R425-F427 HydrophobicContact CB-CZ 3.55Å; R425-E440 IonicContact CZ-OE2 3.01Å; R425-E440 IonicContact NH1-OE2 3.36Å; R425-E440 PolarHBondContact NH1-OE2 2.98Å; R425-E440 IonicContact NH2-OE2 3.49Å; R425-E440 PolarHBondContact NH2-OE2 3.44Å
426	V	86.9	Confident	78.5	Confident	85 Å²	85	64.8 Å²	64.8	52%	0.515	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	138.6	-176.9	-178.1	0	0	0	0	108.6	L403 Y404	L403-V426 HydrophobicContact CB-CG1 3.69Å; L403-V426 HydrophobicContact CD1-CG1 4.23Å; L403-V426 HydrophobicContact CD2-CG1 4.23Å; L403-V426 HydrophobicContact CG-CG1 4.27Å; Y404-V426 WeakPolarHBondContact O-CA 3.48Å
427	F	89.8	Confident	80.2	Confident	32 Å²	32	59.8 Å²	59.8	14%	0.14	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151.4	-175.1	-54.8	-85.1	0	0	0	110.3	Y404 C406 R425 E432 I433 H436	Y404-F427 PolarHBondContact N-O 3.4Å; Y404-F427 PolarHBondContact O-N 3.4Å; C406-F427 HydrophobicContact CB-CE2 4.38Å; R425-F427 HydrophobicContact CB-CE2 3.59Å; R425-F427 HydrophobicContact CB-CZ 3.55Å; F427-E432 HydrophobicContact CB-CB 4.02Å; F427-E432 HydrophobicContact CD1-CB 3.72Å; F427-E432 HydrophobicContact CG-CB 4.13Å; F427-I433 HydrophobicContact CB-CB 4.23Å; F427-I433 HydrophobicContact CD2-CB 3.63Å; F427-I433 HydrophobicContact CD2-CD1 4.26Å; F427-I433 HydrophobicContact CD2-CG1 3.88Å; F427-I433 HydrophobicContact CE2-CB 4.33Å; F427-I433 HydrophobicContact CE2-CG1 4.23Å; F427-I433 HydrophobicContact CG-CB 4.04Å; F427-H436 HydrophobicContact CE1-CB 3.87Å; F427-H436 HydrophobicContact CE2-CB 4.03Å; F427-H436 AromaticContact CE2-CD2 3.29Å; F427-H436 WeakPolarHBondContact CE2-CD2 3.44Å; F427-H436 AromaticContact CE2-CG 3.73Å; F427-H436 HydrophobicContact CZ-CB 3.44Å; F427-H436 VanDerWaalsContact CZ-CB 3.44Å; F427-H436 AromaticContact CZ-CD2 3.33Å; F427-H436 WeakPolarHBondContact CZ-CD2 3.43Å; F427-H436 AromaticContact CZ-CG 3.26Å
428	D	85.6	Confident	81.3	Confident	96 Å²	96	59.3 Å²	59.3	51%	0.513	32%	0.321	S	S	.	.	S	Bend	trans	-86	-11.4	175.3	67.4	18.8	0	0	0	113.2
429	S	86.8	Confident	82.3	Confident	38 Å²	38	63 Å²	63	27%	0.266	34%	0.337	S	S	.	.	S	Bend	trans	-136.6	138.3	-168	172.9	0	0	0	0	113.1	T431 E432 I433	S429-T431 PolarHBondContact O-N 2.78Å; S429-T431 PolarHBondContact OG-N 3.19Å; S429-E432 PolarHBondContact O-N 3.11Å; S429-E432 VanDerWaalsContact O-N 3.13Å; S429-I433 PolarHBondContact O-N 3.45Å
430	V	85.9	Confident	83.3	Confident	36 Å²	36	61.8 Å²	61.8	22%	0.218	33%	0.329	C	S	.	.	H	α-helix	trans	-55.2	-36.2	174.1	-174.9	0	0	0	0	111.6	Y404 I433 V434 E480	Y404-V430 HydrophobicContact CD1-CG2 4.36Å; Y404-V430 HydrophobicContact CE1-CG2 3.6Å; Y404-V430 HydrophobicContact CE2-CG2 3.96Å; Y404-V430 WeakPolarHBondContact OH-CG2 3.29Å; V430-I433 VanDerWaalsContact O-CG2 3.23Å; V430-I433 WeakPolarHBondContact O-CG2 3.43Å; V430-V434 WeakPolarHBondContact O-CB 3.15Å; V430-V434 VanDerWaalsContact O-CG2 3.26Å; V430-V434 WeakPolarHBondContact O-CG2 3.38Å; V430-V434 PolarHBondContact O-N 2.94Å; V430-V434 VanDerWaalsContact O-N 3.15Å; V430-E480 HydrophobicContact CG1-CB 3.81Å; V430-E480 HydrophobicContact CG1-CG 4.08Å
431	T	84.3	Confident	84.2	Confident	88 Å²	88	61.8 Å²	61.8	54%	0.54	33%	0.327	S	S	.	.	H	α-helix	trans	-68.9	-39.2	-178.9	-51.1	0	0	0	0	111.2	S429 V434 N435	S429-T431 PolarHBondContact O-N 2.78Å; S429-T431 PolarHBondContact OG-N 3.19Å; T431-V434 PolarHBondContact O-N 3.48Å; T431-N435 WeakPolarHBondContact O-CB 3.43Å; T431-N435 PolarHBondContact O-N 3.14Å; T431-N435 PolarHBondContact O-ND2 3.48Å
432	E	86.7	Confident	84.8	Confident	92 Å²	92	54 Å²	54	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-69.2	-46.5	-179.9	-68	-167.2	159.4	0	0	112.1	F427 S429 V434 N435 H436	F427-E432 HydrophobicContact CB-CB 4.02Å; F427-E432 HydrophobicContact CD1-CB 3.72Å; F427-E432 HydrophobicContact CG-CB 4.13Å; S429-E432 PolarHBondContact O-N 3.11Å; S429-E432 VanDerWaalsContact O-N 3.13Å; E432-V434 VanDerWaalsContact C-N 3.27Å; E432-V434 PolarHBondContact O-N 2.85Å; E432-N435 PolarHBondContact O-N 3.49Å; E432-H436 VanDerWaalsContact O-CB 3.31Å; E432-H436 WeakPolarHBondContact O-CB 3.49Å; E432-H436 PolarHBondContact O-N 3.5Å
433	I	88	Confident	84	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-62.3	-36.2	176.4	-173.1	166.7	0	0	0	111.6	Y404 Y405 F427 S429 V430 I437 W454 T478	Y404-I433 HydrophobicContact CD1-CG2 4.47Å; Y404-I433 HydrophobicContact CG-CG2 4.24Å; Y405-I433 VanDerWaalsContact O-CD1 3.26Å; Y405-I433 WeakPolarHBondContact O-CD1 3.35Å; F427-I433 HydrophobicContact CB-CB 4.23Å; F427-I433 HydrophobicContact CD2-CB 3.63Å; F427-I433 HydrophobicContact CD2-CD1 4.26Å; F427-I433 HydrophobicContact CD2-CG1 3.88Å; F427-I433 HydrophobicContact CE2-CB 4.33Å; F427-I433 HydrophobicContact CE2-CG1 4.23Å; F427-I433 HydrophobicContact CG-CB 4.04Å; S429-I433 PolarHBondContact O-N 3.45Å; V430-I433 VanDerWaalsContact O-CG2 3.23Å; V430-I433 WeakPolarHBondContact O-CG2 3.43Å; I433-I437 HydrophobicContact CD1-CD1 4.48Å; I433-I437 HydrophobicContact CG1-CD1 3.8Å; I433-I437 HydrophobicContact CG1-CG1 4.35Å; I433-I437 WeakPolarHBondContact O-CD1 3.29Å; I433-I437 WeakPolarHBondContact O-CG1 3.06Å; I433-I437 PolarHBondContact O-N 3.21Å; I433-W454 HydrophobicContact CD1-CH2 4.13Å; I433-T478 HydrophobicContact CG1-CG2 4.39Å; I433-T478 HydrophobicContact CG2-CG2 4.23Å
434	V	85.5	Confident	82.9	Confident	12 Å²	12	53 Å²	53	7%	0.073	30%	0.297	C	S	.	.	H	α-helix	trans	-66.5	-44.1	173.8	166	0	0	0	0	111.8	V430 T431 E432 I437 T438 T478 E480	V430-V434 WeakPolarHBondContact O-CB 3.15Å; V430-V434 VanDerWaalsContact O-CG2 3.26Å; V430-V434 WeakPolarHBondContact O-CG2 3.38Å; V430-V434 PolarHBondContact O-N 2.94Å; V430-V434 VanDerWaalsContact O-N 3.15Å; T431-V434 PolarHBondContact O-N 3.48Å; E432-V434 VanDerWaalsContact C-N 3.27Å; E432-V434 PolarHBondContact O-N 2.85Å; V434-I437 PolarHBondContact O-N 3.07Å; V434-T438 WeakPolarHBondContact O-CB 3.34Å; V434-T438 PolarHBondContact O-N 3.5Å; V434-T438 PolarHBondContact O-OG1 3.36Å; V434-T478 HydrophobicContact CG2-CG2 3.87Å; V434-T478 WeakPolarHBondContact CG2-OG1 3.3Å; V434-E480 WeakPolarHBondContact CG1-OE2 3.37Å; V434-E480 HydrophobicContact CG2-CB 3.84Å; V434-E480 HydrophobicContact CG2-CG 3.93Å; V434-E480 WeakPolarHBondContact CG2-OE2 3.13Å
435	N	85.3	Confident	81.8	Confident	87 Å²	87	53.8 Å²	53.8	47%	0.465	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-47.5	176	-74.2	-17.5	0	0	0	110.8	T431 E432 I437 T438 L439	T431-N435 WeakPolarHBondContact O-CB 3.43Å; T431-N435 PolarHBondContact O-N 3.14Å; T431-N435 PolarHBondContact O-ND2 3.48Å; E432-N435 PolarHBondContact O-N 3.49Å; N435-I437 PolarHBondContact O-N 3.33Å; N435-T438 PolarHBondContact O-N 3.36Å; N435-L439 WeakPolarHBondContact O-CB 3.21Å; N435-L439 VanDerWaalsContact O-CG 3.29Å; N435-L439 WeakPolarHBondContact O-CG 3.4Å; N435-L439 PolarHBondContact O-N 3.4Å
436	H	88.6	Confident	80.3	Confident	13 Å²	13	56.5 Å²	56.5	6%	0.06	32%	0.318	C	S	.	.	H	α-helix	trans	-55	-51.9	175.3	161.4	51.6	0	0	0	112.4	C406 C423 F427 E432 T438 L439 E440 H441	C406-H436 WeakPolarHBondContact CB-NE2 3.5Å; C406-H436 PolarHBondContact SG-NE2 2.77Å; C423-H436 PolarHBondContact SG-CE1 2.97Å; C423-H436 PolarHBondContact SG-NE2 3.41Å; F427-H436 HydrophobicContact CE1-CB 3.87Å; F427-H436 HydrophobicContact CE2-CB 4.03Å; F427-H436 AromaticContact CE2-CD2 3.29Å; F427-H436 WeakPolarHBondContact CE2-CD2 3.44Å; F427-H436 AromaticContact CE2-CG 3.73Å; F427-H436 HydrophobicContact CZ-CB 3.44Å; F427-H436 VanDerWaalsContact CZ-CB 3.44Å; F427-H436 AromaticContact CZ-CD2 3.33Å; F427-H436 WeakPolarHBondContact CZ-CD2 3.43Å; F427-H436 AromaticContact CZ-CG 3.26Å; E432-H436 VanDerWaalsContact O-CB 3.31Å; E432-H436 WeakPolarHBondContact O-CB 3.49Å; E432-H436 PolarHBondContact O-N 3.5Å; H436-T438 VanDerWaalsContact C-N 3.31Å; H436-T438 PolarHBondContact O-N 3.08Å; H436-L439 PolarHBondContact O-N 3.19Å; H436-E440 WeakPolarHBondContact ND1-CG 3.27Å; H436-E440 WeakPolarHBondContact O-CB 2.95Å; H436-E440 WeakPolarHBondContact O-CG 3.31Å; H436-E440 PolarHBondContact O-N 3.2Å; H436-H441 AromaticContact CE1-CD2 3.68Å; H436-H441 AromaticContact NE2-CD2 3.65Å
437	I	86.4	Confident	79.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.304	C	S	.	.	I	π-helix	trans	-64.7	-38.9	178.2	-61	158.9	0	0	0	110.5	W408 I433 V434 N435 L439 H441 V442 W454 I474 T478	W408-I437 HydrophobicContact CE3-CG2 3.84Å; W408-I437 HydrophobicContact CZ3-CG2 3.79Å; I433-I437 HydrophobicContact CD1-CD1 4.48Å; I433-I437 HydrophobicContact CG1-CD1 3.8Å; I433-I437 HydrophobicContact CG1-CG1 4.35Å; I433-I437 WeakPolarHBondContact O-CD1 3.29Å; I433-I437 WeakPolarHBondContact O-CG1 3.06Å; I433-I437 PolarHBondContact O-N 3.21Å; V434-I437 PolarHBondContact O-N 3.07Å; N435-I437 PolarHBondContact O-N 3.33Å; I437-L439 VanDerWaalsContact C-N 3.32Å; I437-L439 PolarHBondContact O-N 3.36Å; I437-H441 HydrophobicContact CG2-CB 4.14Å; I437-H441 CarbonylContact O-C 3.18Å; I437-H441 WeakPolarHBondContact O-CA 3.29Å; I437-H441 PolarHBondContact O-N 3.19Å; I437-H441 VanDerWaalsContact O-N 3.11Å; I437-V442 HydrophobicContact CG2-CG2 4.17Å; I437-V442 WeakPolarHBondContact O-CG2 3.46Å; I437-V442 PolarHBondContact O-N 3.07Å; I437-W454 HydrophobicContact CD1-CE3 4.31Å; I437-W454 HydrophobicContact CD1-CH2 4.11Å; I437-W454 HydrophobicContact CD1-CZ3 3.49Å; I437-W454 VanDerWaalsContact CD1-CZ3 3.49Å; I437-W454 HydrophobicContact CG1-CZ3 4.2Å; I437-I474 HydrophobicContact CB-CG2 4.36Å; I437-I474 HydrophobicContact CD1-CG2 3.99Å; I437-I474 HydrophobicContact CG2-CD1 3.8Å; I437-I474 HydrophobicContact CG2-CG1 4.29Å; I437-I474 HydrophobicContact CG2-CG2 3.86Å; I437-T478 HydrophobicContact CD1-CG2 3.5Å
438	T	83.8	Confident	77.8	Confident	42 Å²	42	61 Å²	61	26%	0.258	34%	0.338	S	S	.	.	I	π-helix	trans	-69.5	-28	-178.1	-57.2	0	0	0	0	113	V434 N435 H436 V442 G443	V434-T438 WeakPolarHBondContact O-CB 3.34Å; V434-T438 PolarHBondContact O-N 3.5Å; V434-T438 PolarHBondContact O-OG1 3.36Å; N435-T438 PolarHBondContact O-N 3.36Å; H436-T438 VanDerWaalsContact C-N 3.31Å; H436-T438 PolarHBondContact O-N 3.08Å; T438-V442 CarbonylContact O-C 3.28Å; T438-G443 WeakPolarHBondContact O-CA 3.36Å; T438-G443 PolarHBondContact O-N 3.01Å
439	L	82.7	Confident	77.3	Confident	117 Å²	117	61.2 Å²	61.2	61%	0.613	34%	0.34	S	S	*	.	I	π-helix	trans	-91.7	-57.3	178.3	-66.9	171.4	0	0	0	112.2	N435 H436 I437 G443	N435-L439 WeakPolarHBondContact O-CB 3.21Å; N435-L439 VanDerWaalsContact O-CG 3.29Å; N435-L439 WeakPolarHBondContact O-CG 3.4Å; N435-L439 PolarHBondContact O-N 3.4Å; H436-L439 PolarHBondContact O-N 3.19Å; I437-L439 VanDerWaalsContact C-N 3.32Å; I437-L439 PolarHBondContact O-N 3.36Å; L439-G443 WeakPolarHBondContact O-CA 3.38Å; L439-G443 PolarHBondContact O-N 2.83Å; L439-G443 VanDerWaalsContact O-N 3.11Å
440	E	82.4	Confident	77.2	Confident	100 Å²	100	61.9 Å²	61.9	47%	0.467	34%	0.338	S	S	.	.	I	π-helix	trans	-76.2	-48.7	-173.9	-48.7	-69.7	88.7	0	0	111.4	R425 H436	R425-E440 IonicContact CZ-OE2 3.01Å; R425-E440 IonicContact NH1-OE2 3.36Å; R425-E440 PolarHBondContact NH1-OE2 2.98Å; R425-E440 IonicContact NH2-OE2 3.49Å; R425-E440 PolarHBondContact NH2-OE2 3.44Å; H436-E440 WeakPolarHBondContact ND1-CG 3.27Å; H436-E440 WeakPolarHBondContact O-CB 2.95Å; H436-E440 WeakPolarHBondContact O-CG 3.31Å; H436-E440 PolarHBondContact O-N 3.2Å
441	H	83.1	Confident	77.3	Confident	14 Å²	14	60.3 Å²	60.3	7%	0.065	33%	0.329	C	S	.	.	I	π-helix	trans	-100.2	-4.7	-168.1	-62.4	-61.7	0	0	0	114.8	W408 D410 C423 H436 I437 Q447	W408-H441 AromaticContact CD1-CE1 3.01Å; W408-H441 AromaticContact CD1-CG 3.64Å; W408-H441 AromaticContact CD1-ND1 3.24Å; W408-H441 HydrophobicContact CD2-CB 3.64Å; W408-H441 AromaticContact CD2-CG 3.85Å; W408-H441 HydrophobicContact CE3-CB 4.03Å; W408-H441 HydrophobicContact CG-CB 3.92Å; W408-H441 AromaticContact CG-CD2 3.95Å; W408-H441 AromaticContact CG-CE1 3.72Å; W408-H441 AromaticContact CG-CG 3.56Å; W408-H441 AromaticContact CG-ND1 3.59Å; W408-H441 HydrophobicContact CH2-CB 4.42Å; W408-H441 HydrophobicContact CZ2-CB 4.07Å; W408-H441 WeakPolarHBondContact CZ2-O 3.24Å; W408-H441 HydrophobicContact CZ3-CB 4.41Å; W408-H441 AromaticContact NE1-CE1 3.27Å; W408-H441 PolarHBondContact NE1-CE1 3.43Å; W408-H441 VanDerWaalsContact NE1-CE1 3.27Å; W408-H441 AromaticContact NE1-CG 3.95Å; W408-H441 AromaticContact NE1-ND1 3.71Å; D410-H441 IonicContact OD1-CE1 3.16Å; D410-H441 PolarHBondContact OD1-CE1 3.44Å; D410-H441 IonicContact OD1-ND1 2.71Å; D410-H441 PolarHBondContact OD1-ND1 2.66Å; D410-H441 IonicContact OD1-NE2 2.74Å; D410-H441 PolarHBondContact OD1-NE2 3.49Å; D410-H441 IonicContact OD2-CE1 2.11Å; D410-H441 PolarHBondContact OD2-CE1 2.92Å; D410-H441 VanDerWaalsContact OD2-CE1 3.3Å; D410-H441 IonicContact OD2-ND1 2.99Å; D410-H441 IonicContact OD2-NE2 3.24Å; D410-H441 PolarHBondContact OD2-NE2 2.74Å; C423-H441 WeakPolarHBondContact CB-NE2 3.18Å; H436-H441 AromaticContact CE1-CD2 3.68Å; H436-H441 AromaticContact NE2-CD2 3.65Å; I437-H441 HydrophobicContact CG2-CB 4.14Å; I437-H441 CarbonylContact O-C 3.18Å; I437-H441 WeakPolarHBondContact O-CA 3.29Å; I437-H441 PolarHBondContact O-N 3.19Å; I437-H441 VanDerWaalsContact O-N 3.11Å; H441-Q447 PolarHBondContact O-NE2 2.82Å; H441-Q447 PolarHBondContact O-OE1 3.41Å
442	V	80.3	Confident	77.5	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.018	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	-11.7	176.7	-172.9	0	0	0	0	111.6	W408 I437 T438 K467 L470 V471 I474	W408-V442 HydrophobicContact CH2-CG2 4.05Å; W408-V442 HydrophobicContact CZ3-CG2 4.42Å; I437-V442 HydrophobicContact CG2-CG2 4.17Å; I437-V442 WeakPolarHBondContact O-CG2 3.46Å; I437-V442 PolarHBondContact O-N 3.07Å; T438-V442 CarbonylContact O-C 3.28Å; V442-K467 HydrophobicContact CG1-CD 4.32Å; V442-K467 HydrophobicContact CG1-CG 4.01Å; V442-K467 WeakPolarHBondContact O-CE 3.43Å; V442-K467 PolarHBondContact O-NZ 2.94Å; V442-L470 HydrophobicContact CG1-CD2 3.85Å; V442-L470 HydrophobicContact CG1-CG 4.35Å; V442-L470 HydrophobicContact CG2-CD2 4.02Å; V442-L470 HydrophobicContact CG2-CG 4.33Å; V442-V471 HydrophobicContact CG1-CG2 4.14Å; V442-I474 HydrophobicContact CG2-CD1 3.48Å; V442-I474 VanDerWaalsContact CG2-CD1 3.48Å
443	G	62.8	Low	77.6	Confident	20 Å²	20	55.4 Å²	55.4	21%	0.206	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-38.4	-170.2	0	0	0	0	0	113.8	T438 L439 K467	T438-G443 WeakPolarHBondContact O-CA 3.36Å; T438-G443 PolarHBondContact O-N 3.01Å; L439-G443 WeakPolarHBondContact O-CA 3.38Å; L439-G443 PolarHBondContact O-N 2.83Å; L439-G443 VanDerWaalsContact O-N 3.11Å; G443-K467 PolarHBondContact O-NZ 3.12Å
444	G	61.4	Low	77.6	Confident	36 Å²	36	56.3 Å²	56.3	37%	0.371	30%	0.301	S	S	.	.	S	Bend	trans	-59	155.2	-174.8	0	0	0	0	0	115.2	E446	G444-E446 PolarHBondContact O-N 3.2Å
445	P	54.9	Low	77.5	Confident	95 Å²	95	58.7 Å²	58.7	62%	0.617	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-14.1	178.2	31.3	-34.5	0	0	0	113.3	Q447 W1213	P445-Q447 PolarHBondContact O-N 2.77Å; P445-W1213 HydrophobicContact CB-CH2 4.01Å; P445-W1213 HydrophobicContact CB-CZ2 4.11Å; P445-W1213 HydrophobicContact CG-CH2 4.43Å
446	E	55.9	Low	77.4	Confident	177 Å²	177	59.2 Å²	59.2	83%	0.827	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-16.8	-170	-60.9	174.2	178.6	0	0	113.9	G444 L448	G444-E446 PolarHBondContact O-N 3.2Å; E446-L448 VanDerWaalsContact C-N 3.27Å; E446-L448 PolarHBondContact O-N 3.27Å
447	Q	61.2	Low	77.4	Confident	46 Å²	46	59 Å²	59	22%	0.215	31%	0.313	C	S	.	.			trans	-80.4	73.1	176.3	-74.3	-171.4	-0.6	0	0	112.4	H441 P445 D449	H441-Q447 PolarHBondContact O-NE2 2.82Å; H441-Q447 PolarHBondContact O-OE1 3.41Å; P445-Q447 PolarHBondContact O-N 2.77Å; Q447-D449 VanDerWaalsContact C-N 3.26Å; Q447-D449 PolarHBondContact O-N 2.73Å
448	L	62	Low	77.4	Confident	165 Å²	165	64.6 Å²	64.6	86%	0.864	34%	0.341	S	S	*	.	S	Bend	trans	-51.9	-46.1	167.9	-71.4	163.5	0	0	0	111.2	E446	E446-L448 VanDerWaalsContact C-N 3.27Å; E446-L448 PolarHBondContact O-N 3.27Å
449	D	75	Confident	77.4	Confident	101 Å²	101	66.1 Å²	66.1	54%	0.54	34%	0.342	S	S	.	.	S	Bend	trans	-91.7	120.2	168.1	-92	-46.1	0	0	0	110.6	Q447 T451 P463	Q447-D449 VanDerWaalsContact C-N 3.26Å; Q447-D449 PolarHBondContact O-N 2.73Å; D449-T451 PolarHBondContact O-N 2.95Å; D449-P463 HydrophobicContact CB-CB 4.18Å; D449-P463 WeakPolarHBondContact OD1-CB 3.44Å
450	H	84.8	Confident	77.1	Confident	52 Å²	52	64.9 Å²	64.9	24%	0.241	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-76.5	70.2	175.4	-51.8	-43.6	0	0	0	111	F464 A466 K467 L470	H450-F464 HydrophobicContact CB-CB 4.22Å; H450-F464 WeakPolarHBondContact CB-O 3.27Å; H450-F464 PolarHBondContact CD2-O 3.26Å; H450-F464 WeakPolarHBondContact O-CB 3.39Å; H450-F464 WeakPolarHBondContact O-CD2 3.34Å; H450-F464 PolarHBondContact O-N 3.08Å; H450-A466 WeakPolarHBondContact CD2-CA 3.28Å; H450-K467 PolarHBondContact CD2-N 3.26Å; H450-K467 PolarHBondContact NE2-N 2.91Å; H450-K467 VanDerWaalsContact NE2-N 3.16Å; H450-L470 HydrophobicContact CB-CB 4.39Å; H450-L470 HydrophobicContact CB-CD2 4.12Å
451	T	87.5	Confident	76.8	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.018	33%	0.33	C	S	.	.			trans	-95.9	150.4	-175.8	-69.6	0	0	0	0	112.2	D449 Y453 G461 P463 L470	D449-T451 PolarHBondContact O-N 2.95Å; T451-Y453 HydrophobicContact CG2-CD1 3.91Å; T451-Y453 HydrophobicContact CG2-CD2 4.03Å; T451-Y453 HydrophobicContact CG2-CE1 3.46Å; T451-Y453 VanDerWaalsContact CG2-CE1 3.46Å; T451-Y453 HydrophobicContact CG2-CE2 3.58Å; T451-Y453 HydrophobicContact CG2-CG 4.19Å; T451-G461 WeakPolarHBondContact CG2-O 3.43Å; T451-P463 WeakPolarHBondContact OG1-CA 3.24Å; T451-L470 WeakPolarHBondContact O-CD2 3.07Å
452	C	90.2	Very high	76.9	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.02	34%	0.338	C	S	.	.			trans	-103	116.8	170.6	-173.2	0	0	0	0	109.8	W408 F464 L470 H477	W408-C452 HydrophobicContact CH2-CB 4.49Å; C452-F464 HydrophobicContact CB-CE2 4.32Å; C452-L470 HydrophobicContact CB-CD1 3.57Å; C452-H477 PolarHBondContact SG-NE2 2.75Å; C452-H477 VanDerWaalsContact SG-NE2 3.44Å
453	Y	87.1	Confident	77.2	Confident	74 Å²	74	65.9 Å²	65.9	29%	0.29	35%	0.354	S	S	.	.			trans	-105.9	32.5	174.7	-52.2	-82.8	0	0	0	112	W408 I409 P411 T451	W408-Y453 AromaticContact CZ2-CD2 3.93Å; W408-Y453 HydrophobicContact CZ2-CD2 3.93Å; W408-Y453 AromaticContact NE1-CD2 3.98Å; I409-Y453 PolarHBondContact N-O 3.09Å; I409-Y453 WeakPolarHBondContact O-CB 3.46Å; P411-Y453 HydrophobicContact CB-CD1 4.04Å; P411-Y453 HydrophobicContact CB-CE1 3.69Å; P411-Y453 HydrophobicContact CB-CE2 4.22Å; P411-Y453 HydrophobicContact CB-CG 4.43Å; P411-Y453 HydrophobicContact CG-CD2 4.15Å; P411-Y453 HydrophobicContact CG-CE1 4.16Å; P411-Y453 HydrophobicContact CG-CE2 3.75Å; T451-Y453 HydrophobicContact CG2-CD1 3.91Å; T451-Y453 HydrophobicContact CG2-CD2 4.03Å; T451-Y453 HydrophobicContact CG2-CE1 3.46Å; T451-Y453 VanDerWaalsContact CG2-CE1 3.46Å; T451-Y453 HydrophobicContact CG2-CE2 3.58Å; T451-Y453 HydrophobicContact CG2-CG 4.19Å
454	W	88.4	Confident	78.3	Confident	23 Å²	23	66.3 Å²	66.3	9%	0.087	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-69.6	135.6	170.2	-167.3	-92.4	0	0	0	109.9	Y405 Q407 W408 I433 I437 C457 H477	Y405-W454 WeakPolarHBondContact O-CH2 3.37Å; Q407-W454 HydrophobicContact CB-CD2 4.08Å; Q407-W454 HydrophobicContact CB-CE3 4.48Å; Q407-W454 HydrophobicContact CB-CH2 4.18Å; Q407-W454 HydrophobicContact CB-CZ2 3.7Å; W408-W454 HydrophobicContact CB-CE3 4.36Å; W408-W454 HydrophobicContact CE3-CE3 4.15Å; I433-W454 HydrophobicContact CD1-CH2 4.13Å; I437-W454 HydrophobicContact CD1-CE3 4.31Å; I437-W454 HydrophobicContact CD1-CH2 4.11Å; I437-W454 HydrophobicContact CD1-CZ3 3.49Å; I437-W454 VanDerWaalsContact CD1-CZ3 3.49Å; I437-W454 HydrophobicContact CG1-CZ3 4.2Å; W454-C457 HydrophobicContact CB-CB 4.24Å; W454-C457 WeakPolarHBondContact O-CB 3.44Å; W454-C457 PolarHBondContact O-N 3.25Å; W454-H477 AromaticContact CD1-CD2 3.79Å; W454-H477 AromaticContact CD1-CE1 3.93Å; W454-H477 AromaticContact CD1-CG 3.51Å; W454-H477 AromaticContact CD1-ND1 3.66Å; W454-H477 HydrophobicContact CD2-CB 3.85Å; W454-H477 HydrophobicContact CG-CB 4.01Å; W454-H477 AromaticContact CG-CD2 3.5Å; W454-H477 VanDerWaalsContact CG-CD2 3.5Å; W454-H477 AromaticContact CG-CG 3.65Å; W454-H477 AromaticContact CG-NE2 3.91Å; W454-H477 HydrophobicContact CZ2-CB 4.04Å; W454-H477 AromaticContact NE1-CG 3.86Å
455	K	84.6	Confident	79.6	Confident	62 Å²	62	75 Å²	75	27%	0.27	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	139.3	175.9	-166.5	-161	173.6	-161.1	0	111.2	Q407 I409 C457 Y947	Q407-K455 HydrophobicContact CB-CB 3.95Å; Q407-K455 HydrophobicContact CG-CB 4.28Å; Q407-K455 HydrophobicContact CG-CD 4.19Å; Q407-K455 WeakPolarHBondContact O-CB 3.23Å; Q407-K455 PolarHBondContact O-N 3.11Å; I409-K455 HydrophobicContact CD1-CB 4.17Å; I409-K455 HydrophobicContact CD1-CG 4.21Å; K455-C457 PolarHBondContact O-N 2.88Å; K455-Y947 HydrophobicContact CD-CE2 4.41Å; K455-Y947 VanDerWaalsContact CE-CE2 3.41Å; K455-Y947 VanDerWaalsContact CE-CZ 3.42Å; K455-Y947 WeakPolarHBondContact CE-OH 3.38Å; K455-Y947 HydrophobicContact CG-CE2 4.04Å; K455-Y947 PolarHBondContact NZ-OH 2.78Å; K455-Y947 VanDerWaalsContact NZ-OH 3.09Å
456	D	83	Confident	81.1	Confident	98 Å²	98	71.5 Å²	71.5	52%	0.524	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	20.6	178.1	-53.7	-49.1	0	0	0	114.5	I458 Y947	D456-I458 PolarHBondContact O-N 3.47Å; D456-Y947 VanDerWaalsContact OD1-CD1 3.29Å; D456-Y947 WeakPolarHBondContact OD1-CD1 3.42Å; D456-Y947 VanDerWaalsContact OD1-CE1 3.31Å; D456-Y947 WeakPolarHBondContact OD1-CE1 3.27Å
457	C	88.6	Confident	82.6	Confident	8 Å²	8	66.3 Å²	66.3	5%	0.054	33%	0.331	C	S	.	.			trans	-70.7	116.7	178.1	177.8	0	0	0	0	112.2	W454 K455 R459 D460 H473	W454-C457 HydrophobicContact CB-CB 4.24Å; W454-C457 WeakPolarHBondContact O-CB 3.44Å; W454-C457 PolarHBondContact O-N 3.25Å; K455-C457 PolarHBondContact O-N 2.88Å; C457-R459 PolarHBondContact O-N 3.09Å; C457-D460 PolarHBondContact O-N 3.37Å; C457-H473 PolarHBondContact SG-NE2 2.88Å
458	I	84.9	Confident	83.8	Confident	117 Å²	117	67.7 Å²	67.7	60%	0.6	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	5.9	177.5	-157.1	171.6	0	0	0	116.6	D456	D456-I458 PolarHBondContact O-N 3.47Å
459	R	84.8	Confident	85.1	Confident	75 Å²	75	64.6 Å²	64.6	28%	0.283	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-4.8	173.9	-82	-176.7	56	112.2	-0.4	113.9	C457 G461 K462 P463 F464	C457-R459 PolarHBondContact O-N 3.09Å; R459-G461 VanDerWaalsContact C-N 3.35Å; R459-G461 PolarHBondContact O-N 3.35Å; R459-K462 PolarHBondContact NH2-O 2.68Å; R459-K462 VanDerWaalsContact O-CB 3.26Å; R459-K462 WeakPolarHBondContact O-CB 3.47Å; R459-K462 WeakPolarHBondContact O-CD 3.35Å; R459-K462 WeakPolarHBondContact O-CG 3.23Å; R459-K462 PolarHBondContact O-N 3.46Å; R459-P463 VanDerWaalsContact NH2-C 3.32Å; R459-P463 PolarHBondContact NH2-O 3.08Å; R459-F464 VanDerWaalsContact NE-CE2 3.27Å
460	D	76.9	Confident	85.9	Confident	90 Å²	90	59.8 Å²	59.8	48%	0.481	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	51.7	167.8	-48.2	-39.1	0	0	0	112.8	C457 K462 Y1322	C457-D460 PolarHBondContact O-N 3.37Å; D460-K462 VanDerWaalsContact C-N 3.28Å; D460-K462 PolarHBondContact O-N 3.22Å; D460-Y1322 WeakPolarHBondContact CB-OH 3.15Å; D460-Y1322 PolarHBondContact O-OH 2.9Å
461	G	76	Confident	86	Confident	33 Å²	33	58.8 Å²	58.8	34%	0.34	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	12.2	179.5	0	0	0	0	0	116.3	T451 R459	T451-G461 WeakPolarHBondContact CG2-O 3.43Å; R459-G461 VanDerWaalsContact C-N 3.35Å; R459-G461 PolarHBondContact O-N 3.35Å
462	K	84.1	Confident	86.1	Confident	51 Å²	51	61.2 Å²	61.2	22%	0.222	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-70.4	129.9	178.8	-71.2	169	-172.4	174.7	0	112.3	R459 D460 S1321 Y1322	R459-K462 PolarHBondContact NH2-O 2.68Å; R459-K462 VanDerWaalsContact O-CB 3.26Å; R459-K462 WeakPolarHBondContact O-CB 3.47Å; R459-K462 WeakPolarHBondContact O-CD 3.35Å; R459-K462 WeakPolarHBondContact O-CG 3.23Å; R459-K462 PolarHBondContact O-N 3.46Å; D460-K462 VanDerWaalsContact C-N 3.28Å; D460-K462 PolarHBondContact O-N 3.22Å; K462-S1321 PolarHBondContact NZ-OG 2.79Å; K462-Y1322 HydrophobicContact CD-CE1 4.31Å; K462-Y1322 VanDerWaalsContact CE-CD1 3.41Å; K462-Y1322 HydrophobicContact CG-CE1 4.11Å; K462-Y1322 VanDerWaalsContact NZ-CD2 3.29Å; K462-Y1322 VanDerWaalsContact NZ-CE2 3.34Å
463	P	86.4	Confident	86.1	Confident	55 Å²	55	62 Å²	62	36%	0.357	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-67.8	151.8	-179.9	25.5	-33.9	0	0	0	113.5	D449 T451 R459	D449-P463 HydrophobicContact CB-CB 4.18Å; D449-P463 WeakPolarHBondContact OD1-CB 3.44Å; T451-P463 WeakPolarHBondContact OG1-CA 3.24Å; R459-P463 VanDerWaalsContact NH2-C 3.32Å; R459-P463 PolarHBondContact NH2-O 3.08Å
464	F	87.6	Confident	86.2	Confident	28 Å²	28	58.7 Å²	58.7	12%	0.123	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-97.4	140.1	172.4	-75	-92.3	0	0	0	111	H450 C452 R459 A466 K469 L470 H473	H450-F464 HydrophobicContact CB-CB 4.22Å; H450-F464 WeakPolarHBondContact CB-O 3.27Å; H450-F464 PolarHBondContact CD2-O 3.26Å; H450-F464 WeakPolarHBondContact O-CB 3.39Å; H450-F464 WeakPolarHBondContact O-CD2 3.34Å; H450-F464 PolarHBondContact O-N 3.08Å; C452-F464 HydrophobicContact CB-CE2 4.32Å; R459-F464 VanDerWaalsContact NE-CE2 3.27Å; F464-A466 PolarHBondContact O-N 3.09Å; F464-K469 HydrophobicContact CB-CB 4.13Å; F464-K469 HydrophobicContact CD1-CB 3.6Å; F464-K469 HydrophobicContact CE1-CB 4.39Å; F464-K469 HydrophobicContact CG-CB 4.22Å; F464-L470 HydrophobicContact CB-CB 4.28Å; F464-L470 HydrophobicContact CD2-CB 3.95Å; F464-L470 HydrophobicContact CD2-CD1 3.92Å; F464-L470 HydrophobicContact CE2-CD1 3.96Å; F464-L470 HydrophobicContact CG-CB 4.19Å; F464-H473 HydrophobicContact CE1-CB 3.89Å; F464-H473 HydrophobicContact CE2-CB 4.11Å; F464-H473 AromaticContact CE2-CD2 3.4Å; F464-H473 WeakPolarHBondContact CE2-CD2 3.34Å; F464-H473 AromaticContact CE2-CG 3.93Å; F464-H473 HydrophobicContact CZ-CB 3.38Å; F464-H473 AromaticContact CZ-CD2 3.31Å; F464-H473 WeakPolarHBondContact CZ-CD2 3.39Å; F464-H473 AromaticContact CZ-CG 3.34Å
465	K	87.8	Confident	86.2	Confident	218 Å²	218	59.6 Å²	59.6	95%	0.948	29%	0.293	S	S	*	.	S	Bend	trans	-65.2	-1.3	178.2	-61.4	-161.5	175.7	-160.3	0	115.7
466	A	87.1	Confident	86.4	Confident	22 Å²	22	61.6 Å²	61.6	18%	0.182	31%	0.311	C	S	.	.	S	Bend	trans	-167.3	143	174.9	0	0	0	0	0	111.8	H450 F464 Y468 K469 L470	H450-A466 WeakPolarHBondContact CD2-CA 3.28Å; F464-A466 PolarHBondContact O-N 3.09Å; A466-Y468 VanDerWaalsContact C-N 3.26Å; A466-Y468 HydrophobicContact CB-CD1 3.53Å; A466-Y468 HydrophobicContact CB-CE1 3.48Å; A466-Y468 VanDerWaalsContact CB-CE1 3.48Å; A466-Y468 PolarHBondContact O-N 3.29Å; A466-Y468 VanDerWaalsContact O-N 3.16Å; A466-K469 HydrophobicContact CB-CG 4.35Å; A466-K469 WeakPolarHBondContact O-CB 3.3Å; A466-K469 PolarHBondContact O-N 2.89Å; A466-L470 PolarHBondContact O-N 3.41Å
467	K	87.4	Confident	86.7	Confident	69 Å²	69	59.1 Å²	59.1	30%	0.3	30%	0.296	S	S	.	.	H	α-helix	trans	-49	-41.6	177.7	179.8	157.7	168.4	159.9	0	113.3	V442 G443 H450 K469 L470 V471	V442-K467 HydrophobicContact CG1-CD 4.32Å; V442-K467 HydrophobicContact CG1-CG 4.01Å; V442-K467 WeakPolarHBondContact O-CE 3.43Å; V442-K467 PolarHBondContact O-NZ 2.94Å; G443-K467 PolarHBondContact O-NZ 3.12Å; H450-K467 PolarHBondContact CD2-N 3.26Å; H450-K467 PolarHBondContact NE2-N 2.91Å; H450-K467 VanDerWaalsContact NE2-N 3.16Å; K467-K469 VanDerWaalsContact C-N 3.26Å; K467-K469 PolarHBondContact O-N 3.14Å; K467-L470 WeakPolarHBondContact O-CB 3.04Å; K467-L470 PolarHBondContact O-N 2.9Å; K467-L470 VanDerWaalsContact O-N 3.13Å; K467-V471 WeakPolarHBondContact O-CG2 3.3Å; K467-V471 PolarHBondContact O-N 3.44Å
468	Y	86.4	Confident	86.6	Confident	75 Å²	75	59.2 Å²	59.2	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-25.4	178.1	82.9	-93.6	0	0	0	113.9	A466 N472 Y1210	A466-Y468 VanDerWaalsContact C-N 3.26Å; A466-Y468 HydrophobicContact CB-CD1 3.53Å; A466-Y468 HydrophobicContact CB-CE1 3.48Å; A466-Y468 VanDerWaalsContact CB-CE1 3.48Å; A466-Y468 PolarHBondContact O-N 3.29Å; A466-Y468 VanDerWaalsContact O-N 3.16Å; Y468-N472 WeakPolarHBondContact O-CB 3.37Å; Y468-N472 PolarHBondContact O-N 3.18Å; Y468-N472 PolarHBondContact O-ND2 3.24Å; Y468-Y1210 HydrophobicContact CD1-CD2 4.36Å; Y468-Y1210 HydrophobicContact CD1-CE2 4.16Å; Y468-Y1210 HydrophobicContact CG-CE2 4.31Å
469	K	89.3	Confident	86.7	Confident	99 Å²	99	55.5 Å²	55.5	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-74.8	-37.1	174.1	-61.6	-66.7	-159.6	-145.9	0	111.3	F464 A466 K467 N472 H473	F464-K469 HydrophobicContact CB-CB 4.13Å; F464-K469 HydrophobicContact CD1-CB 3.6Å; F464-K469 HydrophobicContact CE1-CB 4.39Å; F464-K469 HydrophobicContact CG-CB 4.22Å; A466-K469 HydrophobicContact CB-CG 4.35Å; A466-K469 WeakPolarHBondContact O-CB 3.3Å; A466-K469 PolarHBondContact O-N 2.89Å; K467-K469 VanDerWaalsContact C-N 3.26Å; K467-K469 PolarHBondContact O-N 3.14Å; K469-N472 PolarHBondContact O-N 2.92Å; K469-H473 WeakPolarHBondContact O-CB 3.21Å; K469-H473 PolarHBondContact O-N 2.85Å
470	L	90.4	Very high	86.9	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-49	172.5	172.7	58.8	0	0	0	110.6	W408 V442 H450 T451 C452 F464 A466 K467 N472 H473 I474	W408-L470 HydrophobicContact CH2-CD1 4.4Å; V442-L470 HydrophobicContact CG1-CD2 3.85Å; V442-L470 HydrophobicContact CG1-CG 4.35Å; V442-L470 HydrophobicContact CG2-CD2 4.02Å; V442-L470 HydrophobicContact CG2-CG 4.33Å; H450-L470 HydrophobicContact CB-CB 4.39Å; H450-L470 HydrophobicContact CB-CD2 4.12Å; T451-L470 WeakPolarHBondContact O-CD2 3.07Å; C452-L470 HydrophobicContact CB-CD1 3.57Å; F464-L470 HydrophobicContact CB-CB 4.28Å; F464-L470 HydrophobicContact CD2-CB 3.95Å; F464-L470 HydrophobicContact CD2-CD1 3.92Å; F464-L470 HydrophobicContact CE2-CD1 3.96Å; F464-L470 HydrophobicContact CG-CB 4.19Å; A466-L470 PolarHBondContact O-N 3.41Å; K467-L470 WeakPolarHBondContact O-CB 3.04Å; K467-L470 PolarHBondContact O-N 2.9Å; K467-L470 VanDerWaalsContact O-N 3.13Å; L470-N472 PolarHBondContact O-N 2.85Å; L470-H473 CarbonylContact O-C 3.5Å; L470-H473 WeakPolarHBondContact O-CA 3.18Å; L470-H473 WeakPolarHBondContact O-CB 3.45Å; L470-H473 PolarHBondContact O-N 3.44Å; L470-I474 HydrophobicContact CD1-CD1 3.91Å; L470-I474 HydrophobicContact CD1-CG1 4.25Å; L470-I474 HydrophobicContact CG-CD1 3.88Å; L470-I474 WeakPolarHBondContact O-CG1 3.25Å; L470-I474 PolarHBondContact O-N 2.87Å
471	V	88	Confident	87.6	Confident	31 Å²	31	53.2 Å²	53.2	19%	0.188	28%	0.275	C	S	.	.	H	α-helix	trans	-58	-45.4	175.3	176	0	0	0	0	111.7	V442 K467 H473 I474	V442-V471 HydrophobicContact CG1-CG2 4.14Å; K467-V471 WeakPolarHBondContact O-CG2 3.3Å; K467-V471 PolarHBondContact O-N 3.44Å; V471-H473 PolarHBondContact O-N 2.91Å; V471-I474 PolarHBondContact O-N 3.45Å
472	N	89.6	Confident	88.2	Confident	54 Å²	54	54.1 Å²	54.1	29%	0.289	28%	0.275	S	S	.	.	H	α-helix	trans	-66	-18.1	175.1	-85.1	-86.4	0	0	0	114.1	Y468 K469 L470	Y468-N472 WeakPolarHBondContact O-CB 3.37Å; Y468-N472 PolarHBondContact O-N 3.18Å; Y468-N472 PolarHBondContact O-ND2 3.24Å; K469-N472 PolarHBondContact O-N 2.92Å; L470-N472 PolarHBondContact O-N 2.85Å
473	H	90	Very high	88.6	Confident	21 Å²	21	54.6 Å²	54.6	10%	0.097	28%	0.277	C	S	.	.	H	α-helix	trans	-87.1	-35.7	174.4	163.8	58.1	0	0	0	112.3	C457 F464 K469 L470 V471 R475 V476 H477	C457-H473 PolarHBondContact SG-NE2 2.88Å; F464-H473 HydrophobicContact CE1-CB 3.89Å; F464-H473 HydrophobicContact CE2-CB 4.11Å; F464-H473 AromaticContact CE2-CD2 3.4Å; F464-H473 WeakPolarHBondContact CE2-CD2 3.34Å; F464-H473 AromaticContact CE2-CG 3.93Å; F464-H473 HydrophobicContact CZ-CB 3.38Å; F464-H473 AromaticContact CZ-CD2 3.31Å; F464-H473 WeakPolarHBondContact CZ-CD2 3.39Å; F464-H473 AromaticContact CZ-CG 3.34Å; K469-H473 WeakPolarHBondContact O-CB 3.21Å; K469-H473 PolarHBondContact O-N 2.85Å; L470-H473 CarbonylContact O-C 3.5Å; L470-H473 WeakPolarHBondContact O-CA 3.18Å; L470-H473 WeakPolarHBondContact O-CB 3.45Å; L470-H473 PolarHBondContact O-N 3.44Å; V471-H473 PolarHBondContact O-N 2.91Å; H473-R475 PolarHBondContact O-N 3.08Å; H473-V476 WeakPolarHBondContact O-CB 3.26Å; H473-V476 VanDerWaalsContact O-CG2 3.32Å; H473-V476 WeakPolarHBondContact O-CG2 3.43Å; H473-V476 PolarHBondContact O-N 3.07Å; H473-H477 AromaticContact CE1-CE1 3.65Å; H473-H477 AromaticContact CE1-NE2 3.41Å; H473-H477 PolarHBondContact CE1-NE2 2.75Å; H473-H477 AromaticContact NE2-CE1 3.93Å; H473-H477 AromaticContact NE2-NE2 3.27Å; H473-H477 PolarHBondContact NE2-NE2 3.04Å
474	I	88.2	Confident	88.8	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.015	28%	0.28	C	S	.	.	H	α-helix	trans	-58.6	-30.2	176.6	-73.9	157	0	0	0	111.8	W408 I437 V442 L470 V471 V476 H477 T478	W408-I474 HydrophobicContact CH2-CD1 4.29Å; W408-I474 HydrophobicContact CZ3-CD1 3.89Å; W408-I474 HydrophobicContact CZ3-CG1 4.08Å; I437-I474 HydrophobicContact CB-CG2 4.36Å; I437-I474 HydrophobicContact CD1-CG2 3.99Å; I437-I474 HydrophobicContact CG2-CD1 3.8Å; I437-I474 HydrophobicContact CG2-CG1 4.29Å; I437-I474 HydrophobicContact CG2-CG2 3.86Å; V442-I474 HydrophobicContact CG2-CD1 3.48Å; V442-I474 VanDerWaalsContact CG2-CD1 3.48Å; L470-I474 HydrophobicContact CD1-CD1 3.91Å; L470-I474 HydrophobicContact CD1-CG1 4.25Å; L470-I474 HydrophobicContact CG-CD1 3.88Å; L470-I474 WeakPolarHBondContact O-CG1 3.25Å; L470-I474 PolarHBondContact O-N 2.87Å; V471-I474 PolarHBondContact O-N 3.45Å; I474-V476 PolarHBondContact O-N 3.39Å; I474-V476 VanDerWaalsContact O-N 3.11Å; I474-H477 WeakPolarHBondContact O-CA 3.38Å; I474-H477 WeakPolarHBondContact O-CB 3.17Å; I474-H477 PolarHBondContact O-N 3.08Å; I474-T478 HydrophobicContact CG2-CG2 4.01Å; I474-T478 PolarHBondContact O-N 2.84Å; I474-T478 PolarHBondContact O-OG1 3.18Å
475	R	90.2	Very high	89.1	Confident	42 Å²	42	54.5 Å²	54.5	16%	0.158	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-20.3	169.8	-60.8	-166.7	162.9	142.6	0.6	115.2	H473 H477 G479 E480 A495	H473-R475 PolarHBondContact O-N 3.08Å; R475-H477 VanDerWaalsContact C-N 3.34Å; R475-G479 WeakPolarHBondContact O-CA 3.33Å; R475-G479 PolarHBondContact O-N 3.18Å; R475-G479 VanDerWaalsContact O-N 3.15Å; R475-E480 HydrophobicContact CB-CB 4.45Å; R475-E480 HydrophobicContact CG-CB 4.15Å; R475-E480 WeakPolarHBondContact CG-OE2 3.29Å; R475-E480 IonicContact CZ-OE1 3.21Å; R475-E480 IonicContact CZ-OE2 2.71Å; R475-E480 IonicContact NE-OE1 2.67Å; R475-E480 PolarHBondContact NE-OE1 3.48Å; R475-E480 IonicContact NE-OE2 2.85Å; R475-E480 PolarHBondContact NE-OE2 3.23Å; R475-E480 IonicContact NH2-OE1 2.67Å; R475-E480 PolarHBondContact NH2-OE1 2.79Å; R475-E480 IonicContact NH2-OE2 3.38Å; R475-E480 PolarHBondContact NH2-OE2 3.22Å; R475-A495 HydrophobicContact CB-CB 4.35Å; R475-A495 WeakPolarHBondContact CD-O 3.38Å
476	V	88.3	Confident	89.3	Confident	105 Å²	105	47.9 Å²	47.9	64%	0.636	26%	0.259	S	S	*	.	H	α-helix	trans	-74.1	-30.2	173.1	-176.3	0	0	0	0	110.8	H473 I474	H473-V476 WeakPolarHBondContact O-CB 3.26Å; H473-V476 VanDerWaalsContact O-CG2 3.32Å; H473-V476 WeakPolarHBondContact O-CG2 3.43Å; H473-V476 PolarHBondContact O-N 3.07Å; I474-V476 PolarHBondContact O-N 3.39Å; I474-V476 VanDerWaalsContact O-N 3.11Å
477	H	88.3	Confident	89.5	Confident	46 Å²	46	50.5 Å²	50.5	21%	0.213	27%	0.266	C	S	.	.	H	α-helix	trans	-89	-42.7	-179.7	-54.2	-41.8	0	0	0	112.3	C452 W454 H473 I474 R475	C452-H477 PolarHBondContact SG-NE2 2.75Å; C452-H477 VanDerWaalsContact SG-NE2 3.44Å; W454-H477 AromaticContact CD1-CD2 3.79Å; W454-H477 AromaticContact CD1-CE1 3.93Å; W454-H477 AromaticContact CD1-CG 3.51Å; W454-H477 AromaticContact CD1-ND1 3.66Å; W454-H477 HydrophobicContact CD2-CB 3.85Å; W454-H477 HydrophobicContact CG-CB 4.01Å; W454-H477 AromaticContact CG-CD2 3.5Å; W454-H477 VanDerWaalsContact CG-CD2 3.5Å; W454-H477 AromaticContact CG-CG 3.65Å; W454-H477 AromaticContact CG-NE2 3.91Å; W454-H477 HydrophobicContact CZ2-CB 4.04Å; W454-H477 AromaticContact NE1-CG 3.86Å; H473-H477 AromaticContact CE1-CE1 3.65Å; H473-H477 AromaticContact CE1-NE2 3.41Å; H473-H477 PolarHBondContact CE1-NE2 2.75Å; H473-H477 AromaticContact NE2-CE1 3.93Å; H473-H477 AromaticContact NE2-NE2 3.27Å; H473-H477 PolarHBondContact NE2-NE2 3.04Å; I474-H477 WeakPolarHBondContact O-CA 3.38Å; I474-H477 WeakPolarHBondContact O-CB 3.17Å; I474-H477 PolarHBondContact O-N 3.08Å; R475-H477 VanDerWaalsContact C-N 3.34Å
478	T	86.6	Confident	89.4	Confident	9 Å²	9	53.4 Å²	53.4	6%	0.055	30%	0.295	C	S	.	.	H	α-helix	trans	-82.9	-12.9	178.9	61.7	0	0	0	0	114.1	I433 V434 I437 I474 E480	I433-T478 HydrophobicContact CG1-CG2 4.39Å; I433-T478 HydrophobicContact CG2-CG2 4.23Å; V434-T478 HydrophobicContact CG2-CG2 3.87Å; V434-T478 WeakPolarHBondContact CG2-OG1 3.3Å; I437-T478 HydrophobicContact CD1-CG2 3.5Å; I474-T478 HydrophobicContact CG2-CG2 4.01Å; I474-T478 PolarHBondContact O-N 2.84Å; I474-T478 PolarHBondContact O-OG1 3.18Å; T478-E480 PolarHBondContact O-N 2.83Å
479	G	87.7	Confident	89.4	Confident	39 Å²	39	53.6 Å²	53.6	40%	0.402	32%	0.319	S	S	.	.			trans	73.2	5.7	-176.3	0	0	0	0	0	115.5	R475 K481	R475-G479 WeakPolarHBondContact O-CA 3.33Å; R475-G479 PolarHBondContact O-N 3.18Å; R475-G479 VanDerWaalsContact O-N 3.15Å; G479-K481 WeakPolarHBondContact O-CG 3.24Å; G479-K481 PolarHBondContact O-N 2.88Å
480	E	89	Confident	89.5	Confident	24 Å²	24	49.3 Å²	49.3	11%	0.112	30%	0.302	C	S	.	.			trans	-59.6	128	-173.8	-166.8	-144.3	148.2	0	0	113.7	V430 V434 R475 T478 P482 A495	V430-E480 HydrophobicContact CG1-CB 3.81Å; V430-E480 HydrophobicContact CG1-CG 4.08Å; V434-E480 WeakPolarHBondContact CG1-OE2 3.37Å; V434-E480 HydrophobicContact CG2-CB 3.84Å; V434-E480 HydrophobicContact CG2-CG 3.93Å; V434-E480 WeakPolarHBondContact CG2-OE2 3.13Å; R475-E480 HydrophobicContact CB-CB 4.45Å; R475-E480 HydrophobicContact CG-CB 4.15Å; R475-E480 WeakPolarHBondContact CG-OE2 3.29Å; R475-E480 IonicContact CZ-OE1 3.21Å; R475-E480 IonicContact CZ-OE2 2.71Å; R475-E480 IonicContact NE-OE1 2.67Å; R475-E480 PolarHBondContact NE-OE1 3.48Å; R475-E480 IonicContact NE-OE2 2.85Å; R475-E480 PolarHBondContact NE-OE2 3.23Å; R475-E480 IonicContact NH2-OE1 2.67Å; R475-E480 PolarHBondContact NH2-OE1 2.79Å; R475-E480 IonicContact NH2-OE2 3.38Å; R475-E480 PolarHBondContact NH2-OE2 3.22Å; T478-E480 PolarHBondContact O-N 2.83Å; E480-P482 VanDerWaalsContact OE1-CB 3.31Å; E480-P482 WeakPolarHBondContact OE1-CB 3.28Å; E480-P482 WeakPolarHBondContact OE1-CD 3.44Å; E480-P482 WeakPolarHBondContact OE1-CG 3.48Å; E480-A495 WeakPolarHBondContact O-CB 3.43Å
481	K	90.8	Very high	89.4	Confident	93 Å²	93	58 Å²	58	40%	0.404	35%	0.345	S	S	.	.			trans	-128.7	66	-178.6	-63.9	163.8	-158.6	160.9	0	111.4	G479 F483 V493 F494	G479-K481 WeakPolarHBondContact O-CG 3.24Å; G479-K481 PolarHBondContact O-N 2.88Å; K481-F483 PolarHBondContact O-N 3.38Å; K481-F483 VanDerWaalsContact O-N 3.09Å; K481-V493 HydrophobicContact CB-CB 3.81Å; K481-V493 HydrophobicContact CB-CG2 3.87Å; K481-V493 HydrophobicContact CD-CG2 3.73Å; K481-V493 HydrophobicContact CG-CG2 4.42Å; K481-F494 CarbonylContact C-O 3.37Å; K481-F494 WeakPolarHBondContact CA-O 3.25Å
482	P	89.7	Confident	89.5	Confident	53 Å²	53	58.1 Å²	58.1	34%	0.344	34%	0.343	S	S	.	.			trans	-75.6	1.2	-167.8	36.1	-41.5	0	0	0	114.8	E480 P484	E480-P482 VanDerWaalsContact OE1-CB 3.31Å; E480-P482 WeakPolarHBondContact OE1-CB 3.28Å; E480-P482 WeakPolarHBondContact OE1-CD 3.44Å; E480-P482 WeakPolarHBondContact OE1-CG 3.48Å; P482-P484 VanDerWaalsContact C-CD 3.5Å; P482-P484 WeakPolarHBondContact O-CD 3.5Å
483	F	91.9	Very high	89.6	Confident	61 Å²	61	58.8 Å²	58.8	27%	0.268	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	85.3	-179.5	-59.4	-73.5	0	0	0	110.7	K481 F494 S497 L500	K481-F483 PolarHBondContact O-N 3.38Å; K481-F483 VanDerWaalsContact O-N 3.09Å; F483-F494 HydrophobicContact CB-CB 4.28Å; F483-F494 WeakPolarHBondContact CB-O 3.31Å; F483-F494 WeakPolarHBondContact CD2-O 3.5Å; F483-F494 PolarHBondContact N-O 3.41Å; F483-F494 PolarHBondContact O-N 3.18Å; F483-S497 VanDerWaalsContact CD2-N 3.33Å; F483-L500 HydrophobicContact CB-CB 4.1Å; F483-L500 HydrophobicContact CB-CD2 3.87Å
484	P	91.5	Very high	89.7	Confident	66 Å²	66	59.3 Å²	59.3	43%	0.429	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	154.4	173.6	29.7	-35.5	0	0	0	112.1	P482 V493 L500	P482-P484 VanDerWaalsContact C-CD 3.5Å; P482-P484 WeakPolarHBondContact O-CD 3.5Å; P484-V493 HydrophobicContact CB-CG1 4.05Å; P484-L500 WeakPolarHBondContact O-CD1 3.46Å; P484-L500 VanDerWaalsContact O-CD2 3.29Å; P484-L500 WeakPolarHBondContact O-CD2 3.45Å
485	C	94.1	Very high	89.8	Confident	14 Å²	14	60.7 Å²	60.7	10%	0.095	36%	0.362	C	S	.	.			trans	-76.8	128.9	168	-162.6	0	0	0	0	110.6	F487 C490 K492 L500 H503 H507	C485-F487 VanDerWaalsContact C-N 3.27Å; C485-F487 PolarHBondContact O-N 2.83Å; C485-C490 HydrophobicContact CB-CB 4.35Å; C485-C490 WeakPolarHBondContact CB-O 3.15Å; C485-K492 WeakPolarHBondContact CB-O 3.23Å; C485-K492 PolarHBondContact N-O 3.28Å; C485-L500 HydrophobicContact CB-CD1 4.23Å; C485-H503 VanDerWaalsContact SG-CD2 3.53Å; C485-H503 PolarHBondContact SG-NE2 3.21Å; C485-H507 PolarHBondContact SG-NE2 3.38Å
486	P	91.7	Very high	89.9	Confident	80 Å²	80	63.4 Å²	63.4	52%	0.519	37%	0.372	S	S	.	.			trans	-82.2	-0.4	178.3	35.3	-38.2	0	0	0	113.6	S488 K504	P486-S488 PolarHBondContact O-N 3.45Å; P486-K504 HydrophobicContact CG-CD 4.45Å
487	F	89.8	Confident	90.1	Very high	77 Å²	77	61.9 Å²	61.9	34%	0.338	37%	0.366	S	S	.	.	S	Bend	trans	-77.4	120.3	175.9	-76.7	-90.6	0	0	0	109.4	C485 C490 K504 H507 T508	C485-F487 VanDerWaalsContact C-N 3.27Å; C485-F487 PolarHBondContact O-N 2.83Å; F487-C490 HydrophobicContact CB-CB 4.11Å; F487-C490 VanDerWaalsContact O-CB 3.24Å; F487-C490 WeakPolarHBondContact O-CB 3.33Å; F487-C490 PolarHBondContact O-N 3.48Å; F487-K504 HydrophobicContact CE2-CB 4.15Å; F487-K504 HydrophobicContact CE2-CG 4.14Å; F487-H507 HydrophobicContact CD1-CB 3.74Å; F487-H507 AromaticContact CD1-CG 3.91Å; F487-H507 HydrophobicContact CD2-CB 3.9Å; F487-H507 AromaticContact CD2-CD2 3.33Å; F487-H507 WeakPolarHBondContact CD2-CD2 3.44Å; F487-H507 AromaticContact CD2-CG 3.72Å; F487-H507 HydrophobicContact CE1-CB 3.6Å; F487-H507 HydrophobicContact CE2-CB 3.75Å; F487-H507 AromaticContact CE2-CD2 3.88Å; F487-H507 HydrophobicContact CG-CB 3.9Å; F487-H507 AromaticContact CG-CD2 3.58Å; F487-H507 AromaticContact CG-CG 3.62Å; F487-H507 HydrophobicContact CZ-CB 3.6Å; F487-T508 HydrophobicContact CZ-CG2 4.07Å
488	S	85.3	Confident	90.1	Very high	130 Å²	130	63.9 Å²	63.9	91%	0.909	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	142.7	177.7	-169.4	0	0	0	0	111.5	P486 C490	P486-S488 PolarHBondContact O-N 3.45Å; S488-C490 PolarHBondContact O-N 3.25Å
489	G	87.6	Confident	90.4	Very high	78 Å²	78	65.2 Å²	65.2	80%	0.804	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	-11.3	-170.6	0	0	0	0	0	115.3	M491	G489-M491 PolarHBondContact O-N 2.95Å
490	C	90.6	Very high	90.7	Very high	9 Å²	9	64.1 Å²	64.1	6%	0.061	37%	0.368	C	S	.	.			trans	-100.4	81.7	-178.6	-170.7	0	0	0	0	113	C485 F487 S488 K492 H503 H507	C485-C490 HydrophobicContact CB-CB 4.35Å; C485-C490 WeakPolarHBondContact CB-O 3.15Å; F487-C490 HydrophobicContact CB-CB 4.11Å; F487-C490 VanDerWaalsContact O-CB 3.24Å; F487-C490 WeakPolarHBondContact O-CB 3.33Å; F487-C490 PolarHBondContact O-N 3.48Å; S488-C490 PolarHBondContact O-N 3.25Å; C490-K492 PolarHBondContact O-N 3.17Å; C490-K492 VanDerWaalsContact SG-CG 3.58Å; C490-H503 PolarHBondContact SG-NE2 2.71Å; C490-H507 WeakPolarHBondContact CB-CE1 3.45Å; C490-H507 WeakPolarHBondContact CB-NE2 2.96Å; C490-H507 PolarHBondContact SG-CE1 3.31Å; C490-H507 PolarHBondContact SG-NE2 2.83Å
491	M	89.2	Confident	90.9	Very high	183 Å²	183	68.3 Å²	68.3	90%	0.901	39%	0.385	S	S	*	.			trans	-71.2	36.1	-179.4	-51.9	178	83	0	0	114.5	G489	G489-M491 PolarHBondContact O-N 2.95Å
492	K	90	Very high	90.9	Very high	34 Å²	34	64.9 Å²	64.9	15%	0.148	37%	0.371	C	S	.	.			trans	-96.5	119.2	-176.2	-58.6	-176	-157	-159.7	0	110.6	C485 C490 F494 N627	C485-K492 WeakPolarHBondContact CB-O 3.23Å; C485-K492 PolarHBondContact N-O 3.28Å; C490-K492 PolarHBondContact O-N 3.17Å; C490-K492 VanDerWaalsContact SG-CG 3.58Å; K492-F494 HydrophobicContact CB-CE2 3.73Å; K492-F494 HydrophobicContact CB-CZ 3.98Å; K492-F494 WeakPolarHBondContact O-CE2 3.16Å; K492-N627 HydrophobicContact CD-CB 3.64Å; K492-N627 WeakPolarHBondContact CE-OD1 3.4Å; K492-N627 HydrophobicContact CG-CB 3.73Å; K492-N627 PolarHBondContact NZ-OD1 2.79Å
493	V	92.3	Very high	91	Very high	67 Å²	67	62.8 Å²	62.8	41%	0.406	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	142.9	-180	-73.6	0	0	0	0	111.4	K481 P484	K481-V493 HydrophobicContact CB-CB 3.81Å; K481-V493 HydrophobicContact CB-CG2 3.87Å; K481-V493 HydrophobicContact CD-CG2 3.73Å; K481-V493 HydrophobicContact CG-CG2 4.42Å; P484-V493 HydrophobicContact CB-CG1 4.05Å
494	F	91.4	Very high	91	Very high	33 Å²	33	64 Å²	64	15%	0.145	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.7	-173.2	-60.7	-93.1	0	0	0	112.6	K481 F483 K492 R496 N499 L500 H503	K481-F494 CarbonylContact C-O 3.37Å; K481-F494 WeakPolarHBondContact CA-O 3.25Å; F483-F494 HydrophobicContact CB-CB 4.28Å; F483-F494 WeakPolarHBondContact CB-O 3.31Å; F483-F494 WeakPolarHBondContact CD2-O 3.5Å; F483-F494 PolarHBondContact N-O 3.41Å; F483-F494 PolarHBondContact O-N 3.18Å; K492-F494 HydrophobicContact CB-CE2 3.73Å; K492-F494 HydrophobicContact CB-CZ 3.98Å; K492-F494 WeakPolarHBondContact O-CE2 3.16Å; F494-R496 VanDerWaalsContact C-N 3.3Å; F494-R496 PolarHBondContact O-N 3.31Å; F494-N499 HydrophobicContact CB-CB 4.25Å; F494-N499 HydrophobicContact CD1-CB 3.78Å; F494-N499 HydrophobicContact CG-CB 4.3Å; F494-L500 HydrophobicContact CB-CB 4.37Å; F494-L500 HydrophobicContact CD2-CB 4.13Å; F494-L500 HydrophobicContact CD2-CD1 4.19Å; F494-L500 HydrophobicContact CE2-CD1 4.42Å; F494-L500 HydrophobicContact CG-CB 4.36Å; F494-H503 HydrophobicContact CE1-CB 4.06Å; F494-H503 HydrophobicContact CE2-CB 3.96Å; F494-H503 AromaticContact CE2-CD2 3.24Å; F494-H503 WeakPolarHBondContact CE2-CD2 3.31Å; F494-H503 AromaticContact CE2-CG 3.72Å; F494-H503 HydrophobicContact CZ-CB 3.51Å; F494-H503 AromaticContact CZ-CD2 3.39Å; F494-H503 WeakPolarHBondContact CZ-CD2 3.29Å; F494-H503 AromaticContact CZ-CG 3.38Å
495	A	90.8	Very high	91	Very high	31 Å²	31	62.8 Å²	62.8	26%	0.256	35%	0.349	S	S	.	.	S	Bend	trans	-75.4	-13.3	175.4	0	0	0	0	0	114.4	R475 E480	R475-A495 HydrophobicContact CB-CB 4.35Å; R475-A495 WeakPolarHBondContact CD-O 3.38Å; E480-A495 WeakPolarHBondContact O-CB 3.43Å
496	R	91.6	Very high	90.9	Very high	99 Å²	99	65.4 Å²	65.4	37%	0.374	36%	0.364	S	S	.	.	S	Bend	trans	-140.1	138.8	-177.5	-55.2	-170.7	-54.7	-148.3	-0.1	112	F494 E498 N499 L500 N633	F494-R496 VanDerWaalsContact C-N 3.3Å; F494-R496 PolarHBondContact O-N 3.31Å; R496-E498 PolarHBondContact O-N 2.88Å; R496-N499 HydrophobicContact CB-CB 4.49Å; R496-N499 PolarHBondContact NE-OD1 3.24Å; R496-N499 PolarHBondContact NH2-OD1 3.41Å; R496-N499 WeakPolarHBondContact O-CB 3.44Å; R496-N499 PolarHBondContact O-N 3.3Å; R496-N499 VanDerWaalsContact O-N 3.15Å; R496-L500 PolarHBondContact O-N 3.38Å; R496-N633 PolarHBondContact NH2-OD1 3.44Å
497	S	92.1	Very high	90.8	Very high	73 Å²	73	65.5 Å²	65.5	51%	0.51	36%	0.358	S	S	.	.	H	α-helix	trans	-59.9	-38.6	179	52.5	0	0	0	0	113.8	F483 N499 L500 K501	F483-S497 VanDerWaalsContact CD2-N 3.33Å; S497-N499 VanDerWaalsContact C-N 3.34Å; S497-N499 PolarHBondContact O-N 2.52Å; S497-L500 CarbonylContact O-C 3.29Å; S497-L500 WeakPolarHBondContact O-CB 3.39Å; S497-L500 PolarHBondContact O-N 3.38Å; S497-K501 PolarHBondContact O-N 3.24Å
498	E	89.1	Confident	90.8	Very high	89 Å²	89	65.4 Å²	65.4	42%	0.416	36%	0.363	S	S	.	.	H	α-helix	trans	-67.6	-33.2	177.2	-172.7	58.4	-151.8	0	0	112	R496 L500 K501 I502	R496-E498 PolarHBondContact O-N 2.88Å; E498-L500 VanDerWaalsContact C-N 3.34Å; E498-K501 PolarHBondContact O-N 2.91Å; E498-K501 VanDerWaalsContact OE2-CD 3.28Å; E498-K501 WeakPolarHBondContact OE2-CD 3.24Å; E498-I502 HydrophobicContact CG-CD1 4.16Å; E498-I502 VanDerWaalsContact O-CG1 3.31Å; E498-I502 WeakPolarHBondContact O-CG1 3.42Å; E498-I502 PolarHBondContact O-N 3Å
499	N	91.7	Very high	91	Very high	36 Å²	36	61.5 Å²	61.5	19%	0.193	34%	0.344	C	S	.	.	H	α-helix	trans	-64.5	-42.4	172.6	-65.8	20.2	0	0	0	110.3	F494 R496 S497 I502 H503	F494-N499 HydrophobicContact CB-CB 4.25Å; F494-N499 HydrophobicContact CD1-CB 3.78Å; F494-N499 HydrophobicContact CG-CB 4.3Å; R496-N499 HydrophobicContact CB-CB 4.49Å; R496-N499 PolarHBondContact NE-OD1 3.24Å; R496-N499 PolarHBondContact NH2-OD1 3.41Å; R496-N499 WeakPolarHBondContact O-CB 3.44Å; R496-N499 PolarHBondContact O-N 3.3Å; R496-N499 VanDerWaalsContact O-N 3.15Å; S497-N499 VanDerWaalsContact C-N 3.34Å; S497-N499 PolarHBondContact O-N 2.52Å; N499-I502 PolarHBondContact O-N 2.11Å; N499-H503 WeakPolarHBondContact O-CB 3.46Å; N499-H503 PolarHBondContact O-N 2.99Å
500	L	94.4	Very high	91.1	Very high	17 Å²	17	62.1 Å²	62.1	9%	0.089	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-43.3	172.8	169.3	62.1	0	0	0	111.4	F483 P484 C485 F494 R496 S497 E498 I502 H503 K504	F483-L500 HydrophobicContact CB-CB 4.1Å; F483-L500 HydrophobicContact CB-CD2 3.87Å; P484-L500 WeakPolarHBondContact O-CD1 3.46Å; P484-L500 VanDerWaalsContact O-CD2 3.29Å; P484-L500 WeakPolarHBondContact O-CD2 3.45Å; C485-L500 HydrophobicContact CB-CD1 4.23Å; F494-L500 HydrophobicContact CB-CB 4.37Å; F494-L500 HydrophobicContact CD2-CB 4.13Å; F494-L500 HydrophobicContact CD2-CD1 4.19Å; F494-L500 HydrophobicContact CE2-CD1 4.42Å; F494-L500 HydrophobicContact CG-CB 4.36Å; R496-L500 PolarHBondContact O-N 3.38Å; S497-L500 CarbonylContact O-C 3.29Å; S497-L500 WeakPolarHBondContact O-CB 3.39Å; S497-L500 PolarHBondContact O-N 3.38Å; E498-L500 VanDerWaalsContact C-N 3.34Å; L500-I502 PolarHBondContact O-N 3.37Å; L500-H503 CarbonylContact O-C 3.52Å; L500-H503 WeakPolarHBondContact O-CA 3.36Å; L500-H503 WeakPolarHBondContact O-CB 3.2Å; L500-H503 PolarHBondContact O-N 3.34Å; L500-H503 VanDerWaalsContact O-N 3.1Å; L500-K504 HydrophobicContact CD1-CG 4.08Å; L500-K504 HydrophobicContact CG-CG 4.44Å; L500-K504 WeakPolarHBondContact O-CG 3.42Å; L500-K504 PolarHBondContact O-N 2.74Å
501	K	92.6	Very high	91.1	Very high	111 Å²	111	67.3 Å²	67.3	48%	0.483	35%	0.348	S	S	.	.	H	α-helix	trans	-60.1	-45.5	178.7	-170	-176.6	-173.3	176	0	112	S497 E498 H503 K504 R505	S497-K501 PolarHBondContact O-N 3.24Å; E498-K501 PolarHBondContact O-N 2.91Å; E498-K501 VanDerWaalsContact OE2-CD 3.28Å; E498-K501 WeakPolarHBondContact OE2-CD 3.24Å; K501-H503 VanDerWaalsContact C-N 3.3Å; K501-H503 PolarHBondContact O-N 3.24Å; K501-K504 PolarHBondContact O-N 3.39Å; K501-R505 PolarHBondContact O-N 2.97Å
502	I	91.9	Very high	91.2	Very high	21 Å²	21	61.6 Å²	61.6	11%	0.108	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-35.6	174.5	-64.6	166.8	0	0	0	110.8	E498 N499 L500 R505 N526 T631	E498-I502 HydrophobicContact CG-CD1 4.16Å; E498-I502 VanDerWaalsContact O-CG1 3.31Å; E498-I502 WeakPolarHBondContact O-CG1 3.42Å; E498-I502 PolarHBondContact O-N 3Å; N499-I502 PolarHBondContact O-N 2.11Å; L500-I502 PolarHBondContact O-N 3.37Å; I502-R505 WeakPolarHBondContact O-CB 3.37Å; I502-R505 PolarHBondContact O-N 3.04Å; I502-N526 HydrophobicContact CD1-CB 3.8Å; I502-N526 HydrophobicContact CG1-CB 4.01Å; I502-N526 HydrophobicContact CG2-CB 4.07Å; I502-T631 HydrophobicContact CG2-CG2 3.83Å
503	H	91.7	Very high	91.3	Very high	9 Å²	9	62.9 Å²	62.9	4%	0.042	33%	0.33	C	S	.	.	H	α-helix	trans	-70.2	-38	174.1	173.1	46.3	0	0	0	113.4	C485 C490 F494 N499 L500 K501 R505 T506 H507	C485-H503 VanDerWaalsContact SG-CD2 3.53Å; C485-H503 PolarHBondContact SG-NE2 3.21Å; C490-H503 PolarHBondContact SG-NE2 2.71Å; F494-H503 HydrophobicContact CE1-CB 4.06Å; F494-H503 HydrophobicContact CE2-CB 3.96Å; F494-H503 AromaticContact CE2-CD2 3.24Å; F494-H503 WeakPolarHBondContact CE2-CD2 3.31Å; F494-H503 AromaticContact CE2-CG 3.72Å; F494-H503 HydrophobicContact CZ-CB 3.51Å; F494-H503 AromaticContact CZ-CD2 3.39Å; F494-H503 WeakPolarHBondContact CZ-CD2 3.29Å; F494-H503 AromaticContact CZ-CG 3.38Å; N499-H503 WeakPolarHBondContact O-CB 3.46Å; N499-H503 PolarHBondContact O-N 2.99Å; L500-H503 CarbonylContact O-C 3.52Å; L500-H503 WeakPolarHBondContact O-CA 3.36Å; L500-H503 WeakPolarHBondContact O-CB 3.2Å; L500-H503 PolarHBondContact O-N 3.34Å; L500-H503 VanDerWaalsContact O-N 3.1Å; K501-H503 VanDerWaalsContact C-N 3.3Å; K501-H503 PolarHBondContact O-N 3.24Å; H503-R505 PolarHBondContact O-N 3.33Å; H503-T506 PolarHBondContact CE1-OG1 2.84Å; H503-T506 PolarHBondContact ND1-OG1 3.25Å; H503-T506 WeakPolarHBondContact O-CA 3.37Å; H503-T506 WeakPolarHBondContact O-CB 3.42Å; H503-T506 PolarHBondContact O-N 2.88Å; H503-T506 PolarHBondContact O-OG1 3.45Å; H503-H507 AromaticContact CD2-NE2 3.59Å; H503-H507 AromaticContact CE1-CD2 3.71Å; H503-H507 AromaticContact CE1-NE2 2.74Å; H503-H507 PolarHBondContact CE1-NE2 3.21Å; H503-H507 AromaticContact ND1-NE2 3.92Å; H503-H507 AromaticContact NE2-CD2 3.8Å; H503-H507 AromaticContact NE2-NE2 2.43Å; H503-H507 PolarHBondContact NE2-NE2 2.83Å
504	K	91.5	Very high	91.2	Very high	86 Å²	86	62.2 Å²	62.2	37%	0.374	33%	0.325	S	S	.	.	H	α-helix	trans	-54.7	-36.8	174.5	-71.8	-172.7	-175.8	-168.4	0	111.5	P486 F487 L500 K501 T506 H507 T508	P486-K504 HydrophobicContact CG-CD 4.45Å; F487-K504 HydrophobicContact CE2-CB 4.15Å; F487-K504 HydrophobicContact CE2-CG 4.14Å; L500-K504 HydrophobicContact CD1-CG 4.08Å; L500-K504 HydrophobicContact CG-CG 4.44Å; L500-K504 WeakPolarHBondContact O-CG 3.42Å; L500-K504 PolarHBondContact O-N 2.74Å; K501-K504 PolarHBondContact O-N 3.39Å; K504-T506 PolarHBondContact O-N 3.44Å; K504-H507 WeakPolarHBondContact O-CB 3.26Å; K504-H507 PolarHBondContact O-N 3.07Å; K504-T508 PolarHBondContact O-N 3.48Å
505	R	92.2	Very high	91.3	Very high	42 Å²	42	61.2 Å²	61.2	16%	0.158	32%	0.323	C	S	.	.	H	α-helix	trans	-62.8	-22.3	172.9	-65.1	-167.7	172.2	127.9	6.2	115.3	K501 I502 H503 H507 T508 G509 E510 A525	K501-R505 PolarHBondContact O-N 2.97Å; I502-R505 WeakPolarHBondContact O-CB 3.37Å; I502-R505 PolarHBondContact O-N 3.04Å; H503-R505 PolarHBondContact O-N 3.33Å; R505-H507 PolarHBondContact O-N 3.13Å; R505-T508 WeakPolarHBondContact CA-OG1 3.39Å; R505-G509 CarbonylContact O-C 3.59Å; R505-G509 WeakPolarHBondContact O-CA 3.23Å; R505-G509 PolarHBondContact O-N 3.17Å; R505-E510 HydrophobicContact CB-CB 3.82Å; R505-E510 HydrophobicContact CG-CB 3.67Å; R505-E510 IonicContact NE-OE2 3.3Å; R505-E510 PolarHBondContact NE-OE2 2.92Å; R505-E510 PolarHBondContact O-N 2.89Å; R505-A525 HydrophobicContact CB-CB 4.22Å; R505-A525 WeakPolarHBondContact CD-O 3.4Å; R505-A525 PolarHBondContact NH1-O 2.96Å
506	T	90.5	Very high	91.2	Very high	68 Å²	68	66.3 Å²	66.3	42%	0.417	34%	0.341	S	S	.	.	H	α-helix	trans	-74.9	-15.6	173.5	66	0	0	0	0	112.9	H503 K504	H503-T506 PolarHBondContact CE1-OG1 2.84Å; H503-T506 PolarHBondContact ND1-OG1 3.25Å; H503-T506 WeakPolarHBondContact O-CA 3.37Å; H503-T506 WeakPolarHBondContact O-CB 3.42Å; H503-T506 PolarHBondContact O-N 2.88Å; H503-T506 PolarHBondContact O-OG1 3.45Å; K504-T506 PolarHBondContact O-N 3.44Å
507	H	90.5	Very high	91	Very high	83 Å²	83	66.6 Å²	66.6	38%	0.384	35%	0.345	S	S	.	.	H	α-helix	trans	-91.6	-39.8	169.6	-65.2	-71.5	0	0	0	112.5	C485 F487 C490 H503 K504 R505 G509	C485-H507 PolarHBondContact SG-NE2 3.38Å; F487-H507 HydrophobicContact CD1-CB 3.74Å; F487-H507 AromaticContact CD1-CG 3.91Å; F487-H507 HydrophobicContact CD2-CB 3.9Å; F487-H507 AromaticContact CD2-CD2 3.33Å; F487-H507 WeakPolarHBondContact CD2-CD2 3.44Å; F487-H507 AromaticContact CD2-CG 3.72Å; F487-H507 HydrophobicContact CE1-CB 3.6Å; F487-H507 HydrophobicContact CE2-CB 3.75Å; F487-H507 AromaticContact CE2-CD2 3.88Å; F487-H507 HydrophobicContact CG-CB 3.9Å; F487-H507 AromaticContact CG-CD2 3.58Å; F487-H507 AromaticContact CG-CG 3.62Å; F487-H507 HydrophobicContact CZ-CB 3.6Å; C490-H507 WeakPolarHBondContact CB-CE1 3.45Å; C490-H507 WeakPolarHBondContact CB-NE2 2.96Å; C490-H507 PolarHBondContact SG-CE1 3.31Å; C490-H507 PolarHBondContact SG-NE2 2.83Å; H503-H507 AromaticContact CD2-NE2 3.59Å; H503-H507 AromaticContact CE1-CD2 3.71Å; H503-H507 AromaticContact CE1-NE2 2.74Å; H503-H507 PolarHBondContact CE1-NE2 3.21Å; H503-H507 AromaticContact ND1-NE2 3.92Å; H503-H507 AromaticContact NE2-CD2 3.8Å; H503-H507 AromaticContact NE2-NE2 2.43Å; H503-H507 PolarHBondContact NE2-NE2 2.83Å; K504-H507 WeakPolarHBondContact O-CB 3.26Å; K504-H507 PolarHBondContact O-N 3.07Å; R505-H507 PolarHBondContact O-N 3.13Å; H507-G509 VanDerWaalsContact C-N 3.3Å; H507-G509 PolarHBondContact O-N 3.01Å
508	T	89.7	Confident	90.6	Very high	74 Å²	74	71.3 Å²	71.3	45%	0.454	36%	0.359	S	S	.	.	H	α-helix	trans	-80	-9.2	177.8	62.5	0	0	0	0	113.9	F487 K504 R505 E510	F487-T508 HydrophobicContact CZ-CG2 4.07Å; K504-T508 PolarHBondContact O-N 3.48Å; R505-T508 WeakPolarHBondContact CA-OG1 3.39Å; T508-E510 PolarHBondContact O-N 3.22Å; T508-E510 WeakPolarHBondContact OG1-CB 3.39Å; T508-E510 WeakPolarHBondContact OG1-CG 3.43Å; T508-E510 PolarHBondContact OG1-OE1 2.62Å
509	G	89.1	Confident	90.5	Very high	49 Å²	49	70.7 Å²	70.7	51%	0.505	38%	0.377	S	S	.	.			trans	73	1.7	-174.5	0	0	0	0	0	114.6	R505 H507 K511	R505-G509 CarbonylContact O-C 3.59Å; R505-G509 WeakPolarHBondContact O-CA 3.23Å; R505-G509 PolarHBondContact O-N 3.17Å; H507-G509 VanDerWaalsContact C-N 3.3Å; H507-G509 PolarHBondContact O-N 3.01Å; G509-K511 PolarHBondContact O-N 2.97Å
510	E	89.2	Confident	90.4	Very high	91 Å²	91	69.9 Å²	69.9	43%	0.425	37%	0.374	S	S	.	.			trans	-55.5	117.2	-176.8	-90	171.4	-109.2	0	0	113.3	R505 T508 P512	R505-E510 HydrophobicContact CB-CB 3.82Å; R505-E510 HydrophobicContact CG-CB 3.67Å; R505-E510 IonicContact NE-OE2 3.3Å; R505-E510 PolarHBondContact NE-OE2 2.92Å; R505-E510 PolarHBondContact O-N 2.89Å; T508-E510 PolarHBondContact O-N 3.22Å; T508-E510 WeakPolarHBondContact OG1-CB 3.39Å; T508-E510 WeakPolarHBondContact OG1-CG 3.43Å; T508-E510 PolarHBondContact OG1-OE1 2.62Å; E510-P512 VanDerWaalsContact C-CD 3.49Å; E510-P512 WeakPolarHBondContact O-CD 3.19Å
511	K	91.4	Very high	90.1	Very high	118 Å²	118	75.9 Å²	75.9	51%	0.513	41%	0.406	S	S	.	.			trans	-124.5	73	173.8	-69.4	165.2	-179.8	176.3	0	110.3	G509 F513 R523 F524	G509-K511 PolarHBondContact O-N 2.97Å; K511-F513 VanDerWaalsContact C-N 3.33Å; K511-F513 PolarHBondContact O-N 3.23Å; K511-R523 HydrophobicContact CB-CB 3.57Å; K511-R523 HydrophobicContact CD-CB 4.46Å; K511-R523 WeakPolarHBondContact CD-O 3.38Å; K511-R523 PolarHBondContact O-NH1 3.01Å; K511-F524 CarbonylContact C-O 3.6Å; K511-F524 VanDerWaalsContact C-O 3.28Å; K511-F524 VanDerWaalsContact CA-O 3.31Å; K511-F524 WeakPolarHBondContact CA-O 3.47Å
512	P	91	Very high	89.9	Confident	62 Å²	62	77.6 Å²	77.6	40%	0.403	41%	0.409	S	S	.	.			trans	-73.7	-19.7	-174.3	27.6	-33.3	0	0	0	114.1	E510 V514 F524	E510-P512 VanDerWaalsContact C-CD 3.49Å; E510-P512 WeakPolarHBondContact O-CD 3.19Å; P512-V514 PolarHBondContact O-N 3.13Å; P512-F524 WeakPolarHBondContact CD-O 3.4Å
513	F	92	Very high	89.9	Confident	62 Å²	62	83.1 Å²	83.1	27%	0.272	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	93.1	-176.8	-60.1	-81	0	0	0	110.8	K511 R523 F524 R530	K511-F513 VanDerWaalsContact C-N 3.33Å; K511-F513 PolarHBondContact O-N 3.23Å; F513-R523 CarbonylContact O-C 3.54Å; F513-R523 WeakPolarHBondContact O-CA 3.39Å; F513-F524 HydrophobicContact CB-CB 4.33Å; F513-F524 PolarHBondContact N-O 3.11Å; F513-F524 PolarHBondContact O-N 3.41Å; F513-R530 HydrophobicContact CB-CB 4.29Å
514	V	90.5	Very high	89.9	Confident	52 Å²	52	84.9 Å²	84.9	32%	0.315	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	139.6	172	-161.9	0	0	0	0	109.7	P512 R523 R530	P512-V514 PolarHBondContact O-N 3.13Å; V514-R523 HydrophobicContact CG1-CG 4.42Å; V514-R523 HydrophobicContact CG2-CG 4.38Å; V514-R530 WeakPolarHBondContact O-CD 3.45Å; V514-R530 PolarHBondContact O-NH1 3.45Å
515	C	92.8	Very high	89.9	Confident	13 Å²	13	81.7 Å²	81.7	9%	0.088	43%	0.426	C	S	.	.			trans	-48.8	144.3	163.9	178.3	0	0	0	0	111.4	F517 C520 R522 M534 H537	C515-F517 PolarHBondContact SG-N 3.44Å; C515-F517 VanDerWaalsContact SG-N 3.4Å; C515-C520 WeakPolarHBondContact CB-O 3.09Å; C515-R522 VanDerWaalsContact CB-O 3.29Å; C515-R522 WeakPolarHBondContact CB-O 3.26Å; C515-R522 PolarHBondContact N-O 3.3Å; C515-M534 HydrophobicContact CB-CE 4.05Å; C515-M534 WeakPolarHBondContact SG-CE 3.44Å; C515-H537 PolarHBondContact SG-NE2 3.37Å; C515-H537 VanDerWaalsContact SG-NE2 3.38Å
516	E	88.9	Confident	89.9	Confident	137 Å²	137	80.1 Å²	80.1	64%	0.64	42%	0.421	S	S	*	.			trans	-107.2	16	-178	-71.7	160.2	169	0	0	111.8	R530	E516-R530 IonicContact OE1-CZ 2.72Å; E516-R530 IonicContact OE1-NH1 2.71Å; E516-R530 PolarHBondContact OE1-NH1 2.72Å; E516-R530 IonicContact OE1-NH2 3.51Å; E516-R530 PolarHBondContact OE1-NH2 3.22Å; E516-R530 IonicContact OE2-CZ 3.54Å; E516-R530 IonicContact OE2-NE 2.68Å; E516-R530 IonicContact OE2-NH1 3.85Å; E516-R530 IonicContact OE2-NH2 3.06Å; E516-R530 PolarHBondContact OE2-NH2 3.06Å
517	F	87.7	Confident	90	Very high	106 Å²	106	79.2 Å²	79.2	47%	0.465	42%	0.418	S	S	.	.	S	Bend	trans	-104.1	125.8	177.2	-173.3	-92.1	0	0	0	110.1	C515 G519 C520 H537	C515-F517 PolarHBondContact SG-N 3.44Å; C515-F517 VanDerWaalsContact SG-N 3.4Å; F517-G519 PolarHBondContact O-N 3.27Å; F517-C520 PolarHBondContact O-N 2.75Å; F517-C520 VanDerWaalsContact O-N 3.14Å; F517-H537 HydrophobicContact CB-CB 4.25Å; F517-H537 HydrophobicContact CD1-CB 3.96Å; F517-H537 AromaticContact CD1-CE1 3.89Å; F517-H537 AromaticContact CD1-CG 3.56Å; F517-H537 AromaticContact CD1-ND1 3.42Å; F517-H537 WeakPolarHBondContact CD1-ND1 3.31Å; F517-H537 HydrophobicContact CD2-CB 3.59Å; F517-H537 AromaticContact CD2-CG 3.98Å; F517-H537 HydrophobicContact CE1-CB 4.18Å; F517-H537 AromaticContact CE1-ND1 3.81Å; F517-H537 HydrophobicContact CE2-CB 3.82Å; F517-H537 HydrophobicContact CG-CB 3.66Å; F517-H537 AromaticContact CG-CD2 3.79Å; F517-H537 AromaticContact CG-CG 3.48Å; F517-H537 VanDerWaalsContact CG-CG 3.48Å; F517-H537 AromaticContact CG-ND1 3.86Å; F517-H537 HydrophobicContact CZ-CB 4.11Å
518	E	84.7	Confident	89.9	Confident	172 Å²	172	78.2 Å²	78.2	80%	0.804	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	134.7	-178.8	-64.5	-57.6	147.3	0	0	112.1
519	G	86.4	Confident	89.8	Confident	76 Å²	76	76 Å²	76	78%	0.784	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	16.2	-175.7	0	0	0	0	0	115.3	F517	F517-G519 PolarHBondContact O-N 3.27Å
520	C	90	Very high	90	Very high	19 Å²	19	75.2 Å²	75.2	13%	0.128	39%	0.387	C	S	.	.			trans	-134.1	93.6	173.2	-165.4	0	0	0	0	114.4	C515 F517 R522 H537	C515-C520 WeakPolarHBondContact CB-O 3.09Å; F517-C520 PolarHBondContact O-N 2.75Å; F517-C520 VanDerWaalsContact O-N 3.14Å; C520-R522 PolarHBondContact O-N 2.84Å; C520-H537 VanDerWaalsContact CB-CE1 3.45Å; C520-H537 WeakPolarHBondContact CB-CE1 3.49Å; C520-H537 PolarHBondContact SG-CE1 3.45Å
521	D	87.4	Confident	90	Very high	143 Å²	143	77.9 Å²	77.9	77%	0.765	40%	0.397	S	S	*	.			trans	-73.2	19.2	-179.6	-54.1	-70.5	0	0	0	115.5	R523	D521-R523 VanDerWaalsContact O-CG 3.24Å; D521-R523 WeakPolarHBondContact O-CG 3.42Å; D521-R523 PolarHBondContact O-N 3.11Å
522	R	89.3	Confident	89.6	Confident	147 Å²	147	75.1 Å²	75.1	56%	0.555	39%	0.385	S	S	*	.			trans	-69.4	122.9	-174.6	-76	-179.3	173	-163.4	2.6	111.3	C515 C520 F524 H533	C515-R522 VanDerWaalsContact CB-O 3.29Å; C515-R522 WeakPolarHBondContact CB-O 3.26Å; C515-R522 PolarHBondContact N-O 3.3Å; C520-R522 PolarHBondContact O-N 2.84Å; R522-F524 HydrophobicContact CB-CE2 3.78Å; R522-F524 HydrophobicContact CB-CZ 4.03Å; R522-F524 WeakPolarHBondContact O-CE2 3.43Å; R522-H533 VanDerWaalsContact CD-NE2 3.28Å; R522-H533 WeakPolarHBondContact CD-NE2 3.46Å
523	R	92.2	Very high	89.5	Confident	137 Å²	137	72.9 Å²	72.9	52%	0.517	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	140	-176.6	-39.2	-173.8	85.1	-141.2	1.3	111.7	K511 F513 V514 D521	K511-R523 HydrophobicContact CB-CB 3.57Å; K511-R523 HydrophobicContact CD-CB 4.46Å; K511-R523 WeakPolarHBondContact CD-O 3.38Å; K511-R523 PolarHBondContact O-NH1 3.01Å; F513-R523 CarbonylContact O-C 3.54Å; F513-R523 WeakPolarHBondContact O-CA 3.39Å; V514-R523 HydrophobicContact CG1-CG 4.42Å; V514-R523 HydrophobicContact CG2-CG 4.38Å; D521-R523 VanDerWaalsContact O-CG 3.24Å; D521-R523 WeakPolarHBondContact O-CG 3.42Å; D521-R523 PolarHBondContact O-N 3.11Å
524	F	91.3	Very high	89.1	Confident	45 Å²	45	71.6 Å²	71.6	20%	0.197	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.6	-173.4	-60.8	-93.3	0	0	0	112.6	K511 P512 F513 R522 N526 D529 R530 H533	K511-F524 CarbonylContact C-O 3.6Å; K511-F524 VanDerWaalsContact C-O 3.28Å; K511-F524 VanDerWaalsContact CA-O 3.31Å; K511-F524 WeakPolarHBondContact CA-O 3.47Å; P512-F524 WeakPolarHBondContact CD-O 3.4Å; F513-F524 HydrophobicContact CB-CB 4.33Å; F513-F524 PolarHBondContact N-O 3.11Å; F513-F524 PolarHBondContact O-N 3.41Å; R522-F524 HydrophobicContact CB-CE2 3.78Å; R522-F524 HydrophobicContact CB-CZ 4.03Å; R522-F524 WeakPolarHBondContact O-CE2 3.43Å; F524-N526 VanDerWaalsContact C-N 3.34Å; F524-D529 HydrophobicContact CD1-CB 4.33Å; F524-R530 HydrophobicContact CB-CB 4.15Å; F524-R530 HydrophobicContact CD2-CB 3.82Å; F524-R530 HydrophobicContact CD2-CG 3.98Å; F524-R530 HydrophobicContact CE2-CG 4.47Å; F524-R530 HydrophobicContact CG-CB 4.04Å; F524-H533 HydrophobicContact CE1-CB 4.04Å; F524-H533 HydrophobicContact CE2-CB 4.08Å; F524-H533 AromaticContact CE2-CD2 3.37Å; F524-H533 WeakPolarHBondContact CE2-CD2 3.36Å; F524-H533 AromaticContact CE2-CG 3.99Å; F524-H533 HydrophobicContact CZ-CB 3.54Å; F524-H533 AromaticContact CZ-CD2 3.24Å; F524-H533 WeakPolarHBondContact CZ-CD2 3.2Å; F524-H533 AromaticContact CZ-CG 3.47Å; F524-H533 VanDerWaalsContact CZ-CG 3.47Å
525	A	91.4	Very high	88.7	Confident	20 Å²	20	71 Å²	71	17%	0.165	36%	0.358	C	S	.	.	S	Bend	trans	-75.4	-19.7	179.4	0	0	0	0	0	113.8	R505	R505-A525 HydrophobicContact CB-CB 4.22Å; R505-A525 WeakPolarHBondContact CD-O 3.4Å; R505-A525 PolarHBondContact NH1-O 2.96Å
526	N	91.8	Very high	88.2	Confident	9 Å²	9	73.3 Å²	73.3	5%	0.048	37%	0.372	C	S	.	.	S	Bend	trans	-142.8	159.6	174.4	71.1	76.6	0	0	0	111.5	I502 F524 S528 D529 R530 T631	I502-N526 HydrophobicContact CD1-CB 3.8Å; I502-N526 HydrophobicContact CG1-CB 4.01Å; I502-N526 HydrophobicContact CG2-CB 4.07Å; F524-N526 VanDerWaalsContact C-N 3.34Å; N526-S528 WeakPolarHBondContact OD1-CB 3.33Å; N526-S528 PolarHBondContact OD1-N 3.42Å; N526-D529 PolarHBondContact ND2-OD2 2.96Å; N526-D529 PolarHBondContact OD1-N 3.38Å; N526-D529 PolarHBondContact OD1-OD2 2.96Å; N526-R530 PolarHBondContact O-N 2.86Å; N526-T631 WeakPolarHBondContact ND2-CG2 3.43Å
527	S	92.1	Very high	88	Confident	49 Å²	49	68.4 Å²	68.4	34%	0.343	35%	0.349	S	S	.	.	H	α-helix	trans	-73.4	-26.2	-177.7	52.6	0	0	0	0	114.2	R530 K531	S527-R530 PolarHBondContact O-N 3.49Å; S527-K531 WeakPolarHBondContact O-CG 3.43Å; S527-K531 PolarHBondContact O-N 3.39Å
528	S	88.5	Confident	87.6	Confident	62 Å²	62	69.8 Å²	69.8	43%	0.434	36%	0.358	S	S	.	.	H	α-helix	trans	-68.6	-42.1	-179.4	-63.9	0	0	0	0	112.3	N526 K531 K532	N526-S528 WeakPolarHBondContact OD1-CB 3.33Å; N526-S528 PolarHBondContact OD1-N 3.42Å; S528-K531 PolarHBondContact O-N 2.87Å; S528-K532 WeakPolarHBondContact O-CG 3.14Å; S528-K532 PolarHBondContact O-N 3.44Å
529	D	89	Confident	86.9	Confident	26 Å²	26	67.2 Å²	67.2	14%	0.139	35%	0.35	C	S	.	.	H	α-helix	trans	-75.4	-30.2	177.9	-62.2	-30.6	0	0	0	111.1	F524 N526 K532 H533 T631 T632	F524-D529 HydrophobicContact CD1-CB 4.33Å; N526-D529 PolarHBondContact ND2-OD2 2.96Å; N526-D529 PolarHBondContact OD1-N 3.38Å; N526-D529 PolarHBondContact OD1-OD2 2.96Å; D529-K532 PolarHBondContact O-N 2.89Å; D529-H533 PolarHBondContact O-N 3.46Å; D529-T631 WeakPolarHBondContact OD2-CA 3.32Å; D529-T631 WeakPolarHBondContact OD2-CB 3.18Å; D529-T631 WeakPolarHBondContact OD2-CG2 3.46Å; D529-T632 WeakPolarHBondContact OD1-CB 3.39Å; D529-T632 VanDerWaalsContact OD1-CG2 3.23Å; D529-T632 WeakPolarHBondContact OD1-CG2 3.24Å; D529-T632 PolarHBondContact OD1-N 2.93Å; D529-T632 PolarHBondContact OD1-OG1 3.16Å
530	R	92.9	Very high	86.4	Confident	33 Å²	33	66.5 Å²	66.5	13%	0.125	33%	0.328	C	S	.	.	H	α-helix	trans	-59.7	-53.5	164.2	-174.6	-170.6	70.7	171.9	11.8	111.2	F513 V514 E516 F524 N526 S527 K532 H533 M534	F513-R530 HydrophobicContact CB-CB 4.29Å; V514-R530 WeakPolarHBondContact O-CD 3.45Å; V514-R530 PolarHBondContact O-NH1 3.45Å; E516-R530 IonicContact OE1-CZ 2.72Å; E516-R530 IonicContact OE1-NH1 2.71Å; E516-R530 PolarHBondContact OE1-NH1 2.72Å; E516-R530 IonicContact OE1-NH2 3.51Å; E516-R530 PolarHBondContact OE1-NH2 3.22Å; E516-R530 IonicContact OE2-CZ 3.54Å; E516-R530 IonicContact OE2-NE 2.68Å; E516-R530 IonicContact OE2-NH1 3.85Å; E516-R530 IonicContact OE2-NH2 3.06Å; E516-R530 PolarHBondContact OE2-NH2 3.06Å; F524-R530 HydrophobicContact CB-CB 4.15Å; F524-R530 HydrophobicContact CD2-CB 3.82Å; F524-R530 HydrophobicContact CD2-CG 3.98Å; F524-R530 HydrophobicContact CE2-CG 4.47Å; F524-R530 HydrophobicContact CG-CB 4.04Å; N526-R530 PolarHBondContact O-N 2.86Å; S527-R530 PolarHBondContact O-N 3.49Å; R530-K532 PolarHBondContact O-N 3.19Å; R530-H533 WeakPolarHBondContact O-CA 3.42Å; R530-H533 WeakPolarHBondContact O-CB 3.37Å; R530-H533 PolarHBondContact O-N 3.15Å; R530-M534 HydrophobicContact CG-CE 4.1Å; R530-M534 WeakPolarHBondContact O-CE 3.39Å; R530-M534 PolarHBondContact O-N 3.41Å
531	K	87.8	Confident	86	Confident	147 Å²	147	69.2 Å²	69.2	64%	0.639	34%	0.338	S	S	*	.	H	α-helix	trans	-55	-38.2	179.7	-79.8	-171.7	174.7	-167.6	0	111.7	S527 S528 M534	S527-K531 WeakPolarHBondContact O-CG 3.43Å; S527-K531 PolarHBondContact O-N 3.39Å; S528-K531 PolarHBondContact O-N 2.87Å; K531-M534 WeakPolarHBondContact O-CB 3.41Å; K531-M534 PolarHBondContact O-N 2.82Å
532	K	84.5	Confident	85.8	Confident	60 Å²	60	63.5 Å²	63.5	26%	0.261	31%	0.309	S	S	.	.	H	α-helix	trans	-69.6	-37.1	176.1	-72.4	163.4	-168.6	177.5	0	112.4	S528 D529 R530 M534 H535 H556 T632	S528-K532 WeakPolarHBondContact O-CG 3.14Å; S528-K532 PolarHBondContact O-N 3.44Å; D529-K532 PolarHBondContact O-N 2.89Å; R530-K532 PolarHBondContact O-N 3.19Å; K532-M534 PolarHBondContact O-N 3.45Å; K532-H535 PolarHBondContact O-CD2 3.23Å; K532-H535 PolarHBondContact O-N 3.31Å; K532-H556 PolarHBondContact O-CE1 3.27Å; K532-T632 HydrophobicContact CD-CG2 4.23Å; K532-T632 WeakPolarHBondContact CD-OG1 3.11Å; K532-T632 WeakPolarHBondContact CE-OG1 3.11Å; K532-T632 PolarHBondContact NZ-O 2.92Å; K532-T632 PolarHBondContact NZ-OG1 3.19Å
533	H	87.7	Confident	85.7	Confident	15 Å²	15	58.7 Å²	58.7	7%	0.069	29%	0.291	C	S	.	.	H	α-helix	trans	-57.8	-30.7	171.4	177	33.8	0	0	0	113.4	R522 F524 D529 R530 H535 V536 H537	R522-H533 VanDerWaalsContact CD-NE2 3.28Å; R522-H533 WeakPolarHBondContact CD-NE2 3.46Å; F524-H533 HydrophobicContact CE1-CB 4.04Å; F524-H533 HydrophobicContact CE2-CB 4.08Å; F524-H533 AromaticContact CE2-CD2 3.37Å; F524-H533 WeakPolarHBondContact CE2-CD2 3.36Å; F524-H533 AromaticContact CE2-CG 3.99Å; F524-H533 HydrophobicContact CZ-CB 3.54Å; F524-H533 AromaticContact CZ-CD2 3.24Å; F524-H533 WeakPolarHBondContact CZ-CD2 3.2Å; F524-H533 AromaticContact CZ-CG 3.47Å; F524-H533 VanDerWaalsContact CZ-CG 3.47Å; D529-H533 PolarHBondContact O-N 3.46Å; R530-H533 WeakPolarHBondContact O-CA 3.42Å; R530-H533 WeakPolarHBondContact O-CB 3.37Å; R530-H533 PolarHBondContact O-N 3.15Å; H533-H535 PolarHBondContact O-N 3.13Å; H533-H535 VanDerWaalsContact O-N 3.14Å; H533-V536 VanDerWaalsContact O-CB 3.24Å; H533-V536 WeakPolarHBondContact O-CB 3.42Å; H533-V536 WeakPolarHBondContact O-CG2 3.13Å; H533-V536 PolarHBondContact O-N 3.5Å; H533-H537 AromaticContact CD2-NE2 3.92Å; H533-H537 AromaticContact CE1-CE1 3.84Å; H533-H537 AromaticContact CE1-NE2 3.39Å; H533-H537 PolarHBondContact CE1-NE2 3.35Å; H533-H537 AromaticContact NE2-CE1 3.93Å; H533-H537 AromaticContact NE2-NE2 3.24Å; H533-H537 PolarHBondContact NE2-NE2 3.22Å
534	M	84.1	Confident	85.4	Confident	36 Å²	36	56.9 Å²	56.9	18%	0.177	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-27.8	-178.3	-53	-60.6	82	0	0	113.6	C515 R530 K531 K532 V536 H537 M538	C515-M534 HydrophobicContact CB-CE 4.05Å; C515-M534 WeakPolarHBondContact SG-CE 3.44Å; R530-M534 HydrophobicContact CG-CE 4.1Å; R530-M534 WeakPolarHBondContact O-CE 3.39Å; R530-M534 PolarHBondContact O-N 3.41Å; K531-M534 WeakPolarHBondContact O-CB 3.41Å; K531-M534 PolarHBondContact O-N 2.82Å; K532-M534 PolarHBondContact O-N 3.45Å; M534-V536 PolarHBondContact O-N 2.83Å; M534-V536 VanDerWaalsContact O-N 3.15Å; M534-H537 PolarHBondContact O-N 2.99Å; M534-M538 PolarHBondContact O-N 3.46Å; M534-M538 VanDerWaalsContact O-N 3.13Å
535	H	81.6	Confident	85.5	Confident	39 Å²	39	55.2 Å²	55.2	18%	0.181	28%	0.281	C	S	.	.	H	α-helix	trans	-59	-25.5	173.2	-65.8	-75	0	0	0	113	K532 H533 H537 N539 D540	K532-H535 PolarHBondContact O-CD2 3.23Å; K532-H535 PolarHBondContact O-N 3.31Å; H533-H535 PolarHBondContact O-N 3.13Å; H533-H535 VanDerWaalsContact O-N 3.14Å; H535-H537 VanDerWaalsContact C-N 3.33Å; H535-N539 PolarHBondContact O-N 3.33Å; H535-D540 PolarHBondContact O-N 2.74Å
536	V	82.7	Confident	85.2	Confident	61 Å²	61	63.7 Å²	63.7	37%	0.37	31%	0.309	S	S	.	.	H	α-helix	trans	-68	-33.2	175	-175.8	0	0	0	0	111.3	H533 M534	H533-V536 VanDerWaalsContact O-CB 3.24Å; H533-V536 WeakPolarHBondContact O-CB 3.42Å; H533-V536 WeakPolarHBondContact O-CG2 3.13Å; H533-V536 PolarHBondContact O-N 3.5Å; M534-V536 PolarHBondContact O-N 2.83Å; M534-V536 VanDerWaalsContact O-N 3.15Å
537	H	84.5	Confident	84.9	Confident	35 Å²	35	67.7 Å²	67.7	16%	0.162	33%	0.326	C	S	.	.	H	α-helix	trans	-82.7	-32.6	178.1	-60.4	-54.7	0	0	0	112.9	C515 F517 C520 H533 M534 H535 N539	C515-H537 PolarHBondContact SG-NE2 3.37Å; C515-H537 VanDerWaalsContact SG-NE2 3.38Å; F517-H537 HydrophobicContact CB-CB 4.25Å; F517-H537 HydrophobicContact CD1-CB 3.96Å; F517-H537 AromaticContact CD1-CE1 3.89Å; F517-H537 AromaticContact CD1-CG 3.56Å; F517-H537 AromaticContact CD1-ND1 3.42Å; F517-H537 WeakPolarHBondContact CD1-ND1 3.31Å; F517-H537 HydrophobicContact CD2-CB 3.59Å; F517-H537 AromaticContact CD2-CG 3.98Å; F517-H537 HydrophobicContact CE1-CB 4.18Å; F517-H537 AromaticContact CE1-ND1 3.81Å; F517-H537 HydrophobicContact CE2-CB 3.82Å; F517-H537 HydrophobicContact CG-CB 3.66Å; F517-H537 AromaticContact CG-CD2 3.79Å; F517-H537 AromaticContact CG-CG 3.48Å; F517-H537 VanDerWaalsContact CG-CG 3.48Å; F517-H537 AromaticContact CG-ND1 3.86Å; F517-H537 HydrophobicContact CZ-CB 4.11Å; C520-H537 VanDerWaalsContact CB-CE1 3.45Å; C520-H537 WeakPolarHBondContact CB-CE1 3.49Å; C520-H537 PolarHBondContact SG-CE1 3.45Å; H533-H537 AromaticContact CD2-NE2 3.92Å; H533-H537 AromaticContact CE1-CE1 3.84Å; H533-H537 AromaticContact CE1-NE2 3.39Å; H533-H537 PolarHBondContact CE1-NE2 3.35Å; H533-H537 AromaticContact NE2-CE1 3.93Å; H533-H537 AromaticContact NE2-NE2 3.24Å; H533-H537 PolarHBondContact NE2-NE2 3.22Å; M534-H537 PolarHBondContact O-N 2.99Å; H535-H537 VanDerWaalsContact C-N 3.33Å; H537-N539 PolarHBondContact O-N 2.92Å
538	M	78.9	Confident	84.4	Confident	135 Å²	135	75 Å²	75	67%	0.665	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-8.9	175.8	-61.8	177.8	72	0	0	112.9	M534 D540	M534-M538 PolarHBondContact O-N 3.46Å; M534-M538 VanDerWaalsContact O-N 3.13Å; M538-D540 HydrophobicContact CB-CB 4.06Å; M538-D540 PolarHBondContact O-N 3.06Å
539	N	71.2	Confident	84.2	Confident	117 Å²	117	75.6 Å²	75.6	63%	0.626	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	17.4	-169.4	-73.3	-49	0	0	0	114.2	H535 H537	H535-N539 PolarHBondContact O-N 3.33Å; H537-N539 PolarHBondContact O-N 2.92Å
540	D	75.7	Confident	84.3	Confident	62 Å²	62	75 Å²	75	33%	0.332	37%	0.365	S	S	.	.			trans	-82.1	127.6	-172.6	179.2	28.6	0	0	0	110.9	H535 M538 P542 T555	H535-D540 PolarHBondContact O-N 2.74Å; M538-D540 HydrophobicContact CB-CB 4.06Å; M538-D540 PolarHBondContact O-N 3.06Å; D540-P542 VanDerWaalsContact C-CD 3.46Å; D540-P542 WeakPolarHBondContact O-CD 3.42Å; D540-P542 WeakPolarHBondContact OD1-CD 3.39Å; D540-T555 WeakPolarHBondContact O-CG2 3.43Å
541	K	81.7	Confident	83.9	Confident	75 Å²	75	81.1 Å²	81.1	33%	0.326	40%	0.4	S	S	.	.			trans	-126.1	62.9	-177.7	-66.3	-175.7	176.3	-173.8	0	110.3	Y543 S553 Y554 T555 D588	K541-Y543 PolarHBondContact O-N 2.96Å; K541-Y543 VanDerWaalsContact O-N 3.17Å; K541-S553 WeakPolarHBondContact CB-OG 3.44Å; K541-S553 WeakPolarHBondContact O-CB 3.42Å; K541-Y554 CarbonylContact C-O 3.6Å; K541-Y554 VanDerWaalsContact C-O 3.23Å; K541-Y554 VanDerWaalsContact CA-O 3.27Å; K541-Y554 WeakPolarHBondContact CA-O 3.37Å; K541-T555 HydrophobicContact CG-CG2 3.92Å; K541-D588 WeakPolarHBondContact CE-OD2 3.33Å; K541-D588 IonicContact NZ-OD2 3.52Å; K541-D588 PolarHBondContact NZ-OD2 3.26Å
542	P	83.5	Confident	84	Confident	24 Å²	24	79.7 Å²	79.7	16%	0.156	39%	0.394	C	S	.	.			trans	-75.7	-8.5	-168.2	31.9	-33	0	0	0	112.6	D540 F544	D540-P542 VanDerWaalsContact C-CD 3.46Å; D540-P542 WeakPolarHBondContact O-CD 3.42Å; D540-P542 WeakPolarHBondContact OD1-CD 3.39Å; P542-F544 WeakPolarHBondContact O-CD1 3.42Å; P542-F544 PolarHBondContact O-N 2.83Å
543	Y	86.4	Confident	84.2	Confident	46 Å²	46	79.3 Å²	79.3	18%	0.18	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	79.9	179.6	-54.3	-75.9	0	0	0	110.5	K541 Y554 T555 P557	K541-Y543 PolarHBondContact O-N 2.96Å; K541-Y543 VanDerWaalsContact O-N 3.17Å; Y543-Y554 WeakPolarHBondContact CB-O 3.31Å; Y543-Y554 WeakPolarHBondContact CD2-O 3.37Å; Y543-Y554 PolarHBondContact N-O 2.95Å; Y543-Y554 PolarHBondContact O-N 2.74Å; Y543-T555 WeakPolarHBondContact CD2-O 3.43Å; Y543-T555 WeakPolarHBondContact CE2-O 3.09Å; Y543-P557 HydrophobicContact CD1-CB 3.91Å; Y543-P557 HydrophobicContact CD1-CG 3.88Å; Y543-P557 HydrophobicContact CD2-CG 4.42Å; Y543-P557 HydrophobicContact CE1-CB 4.06Å; Y543-P557 HydrophobicContact CE1-CG 3.55Å; Y543-P557 HydrophobicContact CE2-CG 4.14Å; Y543-P557 HydrophobicContact CG-CB 4.34Å; Y543-P557 HydrophobicContact CG-CG 4.31Å
544	F	86.4	Confident	84.2	Confident	98 Å²	98	81.1 Å²	81.1	43%	0.43	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	143.4	175.6	59.2	-82.1	0	0	0	112.6	P542 R546 L560	P542-F544 WeakPolarHBondContact O-CD1 3.42Å; P542-F544 PolarHBondContact O-N 2.83Å; F544-R546 HydrophobicContact CD2-CG 3.76Å; F544-R546 HydrophobicContact CE2-CG 3.61Å; F544-R546 VanDerWaalsContact CE2-NE 3.28Å; F544-L560 WeakPolarHBondContact O-CD2 3.38Å
545	C	92.4	Very high	84.3	Confident	11 Å²	11	80.5 Å²	80.5	7%	0.074	40%	0.404	C	S	.	.			trans	-69.5	143.4	165	-165.2	0	0	0	0	110.4	C550 K552 L560 H563	C545-C550 WeakPolarHBondContact CB-O 3.49Å; C545-K552 WeakPolarHBondContact CB-O 3.36Å; C545-K552 PolarHBondContact N-O 2.93Å; C545-L560 HydrophobicContact CB-CD1 4Å; C545-H563 PolarHBondContact SG-NE2 2.97Å
546	R	85.5	Confident	84.4	Confident	197 Å²	197	80.9 Å²	80.9	74%	0.743	41%	0.405	S	S	*	.			trans	-110.4	9.7	178.8	-63.9	-171.9	-179.6	-167.7	0.1	112.9	F544	F544-R546 HydrophobicContact CD2-CG 3.76Å; F544-R546 HydrophobicContact CE2-CG 3.61Å; F544-R546 VanDerWaalsContact CE2-NE 3.28Å
547	F	85.3	Confident	84.6	Confident	94 Å²	94	79.8 Å²	79.8	41%	0.412	40%	0.399	S	S	.	.	S	Bend	trans	-80	130	175.7	-165.8	-91.9	0	0	0	109.7	G549 C550 H567	F547-G549 PolarHBondContact O-N 3.31Å; F547-C550 PolarHBondContact O-N 3.48Å; F547-H567 HydrophobicContact CB-CB 4.47Å; F547-H567 VanDerWaalsContact CB-CD2 3.5Å; F547-H567 WeakPolarHBondContact CB-CD2 3.49Å; F547-H567 HydrophobicContact CD1-CB 4.36Å; F547-H567 AromaticContact CD1-CE1 3.25Å; F547-H567 WeakPolarHBondContact CD1-CE1 3.48Å; F547-H567 AromaticContact CD1-CG 3.74Å; F547-H567 AromaticContact CD1-ND1 3.31Å; F547-H567 VanDerWaalsContact CD1-ND1 3.31Å; F547-H567 WeakPolarHBondContact CD1-ND1 3.38Å; F547-H567 AromaticContact CD1-NE2 3.8Å; F547-H567 HydrophobicContact CD2-CB 3.64Å; F547-H567 AromaticContact CD2-CG 3.79Å; F547-H567 AromaticContact CE1-CE1 3.23Å; F547-H567 WeakPolarHBondContact CE1-CE1 3.41Å; F547-H567 AromaticContact CE1-ND1 3.67Å; F547-H567 HydrophobicContact CE2-CB 3.85Å; F547-H567 HydrophobicContact CG-CB 3.9Å; F547-H567 AromaticContact CG-CD2 3.76Å; F547-H567 AromaticContact CG-CE1 3.8Å; F547-H567 AromaticContact CG-CG 3.48Å; F547-H567 VanDerWaalsContact CG-CG 3.48Å; F547-H567 AromaticContact CG-ND1 3.58Å; F547-H567 HydrophobicContact CZ-CB 4.29Å; F547-H567 AromaticContact CZ-CE1 3.77Å
548	K	82.1	Confident	84.7	Confident	203 Å²	203	80.5 Å²	80.5	88%	0.883	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	124.3	-175.3	-172.2	177.3	-179.9	-180	0	110.2
549	G	84.7	Confident	85.2	Confident	74 Å²	74	76.1 Å²	76.1	76%	0.763	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	18.9	-175.9	0	0	0	0	0	115.1	F547	F547-G549 PolarHBondContact O-N 3.31Å
550	C	90.4	Very high	86.2	Confident	12 Å²	12	71.7 Å²	71.7	8%	0.081	37%	0.367	C	S	.	.			trans	-134.4	90.9	174.5	-155	0	0	0	0	113.9	C545 F547 K552 H563 H567	C545-C550 WeakPolarHBondContact CB-O 3.49Å; F547-C550 PolarHBondContact O-N 3.48Å; C550-K552 PolarHBondContact O-N 2.83Å; C550-H563 PolarHBondContact SG-CE1 3.4Å; C550-H567 WeakPolarHBondContact CB-NE2 3.42Å; C550-H567 PolarHBondContact SG-NE2 2.69Å
551	D	85.5	Confident	86.9	Confident	162 Å²	162	75.3 Å²	75.3	87%	0.866	38%	0.376	S	S	*	.			trans	-79.2	25.5	-176.3	-44.5	-59.9	0	0	0	114	S553	D551-S553 PolarHBondContact O-N 3.14Å
552	K	88.7	Confident	87.2	Confident	118 Å²	118	78.5 Å²	78.5	51%	0.513	39%	0.39	S	S	.	.			trans	-79.4	114.1	-175	-68.1	-174.8	-178.5	-178.6	0	110.9	C545 C550 Y554	C545-K552 WeakPolarHBondContact CB-O 3.36Å; C545-K552 PolarHBondContact N-O 2.93Å; C550-K552 PolarHBondContact O-N 2.83Å; K552-Y554 HydrophobicContact CB-CE2 3.79Å; K552-Y554 WeakPolarHBondContact O-CE2 3.36Å
553	S	88.8	Confident	87.5	Confident	51 Å²	51	78.1 Å²	78.1	36%	0.357	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	149.6	175.4	65.6	0	0	0	0	112.6	K541 D551	K541-S553 WeakPolarHBondContact CB-OG 3.44Å; K541-S553 WeakPolarHBondContact O-CB 3.42Å; D551-S553 PolarHBondContact O-N 3.14Å
554	Y	87.9	Confident	87.6	Confident	53 Å²	53	78 Å²	78	21%	0.208	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	147.1	-173	-63.4	-84.6	0	0	0	112.1	K541 Y543 K552 H556 L560 H563	K541-Y554 CarbonylContact C-O 3.6Å; K541-Y554 VanDerWaalsContact C-O 3.23Å; K541-Y554 VanDerWaalsContact CA-O 3.27Å; K541-Y554 WeakPolarHBondContact CA-O 3.37Å; Y543-Y554 WeakPolarHBondContact CB-O 3.31Å; Y543-Y554 WeakPolarHBondContact CD2-O 3.37Å; Y543-Y554 PolarHBondContact N-O 2.95Å; Y543-Y554 PolarHBondContact O-N 2.74Å; K552-Y554 HydrophobicContact CB-CE2 3.79Å; K552-Y554 WeakPolarHBondContact O-CE2 3.36Å; Y554-H556 VanDerWaalsContact C-N 3.27Å; Y554-H556 PolarHBondContact O-N 3.43Å; Y554-L560 HydrophobicContact CD2-CB 3.97Å; Y554-L560 HydrophobicContact CD2-CD1 4.11Å; Y554-L560 HydrophobicContact CE2-CD1 4.41Å; Y554-L560 HydrophobicContact CG-CB 4.35Å; Y554-H563 HydrophobicContact CE1-CB 4.46Å; Y554-H563 HydrophobicContact CE2-CB 3.85Å; Y554-H563 AromaticContact CE2-CD2 3.39Å; Y554-H563 WeakPolarHBondContact CE2-CD2 3.47Å; Y554-H563 AromaticContact CE2-CG 3.78Å; Y554-H563 AromaticContact CZ-CD2 3.82Å; Y554-H563 AromaticContact CZ-CG 3.75Å; Y554-H563 WeakPolarHBondContact OH-CB 3.49Å
555	T	85.6	Confident	87.7	Confident	24 Å²	24	80.5 Å²	80.5	15%	0.147	40%	0.395	C	S	.	.	S	Bend	trans	-68.6	-23.6	173.1	54.4	0	0	0	0	112.8	D540 K541 Y543	D540-T555 WeakPolarHBondContact O-CG2 3.43Å; K541-T555 HydrophobicContact CG-CG2 3.92Å; Y543-T555 WeakPolarHBondContact CD2-O 3.43Å; Y543-T555 WeakPolarHBondContact CE2-O 3.09Å
556	H	84.4	Confident	87.4	Confident	47 Å²	47	84 Å²	84	22%	0.218	42%	0.415	C	S	.	.	S	Bend	trans	-137	142.7	-174.2	-64	-17.4	0	0	0	113.2	K532 Y554 S558 S559 L560	K532-H556 PolarHBondContact O-CE1 3.27Å; Y554-H556 VanDerWaalsContact C-N 3.27Å; Y554-H556 PolarHBondContact O-N 3.43Å; H556-S558 PolarHBondContact O-N 3.21Å; H556-S559 PolarHBondContact O-N 3Å; H556-S559 VanDerWaalsContact O-N 3.1Å; H556-L560 PolarHBondContact O-N 3.48Å
557	P	86.6	Confident	87.4	Confident	38 Å²	38	76.3 Å²	76.3	25%	0.247	39%	0.388	C	S	.	.	H	α-helix	trans	-64.8	-25.9	179	1	1.9	0	0	0	113.6	Y543 R561 Y634	Y543-P557 HydrophobicContact CD1-CB 3.91Å; Y543-P557 HydrophobicContact CD1-CG 3.88Å; Y543-P557 HydrophobicContact CD2-CG 4.42Å; Y543-P557 HydrophobicContact CE1-CB 4.06Å; Y543-P557 HydrophobicContact CE1-CG 3.55Å; Y543-P557 HydrophobicContact CE2-CG 4.14Å; Y543-P557 HydrophobicContact CG-CB 4.34Å; Y543-P557 HydrophobicContact CG-CG 4.31Å; P557-R561 WeakPolarHBondContact O-CB 3.25Å; P557-R561 PolarHBondContact O-N 3.45Å; P557-Y634 HydrophobicContact CB-CE1 4.19Å; P557-Y634 VanDerWaalsContact CD-OH 3.23Å; P557-Y634 WeakPolarHBondContact CD-OH 3.42Å; P557-Y634 HydrophobicContact CG-CE1 4.24Å; P557-Y634 HydrophobicContact CG-CE2 4.35Å; P557-Y634 WeakPolarHBondContact CG-OH 3.36Å
558	S	86.9	Confident	87	Confident	50 Å²	50	80 Å²	80	35%	0.35	40%	0.4	S	S	.	.	H	α-helix	trans	-66.1	-36.3	174	53.9	0	0	0	0	112.6	H556 K562 Y634	H556-S558 PolarHBondContact O-N 3.21Å; S558-K562 WeakPolarHBondContact O-CG 3.45Å; S558-K562 PolarHBondContact O-N 3.19Å; S558-Y634 PolarHBondContact N-OH 3.49Å; S558-Y634 PolarHBondContact OG-OH 3.41Å
559	S	90.6	Very high	86.3	Confident	42 Å²	42	75.4 Å²	75.4	29%	0.294	39%	0.385	S	S	.	.	H	α-helix	trans	-71.3	-43.5	174.8	-58.7	0	0	0	0	111.2	H556 R561 K562 H563	H556-S559 PolarHBondContact O-N 3Å; H556-S559 VanDerWaalsContact O-N 3.1Å; S559-R561 VanDerWaalsContact C-N 3.35Å; S559-R561 PolarHBondContact O-N 2.86Å; S559-K562 WeakPolarHBondContact O-CB 3.49Å; S559-K562 PolarHBondContact O-N 2.93Å; S559-H563 PolarHBondContact O-N 3.28Å
560	L	92.2	Very high	84.4	Confident	25 Å²	25	75.4 Å²	75.4	13%	0.131	37%	0.374	C	S	.	.	H	α-helix	trans	-57.5	-46.2	170.7	173.3	59.5	0	0	0	111.3	F544 C545 Y554 H556 K562 H563 L564	F544-L560 WeakPolarHBondContact O-CD2 3.38Å; C545-L560 HydrophobicContact CB-CD1 4Å; Y554-L560 HydrophobicContact CD2-CB 3.97Å; Y554-L560 HydrophobicContact CD2-CD1 4.11Å; Y554-L560 HydrophobicContact CE2-CD1 4.41Å; Y554-L560 HydrophobicContact CG-CB 4.35Å; H556-L560 PolarHBondContact O-N 3.48Å; L560-K562 PolarHBondContact O-N 3.24Å; L560-H563 CarbonylContact O-C 3.4Å; L560-H563 WeakPolarHBondContact O-CB 3.2Å; L560-H563 PolarHBondContact O-N 2.97Å; L560-H563 VanDerWaalsContact O-N 3.14Å; L560-L564 HydrophobicContact CD1-CD1 4.08Å; L560-L564 HydrophobicContact CD1-CD2 4.38Å; L560-L564 HydrophobicContact CD1-CG 3.92Å; L560-L564 HydrophobicContact CG-CD1 3.93Å; L560-L564 HydrophobicContact CG-CG 4.27Å; L560-L564 WeakPolarHBondContact O-CG 3.27Å; L560-L564 PolarHBondContact O-N 2.84Å
561	R	89.1	Confident	82.2	Confident	138 Å²	138	79.8 Å²	79.8	52%	0.521	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-39.2	177.2	-171.8	-178.7	-64.3	176.5	-2.5	112.6	P557 S559 H563	P557-R561 WeakPolarHBondContact O-CB 3.25Å; P557-R561 PolarHBondContact O-N 3.45Å; S559-R561 VanDerWaalsContact C-N 3.35Å; S559-R561 PolarHBondContact O-N 2.86Å; R561-H563 VanDerWaalsContact C-N 3.31Å; R561-H563 PolarHBondContact O-N 2.95Å
562	K	88.2	Confident	80.3	Confident	142 Å²	142	79 Å²	79	62%	0.617	40%	0.397	S	S	*	.	H	α-helix	trans	-59.7	-43.1	173	-80	179.4	177.4	-174.8	0	111.3	S558 S559 L560	S558-K562 WeakPolarHBondContact O-CG 3.45Å; S558-K562 PolarHBondContact O-N 3.19Å; S559-K562 WeakPolarHBondContact O-CB 3.49Å; S559-K562 PolarHBondContact O-N 2.93Å; L560-K562 PolarHBondContact O-N 3.24Å
563	H	90.1	Very high	77.9	Confident	16 Å²	16	80.2 Å²	80.2	7%	0.074	41%	0.41	C	S	.	.	H	α-helix	trans	-69.8	-42.5	179.1	165.6	48.1	0	0	0	113.6	C545 C550 Y554 S559 L560 R561 R565 V566 H567	C545-H563 PolarHBondContact SG-NE2 2.97Å; C550-H563 PolarHBondContact SG-CE1 3.4Å; Y554-H563 HydrophobicContact CE1-CB 4.46Å; Y554-H563 HydrophobicContact CE2-CB 3.85Å; Y554-H563 AromaticContact CE2-CD2 3.39Å; Y554-H563 WeakPolarHBondContact CE2-CD2 3.47Å; Y554-H563 AromaticContact CE2-CG 3.78Å; Y554-H563 AromaticContact CZ-CD2 3.82Å; Y554-H563 AromaticContact CZ-CG 3.75Å; Y554-H563 WeakPolarHBondContact OH-CB 3.49Å; S559-H563 PolarHBondContact O-N 3.28Å; L560-H563 CarbonylContact O-C 3.4Å; L560-H563 WeakPolarHBondContact O-CB 3.2Å; L560-H563 PolarHBondContact O-N 2.97Å; L560-H563 VanDerWaalsContact O-N 3.14Å; R561-H563 VanDerWaalsContact C-N 3.31Å; R561-H563 PolarHBondContact O-N 2.95Å; H563-R565 PolarHBondContact O-N 2.68Å; H563-R565 VanDerWaalsContact O-N 3.11Å; H563-V566 VanDerWaalsContact O-CB 3.24Å; H563-V566 WeakPolarHBondContact O-CB 3.48Å; H563-V566 WeakPolarHBondContact O-CG2 3.23Å; H563-V566 PolarHBondContact O-N 3.19Å; H563-H567 AromaticContact CE1-CD2 3.8Å; H563-H567 AromaticContact NE2-CD2 3.9Å
564	L	88	Confident	75.2	Confident	43 Å²	43	82 Å²	82	23%	0.225	43%	0.427	C	S	.	.	H	α-helix	trans	-56.7	-30.1	178.9	-75.3	168.1	0	0	0	112.7	L560 V566 H567 Y568	L560-L564 HydrophobicContact CD1-CD1 4.08Å; L560-L564 HydrophobicContact CD1-CD2 4.38Å; L560-L564 HydrophobicContact CD1-CG 3.92Å; L560-L564 HydrophobicContact CG-CD1 3.93Å; L560-L564 HydrophobicContact CG-CG 4.27Å; L560-L564 WeakPolarHBondContact O-CG 3.27Å; L560-L564 PolarHBondContact O-N 2.84Å; L564-V566 PolarHBondContact O-N 3.11Å; L564-H567 PolarHBondContact O-N 3.1Å; L564-H567 VanDerWaalsContact O-N 3.13Å; L564-Y568 HydrophobicContact CB-CE2 3.96Å; L564-Y568 WeakPolarHBondContact O-CD2 3.42Å; L564-Y568 PolarHBondContact O-N 2.88Å
565	R	88.5	Confident	72.8	Confident	150 Å²	150	87.1 Å²	87.1	57%	0.566	46%	0.457	S	S	*	.	H	α-helix	trans	-61.1	-28	172.6	-63.2	-176.7	-55.4	170	10.2	113.5	H563 H567 Y568 L569	H563-R565 PolarHBondContact O-N 2.68Å; H563-R565 VanDerWaalsContact O-N 3.11Å; R565-H567 VanDerWaalsContact C-N 3.31Å; R565-Y568 PolarHBondContact O-N 3.47Å; R565-L569 VanDerWaalsContact O-CB 3.3Å; R565-L569 WeakPolarHBondContact O-CB 3.48Å; R565-L569 WeakPolarHBondContact O-CD1 3.43Å; R565-L569 WeakPolarHBondContact O-CG 3.46Å; R565-L569 PolarHBondContact O-N 3.36Å
566	V	86.8	Confident	70.3	Confident	84 Å²	84	92.8 Å²	92.8	51%	0.509	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-40.1	175.1	-175.5	0	0	0	0	110.1	H563 L564 L569 S570	H563-V566 VanDerWaalsContact O-CB 3.24Å; H563-V566 WeakPolarHBondContact O-CB 3.48Å; H563-V566 WeakPolarHBondContact O-CG2 3.23Å; H563-V566 PolarHBondContact O-N 3.19Å; L564-V566 PolarHBondContact O-N 3.11Å; V566-L569 PolarHBondContact O-N 2.71Å; V566-S570 PolarHBondContact O-N 2.85Å; V566-S570 PolarHBondContact O-OG 3.21Å
567	H	85.6	Confident	67.9	Low	37 Å²	37	96.9 Å²	96.9	17%	0.171	52%	0.518	C	S	.	.	H	α-helix	trans	-68.7	-42.2	175.7	-62.8	-54.4	0	0	0	112.6	F547 C550 H563 L564 R565 L569 S570	F547-H567 HydrophobicContact CB-CB 4.47Å; F547-H567 VanDerWaalsContact CB-CD2 3.5Å; F547-H567 WeakPolarHBondContact CB-CD2 3.49Å; F547-H567 HydrophobicContact CD1-CB 4.36Å; F547-H567 AromaticContact CD1-CE1 3.25Å; F547-H567 WeakPolarHBondContact CD1-CE1 3.48Å; F547-H567 AromaticContact CD1-CG 3.74Å; F547-H567 AromaticContact CD1-ND1 3.31Å; F547-H567 VanDerWaalsContact CD1-ND1 3.31Å; F547-H567 WeakPolarHBondContact CD1-ND1 3.38Å; F547-H567 AromaticContact CD1-NE2 3.8Å; F547-H567 HydrophobicContact CD2-CB 3.64Å; F547-H567 AromaticContact CD2-CG 3.79Å; F547-H567 AromaticContact CE1-CE1 3.23Å; F547-H567 WeakPolarHBondContact CE1-CE1 3.41Å; F547-H567 AromaticContact CE1-ND1 3.67Å; F547-H567 HydrophobicContact CE2-CB 3.85Å; F547-H567 HydrophobicContact CG-CB 3.9Å; F547-H567 AromaticContact CG-CD2 3.76Å; F547-H567 AromaticContact CG-CE1 3.8Å; F547-H567 AromaticContact CG-CG 3.48Å; F547-H567 VanDerWaalsContact CG-CG 3.48Å; F547-H567 AromaticContact CG-ND1 3.58Å; F547-H567 HydrophobicContact CZ-CB 4.29Å; F547-H567 AromaticContact CZ-CE1 3.77Å; C550-H567 WeakPolarHBondContact CB-NE2 3.42Å; C550-H567 PolarHBondContact SG-NE2 2.69Å; H563-H567 AromaticContact CE1-CD2 3.8Å; H563-H567 AromaticContact NE2-CD2 3.9Å; L564-H567 PolarHBondContact O-N 3.1Å; L564-H567 VanDerWaalsContact O-N 3.13Å; R565-H567 VanDerWaalsContact C-N 3.31Å; H567-L569 PolarHBondContact O-N 3.11Å; H567-S570 PolarHBondContact O-N 3.15Å; H567-S570 VanDerWaalsContact O-N 3.17Å
568	Y	75.6	Confident	65.4	Low	170 Å²	170	99.8 Å²	99.8	67%	0.667	54%	0.535	S	S	*	.	H	α-helix	trans	-70.7	-13.4	176.7	-55.5	-49.4	0	0	0	114	L564 R565	L564-Y568 HydrophobicContact CB-CE2 3.96Å; L564-Y568 WeakPolarHBondContact O-CD2 3.42Å; L564-Y568 PolarHBondContact O-N 2.88Å; R565-Y568 PolarHBondContact O-N 3.47Å
569	L	67.1	Low	62.9	Low	107 Å²	107	104.6 Å²	104.6	56%	0.56	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	14.3	173.4	-67	169.7	0	0	0	112.4	R565 V566 H567	R565-L569 VanDerWaalsContact O-CB 3.3Å; R565-L569 WeakPolarHBondContact O-CB 3.48Å; R565-L569 WeakPolarHBondContact O-CD1 3.43Å; R565-L569 WeakPolarHBondContact O-CG 3.46Å; R565-L569 PolarHBondContact O-N 3.36Å; V566-L569 PolarHBondContact O-N 2.71Å; H567-L569 PolarHBondContact O-N 3.11Å
570	S	45.6	Very low	60	Low	75 Å²	75	113.2 Å²	113.2	52%	0.524	58%	0.584	S	S	.	*			trans	-141.7	72.3	178.1	-66.6	0	0	0	0	112.9	V566 H567	V566-S570 PolarHBondContact O-N 2.85Å; V566-S570 PolarHBondContact O-OG 3.21Å; H567-S570 PolarHBondContact O-N 3.15Å; H567-S570 VanDerWaalsContact O-N 3.17Å
571	P	45.4	Very low	57	Low	104 Å²	104	119.7 Å²	119.7	68%	0.675	62%	0.619	S	S	*	*	S	Bend	trans	-111.9	-26.2	143.2	-11.3	30.3	0	0	0	115.5
572	N	43.9	Very low	54.4	Low	144 Å²	144	118 Å²	118	77%	0.77	62%	0.624	S	S	*	*	S	Bend	trans	-120.1	-21.6	-162.4	-72.8	-25.9	0	0	0	117.1	A574	N572-A574 PolarHBondContact O-N 3.07Å
573	D	38.9	Very low	51.7	Low	145 Å²	145	119.6 Å²	119.6	78%	0.775	63%	0.634	S	S	*	*			trans	-82.8	59.4	-174.6	-64.8	-41.1	0	0	0	112.7	L575	D573-L575 PolarHBondContact O-N 3.24Å
574	A	32.7	Very low	48.8	Very low	88 Å²	88	124.4 Å²	124.4	73%	0.727	67%	0.669	S	S	*	*			trans	-91.8	36.3	-167	0	0	0	0	0	115.5	N572	N572-A574 PolarHBondContact O-N 3.07Å
575	L	36.8	Very low	46.1	Very low	160 Å²	160	129.2 Å²	129.2	84%	0.838	70%	0.695	S	S	*	*	S	Bend	trans	-145.9	73.3	173.6	-76	-177.8	0	0	0	113.5	D573	D573-L575 PolarHBondContact O-N 3.24Å
576	N	33.6	Very low	43.4	Very low	143 Å²	143	127.6 Å²	127.6	77%	0.765	71%	0.707	S	S	*	*			trans	163	92.8	138.1	-85.8	-24.9	0	0	0	111.7	T578	N576-T578 PolarHBondContact O-N 3.45Å
577	P	32.8	Very low	40.8	Very low	133 Å²	133	127.5 Å²	127.5	86%	0.864	71%	0.71	S	S	*	*			trans	-89.6	67.1	178.8	36.1	-34.6	0	0	0	112.8
578	T	34.3	Very low	38.1	Very low	100 Å²	100	130.7 Å²	130.7	61%	0.613	73%	0.728	S	S	*	*			trans	-136.1	162.2	168.8	51.9	0	0	0	0	111.6	N576 Y580	N576-T578 PolarHBondContact O-N 3.45Å; T578-Y580 PolarHBondContact O-N 3.21Å
579	D	34.5	Very low	36.2	Very low	151 Å²	151	127.5 Å²	127.5	81%	0.807	73%	0.727	S	S	*	*	S	Bend	trans	73.5	6	169.3	-52.7	-22.5	0	0	0	120	D581	D579-D581 VanDerWaalsContact C-N 3.31Å; D579-D581 PolarHBondContact O-N 3.13Å
580	Y	29.7	Very low	34.4	Very low	222 Å²	222	128.7 Å²	128.7	87%	0.871	74%	0.738	S	S	*	*			trans	-93	33	164.9	-90.4	-69	0	0	0	114.9	T578 T582	T578-Y580 PolarHBondContact O-N 3.21Å; Y580-T582 VanDerWaalsContact C-N 3.31Å; Y580-T582 PolarHBondContact O-N 3.42Å; Y580-T582 VanDerWaalsContact O-N 3.1Å
581	D	30.2	Very low	33.7	Very low	161 Å²	161	132 Å²	132	86%	0.861	75%	0.75	S	S	*	*			trans	-85.8	65.6	175.3	-127.1	-12.9	0	0	0	111.3	D579	D579-D581 VanDerWaalsContact C-N 3.31Å; D579-D581 PolarHBondContact O-N 3.13Å
582	T	34.8	Very low	32.8	Very low	102 Å²	102	132.7 Å²	132.7	63%	0.626	75%	0.748	S	S	*	*			trans	-125.2	91.4	173.6	33.5	0	0	0	0	112.4	Y580 S584	Y580-T582 VanDerWaalsContact C-N 3.31Å; Y580-T582 PolarHBondContact O-N 3.42Å; Y580-T582 VanDerWaalsContact O-N 3.1Å; T582-S584 PolarHBondContact O-N 3.35Å; T582-S584 VanDerWaalsContact O-N 3.09Å
583	H	31.1	Very low	32.1	Very low	177 Å²	177	132.5 Å²	132.5	82%	0.819	75%	0.747	S	S	*	*			trans	31.7	65.2	152.4	-64.8	-77.6	0	0	0	117.5
584	S	29.5	Very low	31.8	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	74%	0.744	S	S	*	*			trans	-107.1	40.5	161.6	46.8	0	0	0	0	112.1	T582	T582-S584 PolarHBondContact O-N 3.35Å; T582-S584 VanDerWaalsContact O-N 3.09Å
585	N	30.9	Very low	31.6	Very low	143 Å²	143	134.4 Å²	134.4	77%	0.765	75%	0.745	S	S	*	*			trans	-141.7	147.4	170	-89.9	-41.3	0	0	0	108.8
586	S	31.8	Very low	31.2	Very low	117 Å²	117	133.1 Å²	133.1	82%	0.818	74%	0.739	S	S	*	*	S	Bend	trans	61.8	128.4	-164.5	70.8	0	0	0	0	114.4
587	S	31.1	Very low	31.2	Very low	82 Å²	82	131.9 Å²	131.9	57%	0.573	73%	0.732	S	S	*	*			cis	-156.9	129.7	-10.6	49.9	0	0	0	0	111.5	T589	S587-T589 WeakPolarHBondContact CB-OG1 3.23Å; S587-T589 PolarHBondContact O-N 3.33Å; S587-T589 PolarHBondContact OG-OG1 2.96Å
588	D	30.6	Very low	31	Very low	103 Å²	103	132 Å²	132	55%	0.551	73%	0.726	S	S	*	*	S	Bend	trans	-76.6	55.9	162	-70.3	-58.1	0	0	0	110	K541	K541-D588 WeakPolarHBondContact CE-OD2 3.33Å; K541-D588 IonicContact NZ-OD2 3.52Å; K541-D588 PolarHBondContact NZ-OD2 3.26Å
589	T	35	Very low	30.7	Very low	104 Å²	104	134.3 Å²	134.3	64%	0.638	74%	0.735	S	S	*	*	S	Bend	trans	-143	141.5	172.1	52.6	0	0	0	0	109.8	S587	S587-T589 WeakPolarHBondContact CB-OG1 3.23Å; S587-T589 PolarHBondContact O-N 3.33Å; S587-T589 PolarHBondContact OG-OG1 2.96Å
590	T	30.1	Very low	30.4	Very low	131 Å²	131	136.5 Å²	136.5	80%	0.804	74%	0.74	S	S	*	*			trans	-46.2	136.8	173.1	47.6	0	0	0	0	114.8
591	N	29.3	Very low	30.3	Very low	145 Å²	145	134.7 Å²	134.7	78%	0.775	74%	0.744	S	S	*	*				-152.1	163.7	126.8	-147.5	-14.6	0	0	0	111.5
592	N	26.7	Very low	30.1	Very low	119 Å²	119	133.7 Å²	133.7	64%	0.636	74%	0.739	S	S	*	*			trans	-100.1	149.6	-171.4	-59.4	-41.5	0	0	0	112.1
593	N	29.6	Very low	29.8	Very low	139 Å²	139	134.1 Å²	134.1	74%	0.743	74%	0.741	S	S	*	*				171.8	158	101.3	-90.6	-42.4	0	0	0	113.6
594	N	33.2	Very low	29.6	Very low	132 Å²	132	133 Å²	133	71%	0.706	74%	0.741	S	S	*	*			trans	58.7	97.1	155.6	-59.3	-16.6	0	0	0	119.7
595	N	29	Very low	29.7	Very low	142 Å²	142	135 Å²	135	76%	0.759	74%	0.743	S	S	*	*				36.8	136.1	111.3	-59.8	-16.1	0	0	0	121.4
596	N	27.8	Very low	29.6	Very low	133 Å²	133	132 Å²	132	71%	0.711	73%	0.733	S	S	*	*			trans	93.2	140.2	136.7	-90.6	48.4	0	0	0	122.7
597	D	33.4	Very low	29.6	Very low	116 Å²	116	137.2 Å²	137.2	62%	0.62	74%	0.735	S	S	*	*			trans	68.7	93	147.1	-54.3	-32.2	0	0	0	122.2
598	N	29.2	Very low	29.6	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	74%	0.74	S	S	*	*				47.1	129.6	113.1	-59.9	-38.8	0	0	0	121.2
599	N	27.4	Very low	29.4	Very low	148 Å²	148	140.1 Å²	140.1	79%	0.791	76%	0.757	S	S	*	*			trans	53.1	82.3	144.3	-64.7	-4.8	0	0	0	118.9
600	Q	27.6	Very low	29.2	Very low	197 Å²	197	140.6 Å²	140.6	92%	0.921	76%	0.76	S	S	*	*				-161.4	113.8	123.4	-111.6	158.3	97.7	0	0	112
601	L	27.5	Very low	29.3	Very low	183 Å²	183	145.3 Å²	145.3	96%	0.958	76%	0.763	S	S	*	*			trans	-153.9	97.5	158.7	-111.9	173.8	0	0	0	107.7
602	N	26.3	Very low	29.4	Very low	141 Å²	141	144.9 Å²	144.9	75%	0.754	76%	0.76	S	S	*	*			trans	-137.1	162.5	169.4	-162.3	7.5	0	0	0	108.2
603	T	29.6	Very low	29.7	Very low	110 Å²	110	145.1 Å²	145.1	68%	0.675	76%	0.761	S	S	*	*			trans	51.8	88.9	176.1	56.8	0	0	0	0	116
604	N	26	Very low	29.7	Very low	153 Å²	153	145.3 Å²	145.3	82%	0.818	76%	0.762	S	S	*	*				25.8	130.9	120.1	-47.1	-20.7	0	0	0	117.9
605	D	30.9	Very low	29.6	Very low	159 Å²	159	148.6 Å²	148.6	85%	0.85	78%	0.776	S	S	*	*				-146.5	172.4	102.3	-136.5	-30.7	0	0	0	112.2
606	S	29.3	Very low	29.6	Very low	80 Å²	80	147.7 Å²	147.7	56%	0.559	77%	0.77	S	S	*	*			trans	-149.2	166.6	-165.6	66.7	0	0	0	0	114.3
607	R	32.6	Very low	29.7	Very low	227 Å²	227	150 Å²	150	86%	0.857	78%	0.78	S	S	*	*			trans	78.5	153.6	173.5	-47	164.9	-174.3	-172.1	-0.1	113.4
608	T	30.6	Very low	29.5	Very low	112 Å²	112	149.8 Å²	149.8	69%	0.687	78%	0.782	S	S	*	*			cis	-150.5	144.7	1.2	-16.7	0	0	0	0	111.8	T610	T608-T610 HydrophobicContact CG2-CG2 4.32Å
609	C	27.3	Very low	29.5	Very low	134 Å²	134	151.7 Å²	151.7	91%	0.905	79%	0.787	S	S	*	*				-154	152.8	129.9	-102.3	0	0	0	0	109.9
610	T	30.3	Very low	29.6	Very low	114 Å²	114	153 Å²	153	70%	0.699	79%	0.786	S	S	*	*			trans	-127.5	162	-168.7	48.2	0	0	0	0	111.7	T608	T608-T610 HydrophobicContact CG2-CG2 4.32Å
611	R	32.2	Very low	29.7	Very low	230 Å²	230	148.3 Å²	148.3	87%	0.868	77%	0.767	S	S	*	*			trans	133.7	138.9	153.2	-76.7	173.5	177.8	174.4	0.3	112.4
612	I	31.2	Very low	29.6	Very low	137 Å²	137	144.3 Å²	144.3	70%	0.703	75%	0.75	S	S	*	*			cis	-163.2	166.1	-19.1	-139.7	172.7	0	0	0	110.2
613	N	31.7	Very low	29.6	Very low	123 Å²	123	145.8 Å²	145.8	66%	0.658	75%	0.745	S	S	*	*			trans	73.4	100	166.8	-68.8	-10.6	0	0	0	122.1
614	N	30.7	Very low	29.5	Very low	144 Å²	144	147.6 Å²	147.6	77%	0.77	75%	0.746	S	S	*	*				55.8	115.9	119.5	-53.5	-12.3	0	0	0	121.7
615	M	31.4	Very low	29.6	Very low	201 Å²	201	144.4 Å²	144.4	99%	0.99	74%	0.735	S	S	*	*				-156.2	171.4	87.2	-92.7	-167	-172.7	0	0	110.5
616	N	28.1	Very low	29.5	Very low	122 Å²	122	145.9 Å²	145.9	65%	0.652	74%	0.737	S	S	*	*			trans	-124	136	-155.1	-176.5	49	0	0	0	114.7
617	M	29.6	Very low	29.5	Very low	183 Å²	183	146.8 Å²	146.8	90%	0.901	74%	0.735	S	S	*	*			trans	-151.1	109	158.9	-88	-60.6	-78	0	0	109.6
618	T	30.6	Very low	29.5	Very low	110 Å²	110	141.2 Å²	141.2	68%	0.675	73%	0.731	S	S	*	*			trans	-145.8	101.3	173.2	52.5	0	0	0	0	111
619	E	29	Very low	29.7	Very low	178 Å²	178	139.4 Å²	139.4	83%	0.832	72%	0.72	S	S	*	*			trans	-166.9	157	146.5	-113	170.9	160.3	0	0	109.1
620	F	28.3	Very low	29.6	Very low	174 Å²	174	140.6 Å²	140.6	76%	0.763	72%	0.717	S	S	*	*	S	Bend	trans	61.6	120.7	-173.8	-64.6	-85.4	0	0	0	117.9
621	L	30.1	Very low	29.7	Very low	100 Å²	100	137.1 Å²	137.1	52%	0.524	70%	0.696	S	S	.	*			cis	-157.5	170.4	-48.1	-111.1	151.3	0	0	0	109.3	N400	N400-L621 WeakPolarHBondContact ND2-CD1 3.35Å; N400-L621 WeakPolarHBondContact OD1-CD1 3.5Å
622	T	25.5	Very low	29.5	Very low	99 Å²	99	129 Å²	129	61%	0.607	67%	0.672	S	S	*	*			trans	-73.9	143.6	-178.7	55.9	0	0	0	0	111.8
623	R	26.3	Very low	29.3	Very low	171 Å²	171	126.6 Å²	126.6	65%	0.645	66%	0.66	S	S	*	*				-167.5	162.7	72.7	-123.4	175.9	160.6	125.1	-3.4	114.1
624	E	26.7	Very low	29.1	Very low	149 Å²	149	125.4 Å²	125.4	70%	0.696	65%	0.647	S	S	*	*			trans	57.5	99.8	152.6	-70.6	170.2	-137.2	0	0	121.8
625	S	30	Very low	29.1	Very low	85 Å²	85	126.1 Å²	126.1	59%	0.594	64%	0.644	S	S	*	*				175.9	77.1	108.5	42.2	0	0	0	0	114.2	N627	S625-N627 PolarHBondContact O-N 2.86Å; S625-N627 VanDerWaalsContact O-N 3.07Å
626	H	27.8	Very low	28.9	Very low	190 Å²	190	126.1 Å²	126.1	88%	0.88	63%	0.634	S	S	*	*			trans	-69	102	162.7	-79.7	-86.4	0	0	0	110.2
627	N	29.5	Very low	29	Very low	100 Å²	100	125.4 Å²	125.4	54%	0.535	64%	0.636	S	S	.	*			trans	162.2	104.1	141.4	-98.8	-80.9	0	0	0	112.5	K492 S625	K492-N627 HydrophobicContact CD-CB 3.64Å; K492-N627 WeakPolarHBondContact CE-OD1 3.4Å; K492-N627 HydrophobicContact CG-CB 3.73Å; K492-N627 PolarHBondContact NZ-OD1 2.79Å; S625-N627 PolarHBondContact O-N 2.86Å; S625-N627 VanDerWaalsContact O-N 3.07Å
628	S	32.7	Very low	28.9	Very low	110 Å²	110	125 Å²	125	77%	0.769	63%	0.634	S	S	*	*			trans	-120.9	116.5	159.9	64.2	0	0	0	0	110.4
629	V	34.7	Very low	28.7	Very low	74 Å²	74	128.7 Å²	128.7	45%	0.448	65%	0.646	S	S	.	*			trans	-81.7	136.6	174.9	176.8	0	0	0	0	109.5	T631	V629-T631 PolarHBondContact O-N 3.45Å
630	N	25.5	Very low	28.6	Very low	158 Å²	158	124.8 Å²	124.8	85%	0.845	63%	0.631	S	S	*	*			trans	-56.5	102.3	179.6	-78.9	-57.7	0	0	0	112.2
631	T	31.5	Very low	28.5	Very low	42 Å²	42	127 Å²	127	26%	0.258	63%	0.634	S	S	.	*			trans	-137.2	133.7	154.4	61.2	0	0	0	0	108.1	I502 N526 D529 V629 N633	I502-T631 HydrophobicContact CG2-CG2 3.83Å; N526-T631 WeakPolarHBondContact ND2-CG2 3.43Å; D529-T631 WeakPolarHBondContact OD2-CA 3.32Å; D529-T631 WeakPolarHBondContact OD2-CB 3.18Å; D529-T631 WeakPolarHBondContact OD2-CG2 3.46Å; V629-T631 PolarHBondContact O-N 3.45Å; T631-N633 PolarHBondContact O-N 2.87Å; T631-N633 PolarHBondContact O-ND2 3.44Å
632	T	28.1	Very low	28.4	Very low	59 Å²	59	125.8 Å²	125.8	36%	0.362	63%	0.628	S	S	.	*			trans	-86.5	88.2	-140.2	48.3	0	0	0	0	116.6	D529 K532	D529-T632 WeakPolarHBondContact OD1-CB 3.39Å; D529-T632 VanDerWaalsContact OD1-CG2 3.23Å; D529-T632 WeakPolarHBondContact OD1-CG2 3.24Å; D529-T632 PolarHBondContact OD1-N 2.93Å; D529-T632 PolarHBondContact OD1-OG1 3.16Å; K532-T632 HydrophobicContact CD-CG2 4.23Å; K532-T632 WeakPolarHBondContact CD-OG1 3.11Å; K532-T632 WeakPolarHBondContact CE-OG1 3.11Å; K532-T632 PolarHBondContact NZ-O 2.92Å; K532-T632 PolarHBondContact NZ-OG1 3.19Å
633	N	28.2	Very low	28.5	Very low	87 Å²	87	128.2 Å²	128.2	47%	0.465	64%	0.638	S	S	.	*			trans	-103.3	128.7	168.8	-65	-95.7	0	0	0	111.5	R496 T631 F635	R496-N633 PolarHBondContact NH2-OD1 3.44Å; T631-N633 PolarHBondContact O-N 2.87Å; T631-N633 PolarHBondContact O-ND2 3.44Å; N633-F635 PolarHBondContact O-N 2.95Å
634	Y	26.6	Very low	28.5	Very low	97 Å²	97	126.6 Å²	126.6	38%	0.38	65%	0.646	S	S	.	*			trans	-94	73	178.6	-84.1	-82.8	0	0	0	112	P557 S558	P557-Y634 HydrophobicContact CB-CE1 4.19Å; P557-Y634 VanDerWaalsContact CD-OH 3.23Å; P557-Y634 WeakPolarHBondContact CD-OH 3.42Å; P557-Y634 HydrophobicContact CG-CE1 4.24Å; P557-Y634 HydrophobicContact CG-CE2 4.35Å; P557-Y634 WeakPolarHBondContact CG-OH 3.36Å; S558-Y634 PolarHBondContact N-OH 3.49Å; S558-Y634 PolarHBondContact OG-OH 3.41Å
635	F	30.8	Very low	28.6	Very low	160 Å²	160	127 Å²	127	70%	0.702	65%	0.654	S	S	*	*			trans	-139.5	107.4	171.9	-80.8	-78.9	0	0	0	112	N633	N633-F635 PolarHBondContact O-N 2.95Å
636	Y	27.7	Very low	28.4	Very low	201 Å²	201	128.5 Å²	128.5	79%	0.788	66%	0.662	S	S	*	*			trans	-153.3	134	157.7	-92.7	-77.6	0	0	0	106.4
637	P	30.2	Very low	28.5	Very low	107 Å²	107	127.1 Å²	127.1	70%	0.695	66%	0.661	S	S	*	*			trans	-57.3	153.8	168.6	-22.4	34.1	0	0	0	111
638	M	26.1	Very low	28.5	Very low	173 Å²	173	134 Å²	134	85%	0.852	68%	0.679	S	S	*	*			trans	-74.1	131.8	168.7	-70.5	-178.5	60	0	0	108.9	N640	M638-N640 PolarHBondContact O-N 3.16Å
639	M	27.6	Very low	28.3	Very low	188 Å²	188	135.4 Å²	135.4	93%	0.926	68%	0.678	S	S	*	*			trans	-64.8	103.1	163.3	-73.4	172.3	163.1	0	0	107.8	R641	M639-R641 PolarHBondContact O-N 3.05Å
640	N	26.5	Very low	28	Very low	97 Å²	97	137.3 Å²	137.3	52%	0.519	69%	0.69	S	S	.	*			trans	-73.4	116.1	165.2	-144.6	55.3	0	0	0	106.2	M638 D642 Q954	M638-N640 PolarHBondContact O-N 3.16Å; N640-D642 PolarHBondContact O-N 3.22Å; N640-Q954 PolarHBondContact ND2-OE1 2.83Å; N640-Q954 VanDerWaalsContact ND2-OE1 3.08Å
641	R	27	Very low	28.1	Very low	219 Å²	219	136 Å²	136	83%	0.826	68%	0.683	S	S	*	*			trans	-94.6	31.2	-165.8	-153.6	-171	-175.6	-168.1	0.3	112.3	M639	M639-R641 PolarHBondContact O-N 3.05Å
642	D	27.7	Very low	27.9	Very low	75 Å²	75	144.7 Å²	144.7	40%	0.401	71%	0.713	S	S	.	*			trans	-123.9	82.1	-168.8	-57.1	-70.4	0	0	0	109.8	N640	N640-D642 PolarHBondContact O-N 3.22Å
643	N	27.6	Very low	28.2	Very low	150 Å²	150	148.5 Å²	148.5	80%	0.802	74%	0.736	S	S	*	*			trans	-170.3	75.3	156.8	-104.3	-8.1	0	0	0	109.2
644	V	26.9	Very low	28.3	Very low	137 Å²	137	147.2 Å²	147.2	83%	0.83	74%	0.744	S	S	*	*			trans	-128.3	64.3	164.8	-172.3	0	0	0	0	107.8
645	D	28.9	Very low	28.4	Very low	159 Å²	159	149.6 Å²	149.6	85%	0.85	76%	0.763	S	S	*	*			trans	-125.1	97.6	166.1	-86.5	-53.3	0	0	0	108.2
646	C	24.5	Very low	28.3	Very low	115 Å²	115	148.7 Å²	148.7	78%	0.777	77%	0.765	S	S	*	*			trans	-80.2	155.1	162	-68.3	0	0	0	0	109.2
647	L	29.6	Very low	28.4	Very low	162 Å²	162	144.9 Å²	144.9	85%	0.848	76%	0.764	S	S	*	*			trans	79	79.3	174.7	-47.8	173	0	0	0	116.5
648	R	30	Very low	28.4	Very low	243 Å²	243	145.6 Å²	145.6	92%	0.917	77%	0.766	S	S	*	*				-156.1	139.2	106.2	-103.3	159.1	-172.8	-168.7	-0.7	111.7
649	N	28.5	Very low	28.6	Very low	140 Å²	140	143.3 Å²	143.3	75%	0.749	76%	0.762	S	S	*	*			trans	-95	177.3	-177	-80.7	-5.6	0	0	0	111.4
650	T	29.1	Very low	28.7	Very low	115 Å²	115	140 Å²	140	71%	0.706	75%	0.752	S	S	*	*			trans	63.3	125.8	145.7	49.1	0	0	0	0	116.9
651	D	27.6	Very low	28.9	Very low	130 Å²	130	140.6 Å²	140.6	70%	0.695	76%	0.76	S	S	*	*			cis	-153.9	166.3	4.7	-85	-44.4	0	0	0	110.8
652	Y	28.1	Very low	29.1	Very low	225 Å²	225	136 Å²	136	88%	0.882	76%	0.756	S	S	*	*				-178.6	64.8	125.9	-107.7	-71.4	0	0	0	113.1	G654	Y652-G654 PolarHBondContact O-N 3.5Å
653	T	33.5	Very low	29.4	Very low	138 Å²	138	141 Å²	141	85%	0.847	78%	0.777	S	S	*	*			trans	-86.7	82.4	158.1	47.1	0	0	0	0	109.4	N655	T653-N655 PolarHBondContact O-N 3.1Å
654	G	29.5	Very low	29.5	Very low	61 Å²	61	139.8 Å²	139.8	63%	0.629	77%	0.771	S	S	*	*			trans	-73.9	89.7	178.4	0	0	0	0	0	112.6	Y652	Y652-G654 PolarHBondContact O-N 3.5Å
655	N	29.5	Very low	29.8	Very low	146 Å²	146	139.5 Å²	139.5	78%	0.781	76%	0.764	S	S	*	*			trans	-158.6	114.8	149.2	-105.3	-27	0	0	0	112.5	T653	T653-N655 PolarHBondContact O-N 3.1Å
656	N	28.3	Very low	30	Very low	141 Å²	141	139 Å²	139	75%	0.754	76%	0.762	S	S	*	*	S	Bend	trans	74.8	128	161.6	-58.9	-23.3	0	0	0	121
657	T	30.7	Very low	30.3	Very low	122 Å²	122	140.3 Å²	140.3	75%	0.748	76%	0.761	S	S	*	*			trans	66.5	90.8	152.5	50.4	0	0	0	0	120.4
658	T	29.4	Very low	30.5	Very low	121 Å²	121	139.2 Å²	139.2	74%	0.742	76%	0.756	S	S	*	*				37.3	136.2	113.1	56.8	0	0	0	0	119.5
659	T	30.9	Very low	30.6	Very low	126 Å²	126	134.8 Å²	134.8	77%	0.773	75%	0.75	S	S	*	*			cis	-157.1	163.2	29.8	-19.4	0	0	0	0	114.2
660	T	28.6	Very low	30.6	Very low	117 Å²	117	133 Å²	133	72%	0.718	75%	0.748	S	S	*	*			trans	-53.8	165.1	171.9	50.9	0	0	0	0	114.8
661	T	31.7	Very low	30.8	Very low	111 Å²	111	135.5 Å²	135.5	68%	0.681	76%	0.755	S	S	*	*				-167.1	156.3	56.8	40.7	0	0	0	0	115.6
662	T	31.3	Very low	31.3	Very low	123 Å²	123	132.8 Å²	132.8	76%	0.755	75%	0.746	S	S	*	*			trans	62.3	143.3	151.1	46.3	0	0	0	0	118.7
663	Q	33	Very low	31.7	Very low	180 Å²	180	126.2 Å²	126.2	84%	0.841	73%	0.73	S	S	*	*			cis	-155.6	171.3	4.4	-102.7	163.6	20	0	0	105.9
664	N	31.2	Very low	31.9	Very low	124 Å²	124	127.5 Å²	127.5	66%	0.663	73%	0.731	S	S	*	*			cis	-176	140.2	-27.6	-179.9	26.6	0	0	0	107.8
665	N	31.9	Very low	32.3	Very low	130 Å²	130	131.5 Å²	131.5	70%	0.695	74%	0.738	S	S	*	*			trans	68.8	147.2	161	-79.6	-18.4	0	0	0	124.2
666	N	32.7	Very low	32.8	Very low	150 Å²	150	133.2 Å²	133.2	80%	0.802	74%	0.738	S	S	*	*			trans	87.4	97.1	153.6	-63.5	-9.8	0	0	0	121.4
667	N	31.1	Very low	32.9	Very low	141 Å²	141	135.6 Å²	135.6	75%	0.754	75%	0.747	S	S	*	*			trans	-68.3	-178	153.6	-76.2	-44.4	0	0	0	112.5
668	N	34.2	Very low	32.9	Very low	140 Å²	140	140.5 Å²	140.5	75%	0.749	75%	0.752	S	S	*	*			trans	78.1	81.8	161.5	-54.3	-19.9	0	0	0	118
669	N	32.4	Very low	33	Very low	149 Å²	149	144.1 Å²	144.1	80%	0.797	76%	0.757	S	S	*	*				175	116.8	123.7	-100	-57.2	0	0	0	113.5
670	C	28.4	Very low	33.2	Very low	102 Å²	102	146.2 Å²	146.2	69%	0.689	76%	0.756	S	S	*	*			trans	-163.9	34	154.7	-110.3	0	0	0	0	116.3	S672 T673	C670-S672 PolarHBondContact O-N 3.05Å; C670-T673 PolarHBondContact SG-OG1 3.25Å
671	I	32.8	Very low	33.4	Very low	168 Å²	168	147.4 Å²	147.4	86%	0.862	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-7.5	166	-74.4	176.6	0	0	0	111.7
672	S	37.3	Very low	33.5	Very low	73 Å²	73	148.7 Å²	148.7	51%	0.51	76%	0.761	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.6	-12.6	-171.7	50.5	0	0	0	0	116.3	C670	C670-S672 PolarHBondContact O-N 3.05Å
673	T	38.2	Very low	33.5	Very low	87 Å²	87	150 Å²	150	53%	0.534	76%	0.764	S	S	.	*	S	Bend	trans	-85.2	-34.5	-166.1	-49.5	0	0	0	0	113.9	C670 N675 K676	C670-T673 PolarHBondContact SG-OG1 3.25Å; T673-N675 PolarHBondContact O-N 3.39Å; T673-K676 PolarHBondContact O-N 3.07Å
674	L	37.9	Very low	33.4	Very low	165 Å²	165	146.9 Å²	146.9	86%	0.864	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-15.9	-173.5	-116.2	163.9	0	0	0	114.3
675	N	36.5	Very low	33.4	Very low	146 Å²	146	146.6 Å²	146.6	78%	0.781	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	1.5	179.5	-79.6	-36.4	0	0	0	114.9	T673	T673-N675 PolarHBondContact O-N 3.39Å
676	K	39.5	Very low	33.4	Very low	181 Å²	181	147.5 Å²	147.5	79%	0.787	77%	0.77	S	S	*	*	S	Bend	trans	-102.6	-5.4	-174.7	-79.3	-175.4	173.8	179.1	0	116.7	T673 R678	T673-K676 PolarHBondContact O-N 3.07Å; K676-R678 PolarHBondContact O-N 3.22Å; K676-R678 VanDerWaalsContact O-N 3.17Å
677	M	31.2	Very low	33.3	Very low	192 Å²	192	148.5 Å²	148.5	95%	0.946	77%	0.77	S	S	*	*	S	Bend	trans	-82.7	23.7	176.7	-69.6	-76.7	-88.1	0	0	113.7
678	R	31.6	Very low	33.3	Very low	224 Å²	224	147.2 Å²	147.2	85%	0.845	77%	0.767	S	S	*	*	S	Bend	trans	-131.5	113.2	-174.8	-148.8	172.3	-171.5	174.1	2.2	110.4	K676	K676-R678 PolarHBondContact O-N 3.22Å; K676-R678 VanDerWaalsContact O-N 3.17Å
679	K	31.4	Very low	33.2	Very low	198 Å²	198	144.9 Å²	144.9	86%	0.861	76%	0.762	S	S	*	*			trans	75.9	110.3	-176	-49.3	175.1	-179.1	179	0	116.3
680	K	33.7	Very low	33.2	Very low	169 Å²	169	144.5 Å²	144.5	74%	0.735	76%	0.76	S	S	*	*				157.8	101.5	116.6	-87.9	-171.1	174.7	-174.7	0	114.5
681	T	32.9	Very low	33.3	Very low	143 Å²	143	148.5 Å²	148.5	88%	0.877	77%	0.766	S	S	*	*			trans	-174	84.3	149.6	26.6	0	0	0	0	104.4
682	Q	33.2	Very low	33.3	Very low	137 Å²	137	145 Å²	145	64%	0.64	76%	0.756	S	S	*	*			cis	64.7	113.2	39.4	-115.6	-178	-16.1	0	0	113.3
683	N	31.9	Very low	32.7	Very low	150 Å²	150	149 Å²	149	80%	0.802	77%	0.771	S	S	*	*			trans	74.4	133.6	177.7	-47	-13	0	0	0	114.1
684	S	30.9	Very low	32.2	Very low	115 Å²	115	155.9 Å²	155.9	80%	0.804	79%	0.787	S	S	*	*			cis	-138.8	161.4	15.7	-59.4	0	0	0	0	113.2
685	P	32	Very low	31.9	Very low	118 Å²	118	157.7 Å²	157.7	77%	0.766	79%	0.788	S	S	*	*			trans	-108	164	-172.8	40.6	-34.7	0	0	0	115.7
686	I	31.3	Very low	31.6	Very low	150 Å²	150	155.4 Å²	155.4	77%	0.769	79%	0.789	S	S	*	*			trans	178.9	111.3	151.7	-97.2	151.8	0	0	0	105.6
687	Q	31.7	Very low	31	Very low	171 Å²	171	152.5 Å²	152.5	80%	0.799	79%	0.792	S	S	*	*				65.6	130	90.2	-79.8	-174.9	-4.4	0	0	113.6
688	T	30.7	Very low	30.9	Very low	113 Å²	113	154.4 Å²	154.4	69%	0.693	79%	0.788	S	S	*	*			cis	-146.6	168.7	3.4	53.8	0	0	0	0	112.4
689	S	32.1	Very low	30.8	Very low	91 Å²	91	152.5 Å²	152.5	64%	0.636	79%	0.786	S	S	*	*			trans	50.2	140.9	142.5	61.9	0	0	0	0	121.9
690	D	31	Very low	30.5	Very low	141 Å²	141	153 Å²	153	75%	0.754	78%	0.783	S	S	*	*			cis	-171.9	-172.5	-10.9	-113.1	-57.7	0	0	0	109.7
691	F	31.4	Very low	30.1	Very low	187 Å²	187	151.6 Å²	151.6	82%	0.82	78%	0.779	S	S	*	*			trans	71.7	73.6	163.8	-78	-78.9	0	0	0	120.4
692	S	31.8	Very low	29.9	Very low	93 Å²	93	156.6 Å²	156.6	65%	0.65	78%	0.783	S	S	*	*				48	108.9	109.3	-57.5	0	0	0	0	122.3
693	L	26.1	Very low	29.7	Very low	159 Å²	159	153.3 Å²	153.3	83%	0.832	78%	0.775	S	S	*	*				74.3	140.1	123.4	-69	167.6	0	0	0	122.5
694	R	26.4	Very low	29.4	Very low	230 Å²	230	152.5 Å²	152.5	87%	0.868	78%	0.776	S	S	*	*			trans	66.6	92.1	158.2	-64.3	176.9	-175.5	-165.2	3.4	119.4
695	K	32.3	Very low	29.2	Very low	204 Å²	204	157.7 Å²	157.7	89%	0.887	78%	0.778	S	S	*	*			trans	-157	116.1	132.8	-101.2	148.6	-174.3	172.6	0	107.7
696	A	31.1	Very low	28.8	Very low	97 Å²	97	157.5 Å²	157.5	80%	0.802	77%	0.771	S	S	*	*				77.9	113	51.7	0	0	0	0	0	112.9
697	S	26.5	Very low	28.6	Very low	120 Å²	120	156.5 Å²	156.5	84%	0.839	76%	0.763	S	S	*	*			trans	-73.7	134.4	-171.7	-34.1	0	0	0	0	114
698	R	28.6	Very low	28.4	Very low	232 Å²	232	157 Å²	157	88%	0.875	76%	0.759	S	S	*	*			trans	-157.7	119.7	140.6	-93.8	138.4	-165.4	-145.1	4.8	106
699	K	29.1	Very low	28.3	Very low	185 Å²	185	158.5 Å²	158.5	80%	0.804	76%	0.762	S	S	*	*				71.6	110.8	63	-158.3	176	-164.2	175.4	0	110.9
700	R	26	Very low	28.1	Very low	208 Å²	208	158 Å²	158	79%	0.785	76%	0.759	S	S	*	*			trans	69	133.1	-172	-36.6	172.8	-142.1	178	3	111.5
701	H	25.9	Very low	28.1	Very low	139 Å²	139	155.3 Å²	155.3	64%	0.644	74%	0.741	S	S	*	*			cis	-159.9	132.4	44	-90.6	-91.7	0	0	0	111.5	S703	H701-S703 PolarHBondContact ND1-OG 3.5Å; H701-S703 PolarHBondContact O-N 3.13Å
702	Y	27.7	Very low	27.9	Very low	249 Å²	249	150.4 Å²	150.4	98%	0.976	73%	0.73	S	S	*	*			trans	-80.7	82.3	144.6	-108.8	-71.9	0	0	0	106.7
703	S	28.7	Very low	27.8	Very low	68 Å²	68	153.4 Å²	153.4	48%	0.476	73%	0.732	S	S	.	*			trans	-157.3	110.5	177	-49.2	0	0	0	0	109.2	H701	H701-S703 PolarHBondContact ND1-OG 3.5Å; H701-S703 PolarHBondContact O-N 3.13Å
704	T	26.3	Very low	27.9	Very low	133 Å²	133	150.6 Å²	150.6	82%	0.816	72%	0.722	S	S	*	*				161.6	164.1	120.9	40.8	0	0	0	0	109.7
705	R	25.5	Very low	28.1	Very low	224 Å²	224	147 Å²	147	85%	0.845	71%	0.714	S	S	*	*			trans	75.8	122.9	170.4	-57.7	-155.1	136.5	111.4	-0.5	117
706	N	25.1	Very low	27.8	Very low	114 Å²	114	142.6 Å²	142.6	61%	0.61	71%	0.705	S	S	*	*	S	Bend	cis	-133.2	167	-21.3	-65.3	-30.6	0	0	0	106
707	E	26.4	Very low	27.7	Very low	129 Å²	129	143.8 Å²	143.8	60%	0.603	70%	0.697	S	S	*	*	S	Bend	cis	-158.8	157.3	17.5	-131.3	136	-111.2	0	0	105.1
708	Y	28.6	Very low	27.8	Very low	182 Å²	182	143.2 Å²	143.2	71%	0.714	69%	0.689	S	S	*	*			cis	-134.4	168.2	16.7	-83.6	-97.7	0	0	0	111.5
709	D	28.5	Very low	27.8	Very low	143 Å²	143	138.7 Å²	138.7	77%	0.765	68%	0.682	S	S	*	*			trans	37.4	140.3	135.2	-55.6	-2.8	0	0	0	123
710	S	27.1	Very low	27.7	Very low	81 Å²	81	135.1 Å²	135.1	57%	0.566	68%	0.676	S	S	*	*			cis	-162.1	177.4	-16.1	64.6	0	0	0	0	111.6
711	E	29.9	Very low	27.8	Very low	84 Å²	84	130.4 Å²	130.4	39%	0.393	67%	0.671	S	S	.	*			trans	50.9	104.9	160.1	-74.7	124.3	-119	0	0	119.3	S1085 I1086	E711-S1085 PolarHBondContact OE2-N 2.79Å; E711-I1086 VanDerWaalsContact OE1-CG1 3.23Å; E711-I1086 WeakPolarHBondContact OE1-CG1 3.15Å; E711-I1086 WeakPolarHBondContact OE2-CG1 3.2Å; E711-I1086 PolarHBondContact OE2-N 3.36Å; E711-I1086 VanDerWaalsContact OE2-N 3.09Å
712	S	27.7	Very low	27.9	Very low	84 Å²	84	129.1 Å²	129.1	59%	0.587	67%	0.673	S	S	*	*				77	162.8	76.5	76	0	0	0	0	112.9
713	F	29.8	Very low	28	Very low	156 Å²	156	123.9 Å²	123.9	68%	0.684	66%	0.661	S	S	*	*			cis	-131.4	-166.5	16.7	-97.9	-69.6	0	0	0	114
714	T	28.6	Very low	27.9	Very low	101 Å²	101	127 Å²	127	62%	0.62	67%	0.671	S	S	*	*			trans	-93.3	179.8	-177.7	45.9	0	0	0	0	111.5
715	H	29.6	Very low	27.9	Very low	154 Å²	154	126.1 Å²	126.1	71%	0.713	67%	0.666	S	S	*	*			cis	-160.7	143.6	39.8	-107.5	-54.1	0	0	0	110.2
716	V	27.8	Very low	27.9	Very low	112 Å²	112	122.1 Å²	122.1	68%	0.679	66%	0.661	S	S	*	*				67.6	134.9	91.3	143.6	0	0	0	0	113.6
717	N	27.8	Very low	28.1	Very low	122 Å²	122	122.1 Å²	122.1	65%	0.652	67%	0.67	S	S	*	*			cis	-166.6	167.8	3.1	-128.1	-6	0	0	0	112.2
718	T	28.6	Very low	28.3	Very low	108 Å²	108	120.7 Å²	120.7	66%	0.663	68%	0.675	S	S	*	*			trans	57.2	153	147	56	0	0	0	0	120.2
719	N	28.7	Very low	28.3	Very low	137 Å²	137	119.4 Å²	119.4	73%	0.733	68%	0.679	S	S	*	*			cis	-151	179.6	-1	-124.1	-7.8	0	0	0	113.2
720	T	27.2	Very low	28.1	Very low	109 Å²	109	118.4 Å²	118.4	67%	0.669	67%	0.673	S	S	*	*			trans	-51.5	173.9	164.2	56.8	0	0	0	0	113.9
721	T	29.2	Very low	28.2	Very low	110 Å²	110	123.3 Å²	123.3	68%	0.675	69%	0.691	S	S	*	*			cis	-164.6	127	32.9	-18.4	0	0	0	0	113.3
722	T	27.3	Very low	28.1	Very low	112 Å²	112	128.7 Å²	128.7	69%	0.687	71%	0.708	S	S	*	*			trans	46.4	150.6	132.5	60	0	0	0	0	125.5
723	N	28.3	Very low	28.1	Very low	139 Å²	139	130 Å²	130	74%	0.743	72%	0.717	S	S	*	*			trans	86.4	148.1	146.2	-67.7	-8.8	0	0	0	120.3
724	I	26.8	Very low	28.1	Very low	132 Å²	132	127.1 Å²	127.1	68%	0.677	71%	0.714	S	S	*	*			cis	-169.8	162.7	-35.9	-125.4	173.9	0	0	0	109
725	T	27.9	Very low	28.3	Very low	115 Å²	115	125.5 Å²	125.5	71%	0.706	71%	0.707	S	S	*	*			trans	62.4	161.2	167.1	47.5	0	0	0	0	119.6
726	N	24.6	Very low	28.6	Very low	140 Å²	140	123.7 Å²	123.7	75%	0.749	71%	0.712	S	S	*	*			cis	-169.1	108.3	-40.9	-104.1	1.3	0	0	0	109.7
727	S	29.9	Very low	29.3	Very low	115 Å²	115	126.2 Å²	126.2	80%	0.804	71%	0.713	S	S	*	*			trans	-179	110.4	157.5	45.4	0	0	0	0	107.9
728	S	29.5	Very low	29.6	Very low	99 Å²	99	124.2 Å²	124.2	69%	0.692	70%	0.702	S	S	*	*			cis	70.3	98.2	38.2	-44.1	0	0	0	0	113.6
729	I	28.4	Very low	29.7	Very low	155 Å²	155	126.4 Å²	126.4	80%	0.795	70%	0.703	S	S	*	*				176.5	131.9	112.9	-90	158.9	0	0	0	112.4
730	N	25.9	Very low	30	Very low	122 Å²	122	126.8 Å²	126.8	65%	0.652	70%	0.702	S	S	*	*			trans	25.8	119.5	157.4	-58.8	-30.3	0	0	0	122
731	I	29	Very low	30.5	Very low	183 Å²	183	125.8 Å²	125.8	94%	0.938	70%	0.7	S	S	*	*				-121.2	146.3	103.4	-62.5	-174.6	0	0	0	107.3
732	R	28	Very low	30.8	Very low	197 Å²	197	127.9 Å²	127.9	74%	0.743	70%	0.702	S	S	*	*			trans	-127.6	117.9	-154.4	-175.8	-176.3	-174	-171.7	3.5	112.4
733	S	27.8	Very low	31.2	Very low	111 Å²	111	128.8 Å²	128.8	78%	0.776	70%	0.702	S	S	*	*			trans	-114.7	119.2	166.2	45.6	0	0	0	0	109.6	S735	S733-S735 PolarHBondContact O-N 3.07Å
734	P	28.7	Very low	31.4	Very low	96 Å²	96	126.1 Å²	126.1	62%	0.623	70%	0.699	S	S	*	*			trans	-67.3	130.7	-177.7	-20.9	33.1	0	0	0	112
735	S	33.7	Very low	31.6	Very low	67 Å²	67	123.3 Å²	123.3	47%	0.469	70%	0.695	S	S	.	*			trans	-72.6	159.4	165.9	77.9	0	0	0	0	109.9	S733 K737 D738	S733-S735 PolarHBondContact O-N 3.07Å; S735-K737 PolarHBondContact O-N 2.99Å; S735-D738 PolarHBondContact O-N 3.09Å
736	S	35.6	Very low	31.6	Very low	117 Å²	117	124.5 Å²	124.5	82%	0.818	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	10.2	178.8	52.6	0	0	0	0	115.3
737	K	41.6	Very low	32	Very low	165 Å²	165	123.8 Å²	123.8	72%	0.717	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-28.5	175.7	-64.8	-176.8	176.1	-177.6	0	113.7	S735 S741	S735-K737 PolarHBondContact O-N 2.99Å; K737-S741 PolarHBondContact O-OG 3.24Å
738	D	35.1	Very low	32	Very low	79 Å²	79	123.5 Å²	123.5	42%	0.422	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.4	-35.2	-175.7	-62.3	-50.3	0	0	0	112.6	S735 M740 S741	S735-D738 PolarHBondContact O-N 3.09Å; D738-M740 VanDerWaalsContact C-N 3.32Å; D738-M740 PolarHBondContact O-N 3.46Å; D738-S741 PolarHBondContact O-N 3.04Å
739	F	30.1	Very low	32.1	Very low	155 Å²	155	121.7 Å²	121.7	68%	0.68	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-23	-173.4	-155.7	-96.3	0	0	0	113.9	L743	F739-L743 HydrophobicContact CD1-CD1 4.42Å; F739-L743 HydrophobicContact CE1-CD1 4.14Å
740	M	34.5	Very low	32.4	Very low	144 Å²	144	118.1 Å²	118.1	71%	0.709	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-14.7	174.5	-80.7	-77.5	161.1	0	0	113.2	D738	D738-M740 VanDerWaalsContact C-N 3.32Å; D738-M740 PolarHBondContact O-N 3.46Å
741	S	39.6	Very low	32.6	Very low	88 Å²	88	116.3 Å²	116.3	62%	0.615	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-15.3	-179.9	-65.2	0	0	0	0	113.9	K737 D738	K737-S741 PolarHBondContact O-OG 3.24Å; D738-S741 PolarHBondContact O-N 3.04Å
742	Q	34.9	Very low	32.9	Very low	154 Å²	154	113.3 Å²	113.3	72%	0.72	66%	0.659	S	S	*	*	S	Bend	trans	-102.8	-3.9	178.3	-62.4	-177.1	10.2	0	0	113.6
743	L	34.5	Very low	33.4	Very low	132 Å²	132	109.8 Å²	109.8	69%	0.691	65%	0.649	S	S	*	*	S	Bend	trans	-101.7	11.4	166	-74.8	166.9	0	0	0	112.4	F739	F739-L743 HydrophobicContact CD1-CD1 4.42Å; F739-L743 HydrophobicContact CE1-CD1 4.14Å
744	A	33.7	Very low	34	Very low	83 Å²	83	109.8 Å²	109.8	69%	0.686	64%	0.637	S	S	*	*	S	Bend	trans	-109.5	13.6	-179.1	0	0	0	0	0	113.2
745	A	29.8	Very low	34.2	Very low	72 Å²	72	110.8 Å²	110.8	60%	0.595	63%	0.631	S	S	*	*	S	Bend	trans	-143.1	146.8	172.4	0	0	0	0	0	108.6
746	V	29.7	Very low	34.6	Very low	141 Å²	141	113.3 Å²	113.3	86%	0.855	63%	0.634	S	S	*	*	S	Bend	trans	72.1	138.1	-159.7	-167.8	0	0	0	0	112.1
747	V	31.4	Very low	34.5	Very low	125 Å²	125	112.9 Å²	112.9	76%	0.758	62%	0.617	S	S	*	*	S	Bend	trans	71	111.1	-167.9	-169.6	0	0	0	0	115.1
748	C	30	Very low	34.5	Very low	109 Å²	109	111.6 Å²	111.6	74%	0.736	61%	0.614	S	S	*	*			trans	19.6	130	151.2	-53.6	0	0	0	0	119.8
749	G	32.5	Very low	34.5	Very low	60 Å²	60	117.3 Å²	117.3	62%	0.619	63%	0.629	S	S	*	*			cis	-179.7	-165.4	6.1	0	0	0	0	0	110.3	T751	G749-T751 PolarHBondContact O-N 2.92Å
750	P	34	Very low	35.1	Very low	81 Å²	81	114.7 Å²	114.7	53%	0.526	62%	0.623	S	S	.	*			trans	-57.8	138.7	178.6	-20.2	31.6	0	0	0	110.9	E754 F755	P750-E754 HydrophobicContact CB-CB 4.21Å; P750-F755 HydrophobicContact CB-CD2 3.9Å; P750-F755 HydrophobicContact CB-CE2 4.31Å; P750-F755 HydrophobicContact CG-CD2 3.97Å; P750-F755 HydrophobicContact CG-CE2 3.86Å
751	T	31.1	Very low	35.5	Very low	83 Å²	83	114.2 Å²	114.2	51%	0.509	62%	0.623	S	S	.	*			trans	-65.9	157.1	-179.1	69.2	0	0	0	0	110.4	G749 K753 E754 F755	G749-T751 PolarHBondContact O-N 2.92Å; T751-K753 PolarHBondContact O-N 2.91Å; T751-E754 WeakPolarHBondContact CB-OE2 3.49Å; T751-E754 WeakPolarHBondContact CG2-OE2 3.47Å; T751-E754 PolarHBondContact N-OE2 3.09Å; T751-E754 PolarHBondContact O-N 2.8Å; T751-E754 PolarHBondContact OG1-OE2 2.78Å; T751-F755 PolarHBondContact O-N 3.47Å
752	E	34.4	Very low	35.6	Very low	120 Å²	120	114.7 Å²	114.7	56%	0.561	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-8	-176.3	-148.6	-150.2	131.5	0	0	114.2	K756	E752-K756 IonicContact OE1-NZ 3.85Å; E752-K756 PolarHBondContact OE1-NZ 3.25Å
753	K	39	Very low	36	Very low	124 Å²	124	111.9 Å²	111.9	54%	0.539	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.2	-18.7	173.5	-65.4	-167.3	172	-164.6	0	114.3	T751	T751-K753 PolarHBondContact O-N 2.91Å
754	E	40.8	Very low	36.3	Very low	111 Å²	111	112.3 Å²	112.3	52%	0.519	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91	-37.9	178.9	-71	156.5	130.6	0	0	111	P750 T751 K756 F757	P750-E754 HydrophobicContact CB-CB 4.21Å; T751-E754 WeakPolarHBondContact CB-OE2 3.49Å; T751-E754 WeakPolarHBondContact CG2-OE2 3.47Å; T751-E754 PolarHBondContact N-OE2 3.09Å; T751-E754 PolarHBondContact O-N 2.8Å; T751-E754 PolarHBondContact OG1-OE2 2.78Å; E754-K756 PolarHBondContact O-N 2.92Å; E754-F757 VanDerWaalsContact O-CB 3.3Å; E754-F757 WeakPolarHBondContact O-CB 3.45Å; E754-F757 PolarHBondContact O-N 2.97Å
755	F	33	Very low	37.1	Very low	117 Å²	117	113.4 Å²	113.4	51%	0.513	60%	0.596	S	S	.	*	H	α-helix	trans	-65.9	-22.2	175.2	-117.7	-62.5	0	0	0	114	P750 T751 F757	P750-F755 HydrophobicContact CB-CD2 3.9Å; P750-F755 HydrophobicContact CB-CE2 4.31Å; P750-F755 HydrophobicContact CG-CD2 3.97Å; P750-F755 HydrophobicContact CG-CE2 3.86Å; T751-F755 PolarHBondContact O-N 3.47Å; F755-F757 VanDerWaalsContact C-N 3.26Å; F755-F757 PolarHBondContact O-N 3.38Å
756	K	40.6	Very low	38.4	Very low	120 Å²	120	114.9 Å²	114.9	52%	0.522	59%	0.59	S	S	.	*	H	α-helix	trans	-77.2	-6.4	171	-84	171.3	176.7	149.1	0	113.7	E752 E754	E752-K756 IonicContact OE1-NZ 3.85Å; E752-K756 PolarHBondContact OE1-NZ 3.25Å; E754-K756 PolarHBondContact O-N 2.92Å
757	F	34.2	Very low	39.4	Very low	107 Å²	107	112.2 Å²	112.2	47%	0.469	57%	0.568	S	S	.	*	H	α-helix	trans	-93.1	-42.6	-179.5	-150	-78.5	0	0	0	112.5	E754 F755 R759 N760 Q956	E754-F757 VanDerWaalsContact O-CB 3.3Å; E754-F757 WeakPolarHBondContact O-CB 3.45Å; E754-F757 PolarHBondContact O-N 2.97Å; F755-F757 VanDerWaalsContact C-N 3.26Å; F755-F757 PolarHBondContact O-N 3.38Å; F757-R759 VanDerWaalsContact C-N 3.32Å; F757-R759 PolarHBondContact O-N 3.5Å; F757-N760 PolarHBondContact O-N 3.45Å; F757-Q956 HydrophobicContact CE2-CG 3.77Å; F757-Q956 HydrophobicContact CZ-CG 3.83Å
758	Q	41.7	Very low	40.8	Very low	138 Å²	138	110 Å²	110	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-68	-30.7	177.5	-74.6	-178.5	-37.6	0	0	112.9	N760 N761	Q758-N760 PolarHBondContact O-N 3.32Å; Q758-N760 VanDerWaalsContact O-N 3.11Å; Q758-N761 PolarHBondContact O-N 3.42Å
759	R	35.9	Very low	42.5	Very low	199 Å²	199	111 Å²	111	75%	0.751	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.4	-179.6	-144.2	-177.8	-157.2	123.4	3	114.6	F757	F757-R759 VanDerWaalsContact C-N 3.32Å; F757-R759 PolarHBondContact O-N 3.5Å
760	N	42.8	Very low	43.8	Very low	101 Å²	101	111.4 Å²	111.4	54%	0.54	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-0.8	-177.9	-65.9	6.1	0	0	0	113.3	F757 Q758	F757-N760 PolarHBondContact O-N 3.45Å; Q758-N760 PolarHBondContact O-N 3.32Å; Q758-N760 VanDerWaalsContact O-N 3.11Å
761	N	42.8	Very low	45.3	Very low	134 Å²	134	111.2 Å²	111.2	72%	0.717	53%	0.527	S	S	*	.	S	Bend	trans	-116	3.4	-175.5	-89	24.1	0	0	0	114.3	Q758	Q758-N761 PolarHBondContact O-N 3.42Å
762	L	41.7	Very low	47.2	Very low	98 Å²	98	112.3 Å²	112.3	51%	0.513	53%	0.526	S	S	.	.	S	Bend	trans	-90.9	128.9	166.7	-81.6	162	0	0	0	108.8	Y764 F767	L762-Y764 PolarHBondContact O-N 3.47Å; L762-F767 HydrophobicContact CD1-CD2 4.31Å
763	N	41.6	Very low	48.7	Very low	95 Å²	95	112.1 Å²	112.1	51%	0.508	53%	0.525	S	S	.	.			trans	-62.2	135.1	174.4	179.5	1.2	0	0	0	109	N765 E766 F767	N763-N765 PolarHBondContact O-N 2.67Å; N763-N765 PolarHBondContact OD1-N 3.17Å; N763-E766 HydrophobicContact CB-CB 3.89Å; N763-E766 PolarHBondContact O-N 2.72Å; N763-E766 VanDerWaalsContact O-N 3.11Å; N763-F767 WeakPolarHBondContact O-CB 3.29Å; N763-F767 PolarHBondContact O-N 3.48Å
764	Y	41.5	Very low	49.8	Very low	141 Å²	141	112.2 Å²	112.2	55%	0.553	53%	0.527	S	S	*	.	H	α-helix	trans	-58.4	-37.2	-174.8	-176.5	-97.2	0	0	0	112	L762 F767 Q768	L762-Y764 PolarHBondContact O-N 3.47Å; Y764-F767 PolarHBondContact O-N 3.34Å; Y764-Q768 HydrophobicContact CD1-CG 4.21Å; Y764-Q768 HydrophobicContact CE1-CG 3.88Å; Y764-Q768 VanDerWaalsContact O-CG 3.31Å; Y764-Q768 WeakPolarHBondContact O-CG 3.48Å; Y764-Q768 PolarHBondContact O-N 3.21Å; Y764-Q768 PolarHBondContact OH-NE2 3.21Å; Y764-Q768 VanDerWaalsContact OH-NE2 3.09Å
765	N	49.7	Very low	50.6	Low	106 Å²	106	109.4 Å²	109.4	57%	0.567	52%	0.523	S	S	*	.	H	α-helix	trans	-70.6	-40.7	178.2	-63.9	-0.2	0	0	0	111.6	N763 F767 Q768 E769	N763-N765 PolarHBondContact O-N 2.67Å; N763-N765 PolarHBondContact OD1-N 3.17Å; N765-F767 VanDerWaalsContact C-N 3.32Å; N765-F767 PolarHBondContact O-N 3.17Å; N765-Q768 CarbonylContact O-C 3.57Å; N765-Q768 PolarHBondContact O-N 2.67Å; N765-E769 WeakPolarHBondContact O-CG 3.2Å; N765-E769 PolarHBondContact O-N 3.45Å
766	E	58.3	Low	51.9	Low	102 Å²	102	108.4 Å²	108.4	48%	0.477	52%	0.52	S	S	.	.	H	α-helix	trans	-69	-31.1	177.2	-167.7	175.5	-151.2	0	0	111.7	N763 T770	N763-E766 HydrophobicContact CB-CB 3.89Å; N763-E766 PolarHBondContact O-N 2.72Å; N763-E766 VanDerWaalsContact O-N 3.11Å; E766-T770 WeakPolarHBondContact O-CB 2.97Å; E766-T770 WeakPolarHBondContact O-CG2 3.13Å; E766-T770 PolarHBondContact O-N 3.41Å; E766-T770 PolarHBondContact O-OG1 3.05Å
767	F	50.7	Low	52.6	Low	86 Å²	86	106.6 Å²	106.6	38%	0.377	52%	0.516	S	S	.	.	H	α-helix	trans	-71.1	-37	170.1	-175.8	-110.2	0	0	0	112.3	L762 N763 Y764 N765 T770 I771	L762-F767 HydrophobicContact CD1-CD2 4.31Å; N763-F767 WeakPolarHBondContact O-CB 3.29Å; N763-F767 PolarHBondContact O-N 3.48Å; Y764-F767 PolarHBondContact O-N 3.34Å; N765-F767 VanDerWaalsContact C-N 3.32Å; N765-F767 PolarHBondContact O-N 3.17Å; F767-T770 WeakPolarHBondContact CA-OG1 3.02Å; F767-T770 PolarHBondContact O-OG1 3.28Å; F767-I771 HydrophobicContact CD1-CD1 3.94Å; F767-I771 HydrophobicContact CE1-CD1 3.42Å; F767-I771 VanDerWaalsContact CE1-CD1 3.42Å; F767-I771 HydrophobicContact CE2-CD1 4.17Å; F767-I771 HydrophobicContact CZ-CD1 3.56Å; F767-I771 HydrophobicContact CZ-CG1 4.42Å; F767-I771 WeakPolarHBondContact O-CB 2.95Å; F767-I771 WeakPolarHBondContact O-CG1 3.24Å; F767-I771 PolarHBondContact O-N 2.87Å
768	Q	61.6	Low	53.4	Low	79 Å²	79	105.8 Å²	105.8	37%	0.369	52%	0.516	S	S	.	.	H	α-helix	trans	-70.4	-41.5	171.9	-70.3	-68.3	-1.4	0	0	111.5	Y764 N765 I771 Q772	Y764-Q768 HydrophobicContact CD1-CG 4.21Å; Y764-Q768 HydrophobicContact CE1-CG 3.88Å; Y764-Q768 VanDerWaalsContact O-CG 3.31Å; Y764-Q768 WeakPolarHBondContact O-CG 3.48Å; Y764-Q768 PolarHBondContact O-N 3.21Å; Y764-Q768 PolarHBondContact OH-NE2 3.21Å; Y764-Q768 VanDerWaalsContact OH-NE2 3.09Å; N765-Q768 CarbonylContact O-C 3.57Å; N765-Q768 PolarHBondContact O-N 2.67Å; Q768-I771 PolarHBondContact O-N 2.8Å; Q768-Q772 WeakPolarHBondContact O-CB 3.43Å; Q768-Q772 PolarHBondContact O-N 3.05Å
769	E	65.6	Low	53.6	Low	128 Å²	128	102.4 Å²	102.4	60%	0.598	51%	0.508	S	S	*	.	H	α-helix	trans	-64.2	-39.7	174.8	-76.3	180	168.6	0	0	112	N765 Q772 Q773	N765-E769 WeakPolarHBondContact O-CG 3.2Å; N765-E769 PolarHBondContact O-N 3.45Å; E769-Q772 PolarHBondContact O-N 2.56Å; E769-Q773 WeakPolarHBondContact O-CB 3.23Å; E769-Q773 WeakPolarHBondContact O-CG 3.3Å; E769-Q773 PolarHBondContact O-N 2.94Å
770	T	59.5	Low	54.2	Low	70 Å²	70	98.8 Å²	98.8	43%	0.429	50%	0.499	S	S	.	.	H	α-helix	trans	-70.8	-33.3	173.1	45.5	0	0	0	0	112.8	E766 F767 H774	E766-T770 WeakPolarHBondContact O-CB 2.97Å; E766-T770 WeakPolarHBondContact O-CG2 3.13Å; E766-T770 PolarHBondContact O-N 3.41Å; E766-T770 PolarHBondContact O-OG1 3.05Å; F767-T770 WeakPolarHBondContact CA-OG1 3.02Å; F767-T770 PolarHBondContact O-OG1 3.28Å; T770-H774 VanDerWaalsContact O-CB 3.27Å; T770-H774 WeakPolarHBondContact O-CB 3.34Å; T770-H774 PolarHBondContact O-N 3.2Å
771	I	64.2	Low	53.9	Low	76 Å²	76	102 Å²	102	39%	0.39	51%	0.508	S	S	.	.	H	α-helix	trans	-66.8	-42.3	169.6	-77.7	175.3	0	0	0	111.4	F767 Q768 H774 A775	F767-I771 HydrophobicContact CD1-CD1 3.94Å; F767-I771 HydrophobicContact CE1-CD1 3.42Å; F767-I771 VanDerWaalsContact CE1-CD1 3.42Å; F767-I771 HydrophobicContact CE2-CD1 4.17Å; F767-I771 HydrophobicContact CZ-CD1 3.56Å; F767-I771 HydrophobicContact CZ-CG1 4.42Å; F767-I771 WeakPolarHBondContact O-CB 2.95Å; F767-I771 WeakPolarHBondContact O-CG1 3.24Å; F767-I771 PolarHBondContact O-N 2.87Å; Q768-I771 PolarHBondContact O-N 2.8Å; I771-H774 PolarHBondContact O-N 3.22Å; I771-A775 WeakPolarHBondContact O-CB 3.38Å; I771-A775 PolarHBondContact O-N 2.94Å
772	Q	72.8	Confident	53.7	Low	107 Å²	107	105.5 Å²	105.5	50%	0.5	51%	0.512	S	S	.	.	H	α-helix	trans	-61.9	-50.9	177.9	-173.7	71.1	25.8	0	0	109.8	Q768 E769 H774 A775 E776	Q768-Q772 WeakPolarHBondContact O-CB 3.43Å; Q768-Q772 PolarHBondContact O-N 3.05Å; E769-Q772 PolarHBondContact O-N 2.56Å; Q772-H774 VanDerWaalsContact C-N 3.32Å; Q772-H774 PolarHBondContact O-N 3.49Å; Q772-A775 PolarHBondContact O-N 3.46Å; Q772-E776 WeakPolarHBondContact CG-OE1 3.19Å; Q772-E776 PolarHBondContact NE2-OE1 3.4Å; Q772-E776 WeakPolarHBondContact O-CB 3.41Å; Q772-E776 WeakPolarHBondContact O-CG 3.35Å; Q772-E776 PolarHBondContact O-N 3.15Å
773	Q	65.9	Low	53.5	Low	115 Å²	115	106.2 Å²	106.2	54%	0.537	52%	0.516	S	S	.	.	H	α-helix	trans	-60.1	-38.3	172.6	-75.1	-176.5	2.1	0	0	112.2	E769 N777	E769-Q773 WeakPolarHBondContact O-CB 3.23Å; E769-Q773 WeakPolarHBondContact O-CG 3.3Å; E769-Q773 PolarHBondContact O-N 2.94Å; Q773-N777 VanDerWaalsContact O-CB 3.23Å; Q773-N777 WeakPolarHBondContact O-CB 3.41Å; Q773-N777 VanDerWaalsContact O-CG 3.31Å; Q773-N777 PolarHBondContact O-N 3.03Å; Q773-N777 PolarHBondContact O-ND2 2.43Å
774	H	60.4	Low	53.2	Low	126 Å²	126	108.7 Å²	108.7	58%	0.583	53%	0.529	S	S	*	.	H	α-helix	trans	-70.8	-36.5	177.8	-143.5	56.8	0	0	0	111.8	T770 I771 Q772 I778	T770-H774 VanDerWaalsContact O-CB 3.27Å; T770-H774 WeakPolarHBondContact O-CB 3.34Å; T770-H774 PolarHBondContact O-N 3.2Å; I771-H774 PolarHBondContact O-N 3.22Å; Q772-H774 VanDerWaalsContact C-N 3.32Å; Q772-H774 PolarHBondContact O-N 3.49Å; H774-I778 VanDerWaalsContact O-CB 3.24Å; H774-I778 WeakPolarHBondContact O-CB 3.35Å; H774-I778 WeakPolarHBondContact O-CD1 3.39Å; H774-I778 WeakPolarHBondContact O-CG1 3.39Å; H774-I778 PolarHBondContact O-N 2.47Å
775	A	58	Low	52.8	Low	52 Å²	52	107.9 Å²	107.9	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-66.5	-41.5	173.3	0	0	0	0	0	111.9	I771 Q772 I778 S779	I771-A775 WeakPolarHBondContact O-CB 3.38Å; I771-A775 PolarHBondContact O-N 2.94Å; Q772-A775 PolarHBondContact O-N 3.46Å; A775-I778 PolarHBondContact O-N 2.84Å; A775-S779 VanDerWaalsContact O-CB 3.28Å; A775-S779 WeakPolarHBondContact O-CB 3.31Å; A775-S779 PolarHBondContact O-N 3.25Å
776	E	60.4	Low	51.8	Low	97 Å²	97	111.2 Å²	111.2	45%	0.453	55%	0.549	S	S	.	.	H	α-helix	trans	-67.6	-44.2	176.1	-74	169.9	-171.4	0	0	111.7	Q772 I778 S779 Q780	Q772-E776 WeakPolarHBondContact CG-OE1 3.19Å; Q772-E776 PolarHBondContact NE2-OE1 3.4Å; Q772-E776 WeakPolarHBondContact O-CB 3.41Å; Q772-E776 WeakPolarHBondContact O-CG 3.35Å; Q772-E776 PolarHBondContact O-N 3.15Å; E776-I778 PolarHBondContact O-N 3.39Å; E776-S779 WeakPolarHBondContact O-CB 3.49Å; E776-S779 PolarHBondContact O-N 2.87Å; E776-Q780 WeakPolarHBondContact O-CG 3.28Å; E776-Q780 PolarHBondContact O-N 2.61Å
777	N	55.1	Low	50.5	Low	82 Å²	82	113.3 Å²	113.3	44%	0.439	56%	0.561	S	S	.	*	H	α-helix	trans	-63	-39.5	172.9	-79.4	-65.6	0	0	0	112.1	Q773 S779 Q780 F781	Q773-N777 VanDerWaalsContact O-CB 3.23Å; Q773-N777 WeakPolarHBondContact O-CB 3.41Å; Q773-N777 VanDerWaalsContact O-CG 3.31Å; Q773-N777 PolarHBondContact O-N 3.03Å; Q773-N777 PolarHBondContact O-ND2 2.43Å; N777-S779 VanDerWaalsContact C-N 3.33Å; N777-Q780 PolarHBondContact O-N 2.74Å; N777-F781 WeakPolarHBondContact O-CB 3.43Å; N777-F781 PolarHBondContact O-N 3.29Å
778	I	50.9	Low	49.6	Very low	90 Å²	90	121.1 Å²	121.1	46%	0.462	59%	0.588	S	S	.	*	H	α-helix	trans	-68.8	-32.2	174.6	-73	166.3	0	0	0	111.4	H774 A775 E776 R782	H774-I778 VanDerWaalsContact O-CB 3.24Å; H774-I778 WeakPolarHBondContact O-CB 3.35Å; H774-I778 WeakPolarHBondContact O-CD1 3.39Å; H774-I778 WeakPolarHBondContact O-CG1 3.39Å; H774-I778 PolarHBondContact O-N 2.47Å; A775-I778 PolarHBondContact O-N 2.84Å; E776-I778 PolarHBondContact O-N 3.39Å; I778-R782 WeakPolarHBondContact O-CB 3.43Å; I778-R782 WeakPolarHBondContact O-CG 3.4Å; I778-R782 PolarHBondContact O-N 3.24Å; I778-R782 VanDerWaalsContact O-N 3.07Å
779	S	46.5	Very low	48.1	Very low	67 Å²	67	120.4 Å²	120.4	47%	0.469	60%	0.602	S	S	.	*	H	α-helix	trans	-70.6	-41.8	174.4	-162.2	0	0	0	0	111.5	A775 E776 N777 R782 N783	A775-S779 VanDerWaalsContact O-CB 3.28Å; A775-S779 WeakPolarHBondContact O-CB 3.31Å; A775-S779 PolarHBondContact O-N 3.25Å; E776-S779 WeakPolarHBondContact O-CB 3.49Å; E776-S779 PolarHBondContact O-N 2.87Å; N777-S779 VanDerWaalsContact C-N 3.33Å; S779-R782 PolarHBondContact O-N 2.99Å; S779-N783 PolarHBondContact O-N 3.16Å; S779-N783 PolarHBondContact O-ND2 3.37Å
780	Q	48.2	Very low	46.4	Very low	122 Å²	122	122.4 Å²	122.4	57%	0.57	61%	0.611	S	S	*	*	H	α-helix	trans	-62.6	-48.7	172.1	-74.6	176.4	-25.2	0	0	111.4	E776 N777 R782 N783 D784	E776-Q780 WeakPolarHBondContact O-CG 3.28Å; E776-Q780 PolarHBondContact O-N 2.61Å; N777-Q780 PolarHBondContact O-N 2.74Å; Q780-R782 PolarHBondContact O-N 3.43Å; Q780-R782 VanDerWaalsContact O-N 3.13Å; Q780-N783 PolarHBondContact O-N 3.46Å; Q780-D784 PolarHBondContact O-N 3.09Å
781	F	35.8	Very low	45	Very low	168 Å²	168	125.6 Å²	125.6	74%	0.737	62%	0.624	S	S	*	*	H	α-helix	trans	-60.7	-23.2	175	-107.9	-85.9	0	0	0	114.1	N777	N777-F781 WeakPolarHBondContact O-CB 3.43Å; N777-F781 PolarHBondContact O-N 3.29Å
782	R	38.9	Very low	43.5	Very low	209 Å²	209	127.5 Å²	127.5	79%	0.789	64%	0.636	S	S	*	*	H	α-helix	trans	-78.8	-18.7	173.6	-90.1	-173.2	167.5	-159.6	-3.6	114.4	I778 S779 Q780	I778-R782 WeakPolarHBondContact O-CB 3.43Å; I778-R782 WeakPolarHBondContact O-CG 3.4Å; I778-R782 PolarHBondContact O-N 3.24Å; I778-R782 VanDerWaalsContact O-N 3.07Å; S779-R782 PolarHBondContact O-N 2.99Å; Q780-R782 PolarHBondContact O-N 3.43Å; Q780-R782 VanDerWaalsContact O-N 3.13Å
783	N	38.5	Very low	41.6	Very low	113 Å²	113	128 Å²	128	60%	0.604	64%	0.642	S	S	*	*	H	α-helix	trans	-90.3	-28.2	-178.6	-67.8	-33.8	0	0	0	112.9	S779 Q780 T785	S779-N783 PolarHBondContact O-N 3.16Å; S779-N783 PolarHBondContact O-ND2 3.37Å; Q780-N783 PolarHBondContact O-N 3.46Å; N783-T785 PolarHBondContact O-N 3.03Å
784	D	35.7	Very low	40	Very low	146 Å²	146	128.6 Å²	128.6	78%	0.781	65%	0.649	S	S	*	*	S	Bend	trans	-86.1	0.6	-174.4	-70	-15.2	0	0	0	114.9	Q780	Q780-D784 PolarHBondContact O-N 3.09Å
785	T	33.4	Very low	38.4	Very low	125 Å²	125	130 Å²	130	77%	0.767	66%	0.66	S	S	*	*			trans	-109.1	70.4	174.8	-49.5	0	0	0	0	111.2	N783	N783-T785 PolarHBondContact O-N 3.03Å
786	F	27.7	Very low	37.1	Very low	176 Å²	176	132.3 Å²	132.3	77%	0.772	67%	0.67	S	S	*	*			trans	-112.9	159.5	174.9	-149.6	-108	0	0	0	110.3
787	M	31	Very low	35.5	Very low	146 Å²	146	134.8 Å²	134.8	72%	0.719	68%	0.683	S	S	*	*			trans	68.4	102.9	177.7	-52.8	-58	-74.3	0	0	118
788	W	32.5	Very low	34.1	Very low	250 Å²	250	136.1 Å²	136.1	95%	0.947	70%	0.695	S	S	*	*				166.1	109.6	128.5	-80.2	111	0	0	0	104
789	G	29	Very low	32.8	Very low	64 Å²	64	138.6 Å²	138.6	66%	0.66	71%	0.709	S	S	*	*			cis	81.7	121.6	25.6	0	0	0	0	0	109.1
790	Q	30.1	Very low	31.7	Very low	170 Å²	170	141.2 Å²	141.2	79%	0.794	72%	0.718	S	S	*	*			cis	-167.1	-179.1	2.2	-171.5	176.8	-20.2	0	0	106.1
791	L	31	Very low	30.6	Very low	136 Å²	136	143.2 Å²	143.2	71%	0.712	72%	0.72	S	S	*	*			trans	75.3	141	165.5	-47.1	156.4	0	0	0	115
792	D	32	Very low	30.1	Very low	117 Å²	117	139.2 Å²	139.2	63%	0.626	71%	0.706	S	S	*	*			cis	-161.4	160	-11	-123.7	12.4	0	0	0	113.4
793	N	31.9	Very low	29.6	Very low	117 Å²	117	134 Å²	134	63%	0.626	69%	0.694	S	S	*	*			trans	62.9	115.6	149.5	-54.9	-30	0	0	0	122.1
794	D	32.5	Very low	29	Very low	128 Å²	128	132.6 Å²	132.6	68%	0.684	69%	0.687	S	S	*	*				82.8	88.6	126.4	-61	-20	0	0	0	123.5
795	L	27.6	Very low	28.7	Very low	156 Å²	156	130.6 Å²	130.6	82%	0.817	68%	0.676	S	S	*	*				73.7	158	111.5	-70.7	168.6	0	0	0	119.8
796	P	31.5	Very low	28.4	Very low	99 Å²	99	132.9 Å²	132.9	64%	0.643	68%	0.675	S	S	*	*			trans	-135.8	-136.2	-141.2	41.6	-19.7	0	0	0	113.4
797	M	26	Very low	28.5	Very low	149 Å²	149	133.2 Å²	133.2	73%	0.734	68%	0.676	S	S	*	*			trans	76.8	93.3	173.7	-57.2	-54.5	176.7	0	0	115.1
798	T	25.4	Very low	28.4	Very low	111 Å²	111	131.4 Å²	131.4	68%	0.681	67%	0.674	S	S	*	*				94.1	138	76.5	52.7	0	0	0	0	114.8
799	N	24.2	Very low	28.3	Very low	142 Å²	142	124.6 Å²	124.6	76%	0.759	66%	0.656	S	S	*	*			trans	73.7	133	146.9	-80.2	-27.7	0	0	0	121.8
800	N	24.1	Very low	28.4	Very low	121 Å²	121	125.9 Å²	125.9	65%	0.647	65%	0.651	S	S	*	*			trans	73.6	121.9	146.7	-90.5	-46.2	0	0	0	120.9
801	R	24.7	Very low	28.4	Very low	165 Å²	165	122.1 Å²	122.1	62%	0.623	64%	0.636	S	S	*	*			trans	82.9	86.2	134.3	-69.9	167.7	-172.9	-174	-2.2	119.8
802	N	25.1	Very low	28.4	Very low	83 Å²	83	121.3 Å²	121.3	44%	0.444	63%	0.632	S	S	.	*				59.8	80.6	96.2	-167.3	27.6	0	0	0	116.6	S840 L841	N802-S840 WeakPolarHBondContact OD1-CA 3.4Å; N802-L841 HydrophobicContact CB-CG 4.27Å; N802-L841 PolarHBondContact ND2-N 3.26Å; N802-L841 WeakPolarHBondContact O-CD1 3.08Å; N802-L841 WeakPolarHBondContact O-CG 3.47Å; N802-L841 PolarHBondContact OD1-N 2.81Å; N802-L841 VanDerWaalsContact OD1-N 3.16Å
803	N	27.5	Very low	28.3	Very low	100 Å²	100	119.3 Å²	119.3	54%	0.535	63%	0.627	S	S	.	*			trans	-156.9	158.5	156.6	-138.8	-18.8	0	0	0	115.1	Q839 S840	N803-Q839 WeakPolarHBondContact O-CG 3.46Å; N803-Q839 PolarHBondContact O-NE2 3.21Å; N803-S840 VanDerWaalsContact C-OG 3.27Å; N803-S840 WeakPolarHBondContact CA-OG 3.47Å; N803-S840 PolarHBondContact OD1-OG 2.98Å
804	N	26.8	Very low	28.2	Very low	84 Å²	84	122.5 Å²	122.5	45%	0.449	63%	0.632	S	S	.	*			trans	-64	138.3	-171.9	-67.9	-46.9	0	0	0	111.1	S840	N804-S840 WeakPolarHBondContact CA-OG 3.46Å; N804-S840 PolarHBondContact N-OG 2.97Å; N804-S840 PolarHBondContact ND2-OG 3.33Å; N804-S840 VanDerWaalsContact ND2-OG 3.08Å; N804-S840 PolarHBondContact OD1-OG 3.23Å
805	N	29.1	Very low	27.9	Very low	104 Å²	104	123.1 Å²	123.1	56%	0.556	64%	0.635	S	S	*	*				-174.9	160.4	73.5	-94.2	-78.7	0	0	0	113.2
806	K	27.9	Very low	27.9	Very low	172 Å²	172	119.9 Å²	119.9	75%	0.748	63%	0.625	S	S	*	*				6.4	142.8	128.6	-56.9	162.5	-176.2	164.9	0	115.8
807	K	28.7	Very low	27.8	Very low	183 Å²	183	119.6 Å²	119.6	80%	0.796	63%	0.625	S	S	*	*			cis	-177.4	179.7	44.4	-142.4	170	-176	-174.3	0	111.5
808	T	29.5	Very low	27.9	Very low	109 Å²	109	118.2 Å²	118.2	67%	0.669	62%	0.621	S	S	*	*			trans	62.1	116.3	160.2	44.6	0	0	0	0	118
809	N	30	Very low	28.1	Very low	107 Å²	107	119.5 Å²	119.5	57%	0.572	62%	0.619	S	S	*	*				88.9	125.4	54.2	-80.8	-4.4	0	0	0	113.5
810	T	31.2	Very low	28.4	Very low	90 Å²	90	118 Å²	118	55%	0.552	61%	0.611	S	S	*	*				-168.8	135.8	119.2	21.3	0	0	0	0	113	S1258 T1259	T810-S1258 WeakPolarHBondContact CG2-O 3.46Å; T810-T1259 VanDerWaalsContact CG2-N 3.33Å
811	N	30.6	Very low	28.8	Very low	92 Å²	92	119.3 Å²	119.3	49%	0.492	62%	0.618	S	S	.	*			trans	73.2	145.4	138	-64.4	0.6	0	0	0	121.6	T1259 V1260	N811-T1259 PolarHBondContact ND2-O 3.42Å; N811-T1259 PolarHBondContact OD1-O 3.02Å; N811-T1259 VanDerWaalsContact OD1-O 3.12Å; N811-V1260 PolarHBondContact ND2-O 3.43Å
812	L	30.1	Very low	28.9	Very low	118 Å²	118	118.3 Å²	118.3	62%	0.618	62%	0.623	S	S	*	*			cis	-154.4	122.5	-14.3	-93.8	152.9	0	0	0	104.1
813	S	29.3	Very low	29.1	Very low	76 Å²	76	120.2 Å²	120.2	53%	0.531	63%	0.634	S	S	.	*				97.5	152.9	57.4	74.9	0	0	0	0	114.5
814	Y	29.7	Very low	29.2	Very low	183 Å²	183	120.4 Å²	120.4	72%	0.718	64%	0.64	S	S	*	*			trans	106.4	80.6	175.1	-69.9	-74.6	0	0	0	114.2
815	L	26.6	Very low	29.2	Very low	142 Å²	142	125.1 Å²	125.1	74%	0.743	66%	0.657	S	S	*	*				77.9	140.3	59.1	-62.5	164.1	0	0	0	113.8
816	S	27.9	Very low	29.1	Very low	87 Å²	87	126.6 Å²	126.6	61%	0.608	66%	0.664	S	S	*	*			cis	-172.1	176.2	-27.2	57.7	0	0	0	0	110.2
817	S	29.2	Very low	29.3	Very low	94 Å²	94	123.1 Å²	123.1	66%	0.657	66%	0.662	S	S	*	*			trans	73.5	151.8	147.9	-63.8	0	0	0	0	118.8
818	N	28	Very low	29.2	Very low	119 Å²	119	120.5 Å²	120.5	64%	0.636	67%	0.666	S	S	*	*			cis	-163.6	177.8	-7.8	-98.1	3.1	0	0	0	105.8
819	H	30.2	Very low	29.3	Very low	139 Å²	139	121 Å²	121	64%	0.644	67%	0.674	S	S	*	*			cis	-168.9	164.6	-15.4	-95.7	-17.4	0	0	0	104.9
820	N	29.5	Very low	29.5	Very low	111 Å²	111	126.7 Å²	126.7	59%	0.594	69%	0.688	S	S	*	*			cis	-156.2	-127.8	-17	-95.4	-9.2	0	0	0	107.8	I822	N820-I822 HydrophobicContact CB-CD1 4.3Å
821	N	32.7	Very low	29.2	Very low	148 Å²	148	129.5 Å²	129.5	79%	0.791	70%	0.696	S	S	*	*			trans	59	92	178.5	-62.5	4.8	0	0	0	115.7
822	I	27.6	Very low	28.9	Very low	144 Å²	144	135 Å²	135	74%	0.738	71%	0.712	S	S	*	*			cis	70.9	121.3	40.6	-47.5	163.6	0	0	0	112.1	N820	N820-I822 HydrophobicContact CB-CD1 4.3Å
823	D	28.2	Very low	28.6	Very low	123 Å²	123	134.8 Å²	134.8	66%	0.658	72%	0.72	S	S	*	*			cis	-144.7	-114.6	-27.8	-160.2	-135.1	0	0	0	107.3
824	P	31.3	Very low	28.4	Very low	104 Å²	104	135.8 Å²	135.8	68%	0.675	73%	0.727	S	S	*	*			cis	-114.9	-178.3	-21.7	42.5	-27.8	0	0	0	114.2
825	F	26.2	Very low	28.1	Very low	183 Å²	183	135.3 Å²	135.3	80%	0.803	74%	0.736	S	S	*	*			trans	60	82.3	178.7	-79.5	-76.8	0	0	0	114.6
826	L	26.1	Very low	27.9	Very low	134 Å²	134	134.3 Å²	134.3	70%	0.702	73%	0.732	S	S	*	*				54.8	121.9	61.6	-42.8	159.2	0	0	0	111.9
827	S	31.6	Very low	27.8	Very low	100 Å²	100	140.4 Å²	140.4	70%	0.699	75%	0.747	S	S	*	*			cis	-126.8	115.8	8.9	50.7	0	0	0	0	113.5	S829	S827-S829 PolarHBondContact O-N 3.33Å
828	S	27.9	Very low	27.6	Very low	128 Å²	128	137.5 Å²	137.5	90%	0.895	73%	0.732	S	S	*	*			trans	-87	79.7	150.2	-77.3	0	0	0	0	109.2
829	S	30.9	Very low	27.4	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	73%	0.725	S	S	*	*			trans	-99.9	66.8	167	-62.1	0	0	0	0	109.6	S827	S827-S829 PolarHBondContact O-N 3.33Å
830	R	33.7	Very low	27.1	Very low	227 Å²	227	131.9 Å²	131.9	86%	0.857	71%	0.707	S	S	*	*			trans	-110.5	137	175	-159.3	-176.3	-162.9	179.7	6.3	108.4
831	M	26.5	Very low	26.9	Very low	149 Å²	149	130.4 Å²	130.4	73%	0.734	70%	0.698	S	S	*	*	S	Bend	trans	80.3	154.7	177.8	-53	-179.2	151.7	0	0	117.3
832	Y	23.6	Very low	26.7	Very low	206 Å²	206	128 Å²	128	81%	0.808	69%	0.693	S	S	*	*			trans	77.7	141.7	166.3	-60.2	-69.2	0	0	0	120.1
833	S	23.7	Very low	26.7	Very low	115 Å²	115	127 Å²	127	80%	0.804	69%	0.694	S	S	*	*			trans	66	122.8	166.1	-55.5	0	0	0	0	116.7
834	S	24.8	Very low	26.6	Very low	96 Å²	96	128 Å²	128	67%	0.671	70%	0.699	S	S	*	*			cis	-138.8	109.6	14.7	-67.3	0	0	0	0	113.2	N836	S834-N836 PolarHBondContact O-N 3.38Å
835	L	24.1	Very low	26.5	Very low	173 Å²	173	127.3 Å²	127.3	91%	0.906	70%	0.696	S	S	*	*			trans	-80.4	76.7	145	-96.1	173.9	0	0	0	108.3
836	N	22.2	Very low	26.7	Very low	122 Å²	122	126.4 Å²	126.4	65%	0.652	69%	0.694	S	S	*	*			trans	-141.7	121.2	158.4	-84.2	-32.5	0	0	0	102.6	S834	S834-N836 PolarHBondContact O-N 3.38Å
837	F	26.5	Very low	26.9	Very low	214 Å²	214	127 Å²	127	94%	0.939	70%	0.697	S	S	*	*			cis	45.9	47.2	35.5	-90.8	-74.9	0	0	0	111
838	G	23.9	Very low	26.9	Very low	33 Å²	33	128.2 Å²	128.2	34%	0.34	70%	0.7	S	S	.	*			trans	-148.2	27.7	-174.2	0	0	0	0	0	113.9
839	Q	24.2	Very low	27.3	Very low	104 Å²	104	128 Å²	128	49%	0.486	70%	0.696	S	S	.	*			trans	68.7	166.7	167.5	-43	127.9	-44.6	0	0	112.5	N803	N803-Q839 WeakPolarHBondContact O-CG 3.46Å; N803-Q839 PolarHBondContact O-NE2 3.21Å
840	S	23.8	Very low	27.5	Very low	37 Å²	37	128.2 Å²	128.2	26%	0.259	70%	0.697	S	S	.	*			cis	-153	-180	15.8	-70.7	0	0	0	0	115	N802 N803 N804	N802-S840 WeakPolarHBondContact OD1-CA 3.4Å; N803-S840 VanDerWaalsContact C-OG 3.27Å; N803-S840 WeakPolarHBondContact CA-OG 3.47Å; N803-S840 PolarHBondContact OD1-OG 2.98Å; N804-S840 WeakPolarHBondContact CA-OG 3.46Å; N804-S840 PolarHBondContact N-OG 2.97Å; N804-S840 PolarHBondContact ND2-OG 3.33Å; N804-S840 VanDerWaalsContact ND2-OG 3.08Å; N804-S840 PolarHBondContact OD1-OG 3.23Å
841	L	25.2	Very low	27.4	Very low	79 Å²	79	122.5 Å²	122.5	41%	0.414	69%	0.692	S	S	.	*			trans	-35.2	157.1	143.9	-73.8	169.1	0	0	0	113.1	N802	N802-L841 HydrophobicContact CB-CG 4.27Å; N802-L841 PolarHBondContact ND2-N 3.26Å; N802-L841 WeakPolarHBondContact O-CD1 3.08Å; N802-L841 WeakPolarHBondContact O-CG 3.47Å; N802-L841 PolarHBondContact OD1-N 2.81Å; N802-L841 VanDerWaalsContact OD1-N 3.16Å
842	S	27.8	Very low	27.5	Very low	98 Å²	98	120.9 Å²	120.9	69%	0.685	69%	0.693	S	S	*	*			cis	-162.6	159.8	9.8	21.6	0	0	0	0	107.3
843	T	28.4	Very low	27.9	Very low	124 Å²	124	116.8 Å²	116.8	76%	0.761	69%	0.689	S	S	*	*				-144.3	127.8	51.6	33.9	0	0	0	0	114.7
844	L	26.3	Very low	28.4	Very low	143 Å²	143	118.1 Å²	118.1	75%	0.749	69%	0.687	S	S	*	*			trans	-64.3	126.3	130.6	-129.9	73.5	0	0	0	108.4
845	S	28.7	Very low	28.4	Very low	89 Å²	89	121.6 Å²	121.6	62%	0.622	70%	0.697	S	S	*	*			trans	-115.7	117.1	137.8	47.9	0	0	0	0	105.4
846	Q	30	Very low	28.7	Very low	164 Å²	164	120.7 Å²	120.7	77%	0.766	69%	0.691	S	S	*	*				73.8	130.6	104.5	-67.6	170.2	11.6	0	0	112.2
847	I	31.7	Very low	29.1	Very low	148 Å²	148	119 Å²	119	76%	0.759	69%	0.694	S	S	*	*			cis	-148.5	167.3	17.9	-121.2	154.5	0	0	0	113.2
848	T	30.8	Very low	29.2	Very low	124 Å²	124	117.5 Å²	117.5	76%	0.761	69%	0.69	S	S	*	*			trans	-39.1	162.8	-167.4	49.7	0	0	0	0	123.2
849	P	36.6	Very low	29.3	Very low	125 Å²	125	123.9 Å²	123.9	81%	0.812	71%	0.711	S	S	*	*			trans	-115.4	166.2	-179.6	43.2	-33.7	0	0	0	117
850	S	34.2	Very low	29.6	Very low	123 Å²	123	127.2 Å²	127.2	86%	0.86	73%	0.726	S	S	*	*			trans	-170.2	148.9	156.6	51.7	0	0	0	0	109.2
851	S	32.4	Very low	29.7	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	75%	0.754	S	S	*	*			cis	-143.2	172.6	-6.4	60.2	0	0	0	0	110.1
852	P	29.2	Very low	29.8	Very low	116 Å²	116	136.4 Å²	136.4	75%	0.753	77%	0.769	S	S	*	*			trans	-112.9	106.7	-167.1	37	-26.1	0	0	0	116.5
853	T	31.5	Very low	29.7	Very low	120 Å²	120	138.9 Å²	138.9	74%	0.736	77%	0.772	S	S	*	*			trans	-159.2	132.7	157.7	29.8	0	0	0	0	105.9
854	D	33.3	Very low	29.8	Very low	142 Å²	142	139.6 Å²	139.6	76%	0.759	77%	0.771	S	S	*	*			cis	-125.1	143.8	13.3	-64	-59.5	0	0	0	112.8
855	I	26.4	Very low	30	Very low	169 Å²	169	138 Å²	138	87%	0.867	77%	0.772	S	S	*	*			trans	-116.9	61.2	172.1	-50.3	-178.4	0	0	0	109.3
856	I	28.7	Very low	30.1	Very low	155 Å²	155	138.8 Å²	138.8	80%	0.795	77%	0.773	S	S	*	*	S	Bend	trans	-138.5	145.8	165	-57.8	-177.2	0	0	0	106.7
857	A	31.8	Very low	30.1	Very low	86 Å²	86	139.2 Å²	139.2	71%	0.711	77%	0.772	S	S	*	*	S	Bend	trans	68.3	26.1	176.7	0	0	0	0	0	118.3
858	Q	28.3	Very low	30.1	Very low	182 Å²	182	139.2 Å²	139.2	85%	0.85	77%	0.771	S	S	*	*			trans	-133.4	76.1	162.5	-74.1	-159.6	-1	0	0	114
859	H	26.8	Very low	30.3	Very low	168 Å²	168	136.6 Å²	136.6	78%	0.778	75%	0.749	S	S	*	*			trans	-148.7	25.8	149.8	-120	67.9	0	0	0	114.1	M861	H859-M861 VanDerWaalsContact C-N 3.26Å; H859-M861 PolarHBondContact O-N 3.04Å
860	E	29	Very low	30.2	Very low	174 Å²	174	133.5 Å²	133.5	81%	0.813	73%	0.73	S	S	*	*			trans	-85.1	56.9	-179.7	-62	-168.6	137.8	0	0	112.5
861	M	27	Very low	30.2	Very low	171 Å²	171	132.5 Å²	132.5	84%	0.842	72%	0.715	S	S	*	*	S	Bend	trans	-167.1	98.9	165.1	-114	168.1	-79.6	0	0	112.9	H859	H859-M861 VanDerWaalsContact C-N 3.26Å; H859-M861 PolarHBondContact O-N 3.04Å
862	N	26.3	Very low	30.5	Very low	138 Å²	138	132.1 Å²	132.1	74%	0.738	70%	0.704	S	S	*	*	S	Bend	trans	68	160.1	178.1	-67.9	-72.7	0	0	0	117.3
863	M	26.4	Very low	30.9	Very low	149 Å²	149	131.2 Å²	131.2	73%	0.734	69%	0.693	S	S	*	*			trans	69.1	143.3	-163	-39.7	-55.5	175.2	0	0	112
864	D	30.8	Very low	31	Very low	140 Å²	140	131.1 Å²	131.1	75%	0.749	69%	0.688	S	S	*	*			cis	-109.2	124.4	9.5	-83.1	-43.7	0	0	0	114.6
865	S	29.9	Very low	31.1	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	69%	0.686	S	S	*	*			trans	-99.9	17.2	165.4	-162.4	0	0	0	0	111.7
866	V	29.9	Very low	31.5	Very low	107 Å²	107	130.2 Å²	130.2	65%	0.648	68%	0.683	S	S	*	*			trans	-137.1	54.5	-160.7	-162.2	0	0	0	0	112.4
867	K	31.1	Very low	31.6	Very low	172 Å²	172	133 Å²	133	75%	0.748	68%	0.684	S	S	*	*	S	Bend	trans	-147.9	29.5	167.1	-142.5	174.1	-177.4	177	0	116.9
868	M	30.6	Very low	31.7	Very low	149 Å²	149	132.6 Å²	132.6	73%	0.734	68%	0.676	S	S	*	*	S	Bend	trans	-136	-2	167	-89.1	-170.5	168.8	0	0	114.5	L872	M868-L872 WeakPolarHBondContact O-CB 3.28Å; M868-L872 PolarHBondContact O-N 2.93Å
869	K	36.4	Very low	31.9	Very low	69 Å²	69	134 Å²	134	30%	0.3	68%	0.675	S	S	.	*	H	α-helix	trans	-86.3	-33.1	-179.8	-90.5	166.2	168.6	162.9	0	114.2	D871 L873 L1326 D1327	K869-D871 VanDerWaalsContact C-N 3.31Å; K869-D871 PolarHBondContact O-N 3.19Å; K869-L873 PolarHBondContact O-N 3.49Å; K869-L1326 HydrophobicContact CB-CD2 4.18Å; K869-L1326 HydrophobicContact CG-CD2 3.85Å; K869-L1326 HydrophobicContact CG-CG 4.2Å; K869-L1326 VanDerWaalsContact O-CD2 3.3Å; K869-L1326 WeakPolarHBondContact O-CD2 3.02Å; K869-D1327 WeakPolarHBondContact CD-O 3.13Å; K869-D1327 VanDerWaalsContact CE-O 3.25Å; K869-D1327 WeakPolarHBondContact CE-O 3.47Å; K869-D1327 WeakPolarHBondContact CE-OD2 3.33Å; K869-D1327 IonicContact NZ-OD2 3.06Å; K869-D1327 PolarHBondContact NZ-OD2 2.77Å
870	S	34.3	Very low	32.2	Very low	60 Å²	60	133 Å²	133	42%	0.42	67%	0.671	S	S	.	*	H	α-helix	trans	-60.6	-40.8	170.6	48.7	0	0	0	0	112.3	L873 N874	S870-L873 PolarHBondContact O-N 2.73Å; S870-N874 PolarHBondContact O-ND2 2.9Å; S870-N874 VanDerWaalsContact O-ND2 3.16Å
871	D	34.8	Very low	32.3	Very low	101 Å²	101	132.2 Å²	132.2	54%	0.54	67%	0.671	S	S	.	*	H	α-helix	trans	-89.4	-32.7	-164.1	-57.4	1.3	0	0	0	110.9	K869 L873 N874	K869-D871 VanDerWaalsContact C-N 3.31Å; K869-D871 PolarHBondContact O-N 3.19Å; D871-L873 VanDerWaalsContact C-N 3.28Å; D871-L873 PolarHBondContact O-N 3.44Å; D871-N874 PolarHBondContact O-N 3.38Å
872	L	38.5	Very low	32.6	Very low	99 Å²	99	130.6 Å²	130.6	52%	0.518	66%	0.661	S	S	.	*	H	α-helix	trans	-73.7	-13.9	169.3	-79.2	167.5	0	0	0	113.9	M868 L1326	M868-L872 WeakPolarHBondContact O-CB 3.28Å; M868-L872 PolarHBondContact O-N 2.93Å; L872-L1326 HydrophobicContact CB-CD1 4Å; L872-L1326 HydrophobicContact CB-CD2 3.81Å
873	L	36.6	Very low	32.8	Very low	97 Å²	97	130 Å²	130	51%	0.508	66%	0.658	S	S	.	*	H	α-helix	trans	-83.4	-21.1	169.8	-97.9	162.6	0	0	0	113.4	K869 S870 D871 L1326	K869-L873 PolarHBondContact O-N 3.49Å; S870-L873 PolarHBondContact O-N 2.73Å; D871-L873 VanDerWaalsContact C-N 3.28Å; D871-L873 PolarHBondContact O-N 3.44Å; L873-L1326 HydrophobicContact CD1-CD2 4.28Å; L873-L1326 HydrophobicContact CG-CD2 3.97Å
874	N	33.8	Very low	32.8	Very low	118 Å²	118	130.8 Å²	130.8	63%	0.631	67%	0.665	S	S	*	*	H	α-helix	trans	-87.9	-19.9	-179.6	-78.9	-46	0	0	0	114.2	S870 D871 N876	S870-N874 PolarHBondContact O-ND2 2.9Å; S870-N874 VanDerWaalsContact O-ND2 3.16Å; D871-N874 PolarHBondContact O-N 3.38Å; N874-N876 VanDerWaalsContact C-N 3.26Å; N874-N876 PolarHBondContact O-N 3.42Å
875	L	35.5	Very low	32.7	Very low	137 Å²	137	128.4 Å²	128.4	72%	0.717	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-10.9	177.9	-150.8	72.6	0	0	0	113.9
876	N	34.6	Very low	32.8	Very low	154 Å²	154	130.6 Å²	130.6	82%	0.824	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	16.8	-174.7	-123.4	-8.1	0	0	0	113.5	N874	N874-N876 VanDerWaalsContact C-N 3.26Å; N874-N876 PolarHBondContact O-N 3.42Å
877	R	31.7	Very low	32.6	Very low	214 Å²	214	132.4 Å²	132.4	81%	0.808	66%	0.663	S	S	*	*	S	Bend	trans	-126.9	3.1	-177.6	-148.4	175.4	-175.4	-173.8	-0.4	114.8
878	S	33.5	Very low	32.4	Very low	77 Å²	77	131.4 Å²	131.4	54%	0.538	67%	0.666	S	S	.	*	S	Bend	trans	-100	-13.2	-177.2	47.1	0	0	0	0	114.6
879	Y	32.5	Very low	32.5	Very low	211 Å²	211	129.4 Å²	129.4	83%	0.827	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-12.9	-172.2	-116.6	-86.3	0	0	0	115.8
880	E	33.5	Very low	32.2	Very low	148 Å²	148	133.1 Å²	133.1	69%	0.692	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.2	39.4	-178.4	-144	158.9	-134.3	0	0	114.1
881	L	30.2	Very low	32.2	Very low	158 Å²	158	135.7 Å²	135.7	83%	0.827	71%	0.708	S	S	*	*	S	Bend	trans	-119.6	14.6	153.6	-101.1	175.2	0	0	0	112.8
882	H	34.1	Very low	31.8	Very low	137 Å²	137	136.9 Å²	136.9	63%	0.634	71%	0.714	S	S	*	*	S	Bend	trans	-119.9	7.4	179.1	-132	-74.4	0	0	0	115.2	N884	H882-N884 VanDerWaalsContact C-N 3.34Å; H882-N884 PolarHBondContact O-N 3.06Å
883	N	30.1	Very low	31.5	Very low	124 Å²	124	137.8 Å²	137.8	66%	0.663	73%	0.726	S	S	*	*	S	Bend	trans	-94.3	56.4	167.2	-82.7	-30.9	0	0	0	111
884	N	26.6	Very low	30.9	Very low	166 Å²	166	143 Å²	143	89%	0.888	74%	0.74	S	S	*	*	S	Bend	trans	-165.3	47.6	168.5	-102.7	-32.8	0	0	0	111.4	H882	H882-N884 VanDerWaalsContact C-N 3.34Å; H882-N884 PolarHBondContact O-N 3.06Å
885	V	28.4	Very low	30.6	Very low	90 Å²	90	140.1 Å²	140.1	55%	0.545	74%	0.739	S	S	.	*			trans	-130.4	126.6	178.8	174.9	0	0	0	0	109.4
886	I	33.2	Very low	30.2	Very low	154 Å²	154	140.8 Å²	140.8	79%	0.79	74%	0.743	S	S	*	*			trans	67.5	89.7	173.3	-60.6	163.5	0	0	0	115.3
887	N	25.8	Very low	29.9	Very low	145 Å²	145	140.3 Å²	140.3	78%	0.775	74%	0.74	S	S	*	*			trans	-70.3	172.5	143.9	-69.9	-65.9	0	0	0	110.3
888	N	26.2	Very low	29.7	Very low	151 Å²	151	136.9 Å²	136.9	81%	0.807	73%	0.733	S	S	*	*			trans	83.8	90.2	164.7	-52.6	-23.7	0	0	0	118.2
889	S	32.6	Very low	29.7	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	74%	0.741	S	S	*	*				165.5	149.6	127.1	46.6	0	0	0	0	110.3
890	N	30.1	Very low	29.6	Very low	147 Å²	147	136.1 Å²	136.1	79%	0.786	73%	0.728	S	S	*	*			cis	-157.6	168.7	-21.9	-106.4	-24.5	0	0	0	108.9
891	S	33.1	Very low	29.3	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	73%	0.726	S	S	*	*			trans	59.1	118.6	157.7	48.5	0	0	0	0	121.7
892	N	26.6	Very low	29.4	Very low	127 Å²	127	135 Å²	135	68%	0.679	72%	0.718	S	S	*	*			trans	-27.4	159.4	140.2	-102.4	-19.1	0	0	0	116
893	P	32.8	Very low	29.3	Very low	118 Å²	118	135 Å²	135	77%	0.766	72%	0.719	S	S	*	*			cis	-121	164.4	37	13.6	11.1	0	0	0	115.1
894	Y	24.7	Very low	29.1	Very low	205 Å²	205	136.3 Å²	136.3	80%	0.804	72%	0.72	S	S	*	*			cis	80.4	102.7	43.6	-116.2	-88	0	0	0	116
895	G	26.6	Very low	29.2	Very low	58 Å²	58	135.2 Å²	135.2	60%	0.598	71%	0.71	S	S	*	*			trans	98	152.1	137.4	0	0	0	0	0	120.3
896	N	27.7	Very low	29.3	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	72%	0.718	S	S	*	*			trans	72.1	155.4	151.5	-53.1	-20.2	0	0	0	116.7
897	L	29	Very low	29	Very low	145 Å²	145	136.7 Å²	136.7	76%	0.759	71%	0.714	S	S	*	*			cis	-153.8	132.1	-16.8	-130.1	46	0	0	0	105.1
898	H	27.3	Very low	29.1	Very low	142 Å²	142	137.3 Å²	137.3	66%	0.657	71%	0.712	S	S	*	*				50.7	94	93.8	-154	-58.1	0	0	0	116.3	Q900	H898-Q900 PolarHBondContact CE1-OE1 2.97Å
899	H	32.2	Very low	29.5	Very low	154 Å²	154	137 Å²	137	71%	0.713	71%	0.709	S	S	*	*			trans	-175.1	131.6	136.2	-102.4	60.1	0	0	0	106.4
900	Q	30.8	Very low	29.5	Very low	117 Å²	117	139.9 Å²	139.9	55%	0.547	71%	0.711	S	S	.	*				59.5	136.7	65.8	-65.1	-177.9	-102.9	0	0	111.2	H898	H898-Q900 PolarHBondContact CE1-OE1 2.97Å
901	Q	28.1	Very low	29.6	Very low	138 Å²	138	141.1 Å²	141.1	65%	0.645	71%	0.712	S	S	*	*			cis	170.4	-171.3	-5.9	-112.2	171.8	-46.7	0	0	102.6
902	H	32	Very low	29.5	Very low	145 Å²	145	141.4 Å²	141.4	67%	0.671	71%	0.713	S	S	*	*			trans	68.4	136	172	-61.7	-92	0	0	0	116
903	E	31	Very low	30	Very low	138 Å²	138	140.4 Å²	140.4	65%	0.645	72%	0.717	S	S	*	*			cis	-153	148.4	-25.6	-124.3	161.6	-172.9	0	0	106.2
904	E	27.2	Very low	30.3	Very low	150 Å²	150	139.8 Å²	139.8	70%	0.701	72%	0.715	S	S	*	*				46.8	153.4	106.2	-70.7	-159.8	178.1	0	0	119.2
905	Q	28.8	Very low	30.9	Very low	143 Å²	143	137.4 Å²	137.4	67%	0.668	71%	0.711	S	S	*	*			trans	83.1	126.1	151.9	-80.3	166.2	61.1	0	0	119.9
906	M	29.1	Very low	31.5	Very low	145 Å²	145	143.8 Å²	143.8	71%	0.714	72%	0.718	S	S	*	*			trans	61	107.6	162	-46.9	-42.8	175.4	0	0	117
907	D	27.1	Very low	32.3	Very low	131 Å²	131	140 Å²	140	70%	0.701	71%	0.708	S	S	*	*				80.6	136.4	66.7	-89.9	-34.8	0	0	0	114.6
908	H	29.3	Very low	33	Very low	157 Å²	157	138.8 Å²	138.8	73%	0.727	70%	0.701	S	S	*	*			trans	64.9	133	159.7	-73.2	-60.9	0	0	0	120
909	L	33	Very low	33.6	Very low	145 Å²	145	136.8 Å²	136.8	76%	0.759	70%	0.695	S	S	*	*			trans	74.3	146	161.7	-48.3	143	0	0	0	114.6
910	Q	34.3	Very low	34.3	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	69%	0.69	S	S	*	*			cis	-149.7	174.7	-17	-128.1	163.7	-12.6	0	0	111
911	H	31	Very low	35	Very low	174 Å²	174	138 Å²	138	81%	0.806	70%	0.695	S	S	*	*			trans	-72.5	173.7	-171	-62	-41.2	0	0	0	115.8
912	S	30.7	Very low	36.4	Very low	118 Å²	118	134.2 Å²	134.2	83%	0.825	68%	0.682	S	S	*	*			trans	65.4	83.6	158.5	53.3	0	0	0	0	119
913	S	38.6	Very low	37.7	Very low	107 Å²	107	134 Å²	134	75%	0.748	68%	0.681	S	S	*	*	S	Bend	trans	-144.2	-37.9	158.4	-48	0	0	0	0	114.7	Q915	S913-Q915 PolarHBondContact O-N 3.47Å
914	S	38.9	Very low	38.9	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	68%	0.676	S	S	*	*	H	α-helix	trans	-83.8	-7.9	-160.4	52.7	0	0	0	0	117.8
915	Q	37.4	Very low	40.5	Very low	155 Å²	155	129.4 Å²	129.4	72%	0.724	67%	0.665	S	S	*	*	H	α-helix	trans	-82.5	-22.5	-178.7	-78.9	-171.4	-42.1	0	0	114.6	S913	S913-Q915 PolarHBondContact O-N 3.47Å
916	Y	39.3	Very low	41.6	Very low	193 Å²	193	129.6 Å²	129.6	76%	0.757	66%	0.664	S	S	*	*	H	α-helix	trans	-77.1	-46.4	-174.3	-79.3	-85.4	0	0	0	113.1	L918 N919 E920	Y916-L918 PolarHBondContact O-N 3.27Å; Y916-N919 PolarHBondContact O-N 2.84Å; Y916-N919 VanDerWaalsContact O-N 3.13Å; Y916-E920 PolarHBondContact O-N 2.83Å; Y916-E920 VanDerWaalsContact O-N 3.15Å
917	A	43.5	Very low	43.1	Very low	70 Å²	70	128.9 Å²	128.9	58%	0.579	66%	0.659	S	S	*	*	H	α-helix	trans	-59.8	-29.7	178.5	0	0	0	0	0	113.4	Y921	A917-Y921 PolarHBondContact O-N 3.25Å; A917-Y921 VanDerWaalsContact O-N 3.08Å
918	L	43	Very low	45	Very low	120 Å²	120	125.2 Å²	125.2	63%	0.628	65%	0.647	S	S	*	*	H	α-helix	trans	-79.6	-27.4	-179.2	-144.9	146.7	0	0	0	112.4	Y916 T922	Y916-L918 PolarHBondContact O-N 3.27Å; L918-T922 WeakPolarHBondContact O-CG2 3.24Å; L918-T922 PolarHBondContact O-N 3.18Å; L918-T922 PolarHBondContact O-OG1 3.48Å
919	N	39.6	Very low	46.5	Very low	100 Å²	100	121.9 Å²	121.9	54%	0.535	63%	0.634	S	S	.	*	H	α-helix	trans	-71.8	-40.2	168.9	-83.6	-1.8	0	0	0	111.9	Y916 T922 Q923	Y916-N919 PolarHBondContact O-N 2.84Å; Y916-N919 VanDerWaalsContact O-N 3.13Å; N919-T922 WeakPolarHBondContact CA-OG1 3.36Å; N919-T922 PolarHBondContact O-N 3.46Å; N919-T922 PolarHBondContact O-OG1 3.34Å; N919-T922 VanDerWaalsContact O-OG1 3.07Å; N919-Q923 WeakPolarHBondContact O-CB 3.41Å; N919-Q923 WeakPolarHBondContact O-CG 3.42Å; N919-Q923 PolarHBondContact O-N 2.78Å
920	E	47.3	Very low	48.3	Very low	127 Å²	127	119 Å²	119	59%	0.593	62%	0.62	S	S	*	*	H	α-helix	trans	-65.1	-44.4	177.2	-171.4	169.7	-160.2	0	0	111.4	Y916 T922 Q923 N924	Y916-E920 PolarHBondContact O-N 2.83Å; Y916-E920 VanDerWaalsContact O-N 3.15Å; E920-T922 VanDerWaalsContact C-N 3.3Å; E920-T922 PolarHBondContact O-N 3.47Å; E920-Q923 PolarHBondContact O-N 3.1Å; E920-N924 WeakPolarHBondContact O-CB 3.45Å; E920-N924 PolarHBondContact O-N 3.43Å; E920-N924 PolarHBondContact O-ND2 3.13Å
921	Y	45.8	Very low	50	Low	170 Å²	170	116.6 Å²	116.6	67%	0.667	61%	0.612	S	S	*	*	H	α-helix	trans	-63.5	-34.6	175.7	-152.5	-83.7	0	0	0	112.6	A917 L925	A917-Y921 PolarHBondContact O-N 3.25Å; A917-Y921 VanDerWaalsContact O-N 3.08Å; Y921-L925 HydrophobicContact CD1-CD1 4.29Å; Y921-L925 HydrophobicContact CE1-CD1 3.96Å; Y921-L925 WeakPolarHBondContact O-CB 3.34Å; Y921-L925 PolarHBondContact O-N 2.98Å
922	T	57.1	Low	51.8	Low	59 Å²	59	111.9 Å²	111.9	36%	0.362	59%	0.592	S	S	.	*	H	α-helix	trans	-78.2	-35.2	177.2	45.8	0	0	0	0	113.1	L918 N919 E920 L925 F926	L918-T922 WeakPolarHBondContact O-CG2 3.24Å; L918-T922 PolarHBondContact O-N 3.18Å; L918-T922 PolarHBondContact O-OG1 3.48Å; N919-T922 WeakPolarHBondContact CA-OG1 3.36Å; N919-T922 PolarHBondContact O-N 3.46Å; N919-T922 PolarHBondContact O-OG1 3.34Å; N919-T922 VanDerWaalsContact O-OG1 3.07Å; E920-T922 VanDerWaalsContact C-N 3.3Å; E920-T922 PolarHBondContact O-N 3.47Å; T922-L925 PolarHBondContact O-N 3.15Å; T922-F926 WeakPolarHBondContact O-CD2 3.47Å; T922-F926 PolarHBondContact O-N 3.14Å
923	Q	60	Low	52.9	Low	139 Å²	139	112.4 Å²	112.4	65%	0.65	58%	0.583	S	S	*	*	H	α-helix	trans	-63.3	-44	170.7	-78	-175.5	-32.9	0	0	111.6	N919 E920 L925 F926 H927	N919-Q923 WeakPolarHBondContact O-CB 3.41Å; N919-Q923 WeakPolarHBondContact O-CG 3.42Å; N919-Q923 PolarHBondContact O-N 2.78Å; E920-Q923 PolarHBondContact O-N 3.1Å; Q923-L925 VanDerWaalsContact C-N 3.3Å; Q923-L925 PolarHBondContact O-N 2.79Å; Q923-F926 PolarHBondContact O-N 3.01Å; Q923-F926 VanDerWaalsContact O-N 3.14Å; Q923-H927 PolarHBondContact O-N 3.2Å
924	N	56.4	Low	54.2	Low	102 Å²	102	111.4 Å²	111.4	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-63.3	-35.8	174.4	-71.2	-26.7	0	0	0	111.9	E920 A928	E920-N924 WeakPolarHBondContact O-CB 3.45Å; E920-N924 PolarHBondContact O-N 3.43Å; E920-N924 PolarHBondContact O-ND2 3.13Å; N924-A928 VanDerWaalsContact O-CB 3.26Å; N924-A928 WeakPolarHBondContact O-CB 3.24Å; N924-A928 PolarHBondContact O-N 3.3Å
925	L	59.4	Low	55.2	Low	90 Å²	90	109.7 Å²	109.7	47%	0.471	55%	0.552	S	S	.	*	H	α-helix	trans	-66.1	-38.8	171.8	-129.3	77	0	0	0	112.7	Y921 T922 Q923 N929	Y921-L925 HydrophobicContact CD1-CD1 4.29Å; Y921-L925 HydrophobicContact CE1-CD1 3.96Å; Y921-L925 WeakPolarHBondContact O-CB 3.34Å; Y921-L925 PolarHBondContact O-N 2.98Å; T922-L925 PolarHBondContact O-N 3.15Å; Q923-L925 VanDerWaalsContact C-N 3.3Å; Q923-L925 PolarHBondContact O-N 2.79Å; L925-N929 PolarHBondContact O-N 3.48Å; L925-N929 PolarHBondContact O-ND2 2.91Å
926	F	53.2	Low	56.8	Low	147 Å²	147	106.6 Å²	106.6	65%	0.645	54%	0.537	S	S	*	.	H	α-helix	trans	-63.9	-52	175.7	-97.5	-81.2	0	0	0	111.1	T922 Q923 A928 N929 D930	T922-F926 WeakPolarHBondContact O-CD2 3.47Å; T922-F926 PolarHBondContact O-N 3.14Å; Q923-F926 PolarHBondContact O-N 3.01Å; Q923-F926 VanDerWaalsContact O-N 3.14Å; F926-A928 VanDerWaalsContact C-N 3.31Å; F926-A928 PolarHBondContact O-N 3.39Å; F926-N929 CarbonylContact O-C 3.59Å; F926-N929 WeakPolarHBondContact O-CA 3.28Å; F926-N929 PolarHBondContact O-N 3.47Å; F926-D930 PolarHBondContact O-N 3.26Å
927	H	60	Low	57.8	Low	130 Å²	130	103.5 Å²	103.5	60%	0.602	53%	0.528	S	S	*	.	H	α-helix	trans	-61.4	-35.2	176.4	-94	4.7	0	0	0	113.7	Q923 N929 D930 L931	Q923-H927 PolarHBondContact O-N 3.2Å; H927-N929 VanDerWaalsContact C-N 3.32Å; H927-N929 PolarHBondContact O-N 3.04Å; H927-D930 IonicContact ND1-OD2 3.63Å; H927-D930 PolarHBondContact O-N 3.24Å; H927-L931 WeakPolarHBondContact O-CB 3.47Å; H927-L931 WeakPolarHBondContact O-CG 3.34Å; H927-L931 PolarHBondContact O-N 2.87Å
928	A	68.2	Low	58.7	Low	55 Å²	55	105.1 Å²	105.1	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-63.8	-36.9	172.6	0	0	0	0	0	112.4	N924 F926 L932	N924-A928 VanDerWaalsContact O-CB 3.26Å; N924-A928 WeakPolarHBondContact O-CB 3.24Å; N924-A928 PolarHBondContact O-N 3.3Å; F926-A928 VanDerWaalsContact C-N 3.31Å; F926-A928 PolarHBondContact O-N 3.39Å; A928-L932 VanDerWaalsContact O-CB 3.3Å; A928-L932 WeakPolarHBondContact O-CB 3.37Å; A928-L932 PolarHBondContact O-N 3.24Å
929	N	60.6	Low	59.6	Low	86 Å²	86	104.9 Å²	104.9	46%	0.46	53%	0.526	S	S	.	.	H	α-helix	trans	-73.4	-38.1	174.6	-79.4	-79.6	0	0	0	112.4	L925 F926 H927 L932 M933	L925-N929 PolarHBondContact O-N 3.48Å; L925-N929 PolarHBondContact O-ND2 2.91Å; F926-N929 CarbonylContact O-C 3.59Å; F926-N929 WeakPolarHBondContact O-CA 3.28Å; F926-N929 PolarHBondContact O-N 3.47Å; H927-N929 VanDerWaalsContact C-N 3.32Å; H927-N929 PolarHBondContact O-N 3.04Å; N929-L932 PolarHBondContact O-N 3.49Å; N929-M933 WeakPolarHBondContact O-CB 3.32Å; N929-M933 VanDerWaalsContact O-CG 3.29Å; N929-M933 WeakPolarHBondContact O-CG 3.31Å; N929-M933 PolarHBondContact O-N 3.26Å
930	D	69	Low	59.7	Low	86 Å²	86	102.4 Å²	102.4	46%	0.46	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-46.1	174.8	-65.2	-36.1	0	0	0	110.8	F926 H927 L932 M933 E934	F926-D930 PolarHBondContact O-N 3.26Å; H927-D930 IonicContact ND1-OD2 3.63Å; H927-D930 PolarHBondContact O-N 3.24Å; D930-L932 VanDerWaalsContact C-N 3.32Å; D930-L932 PolarHBondContact O-N 2.82Å; D930-M933 PolarHBondContact O-N 2.97Å; D930-E934 WeakPolarHBondContact O-CB 3.48Å; D930-E934 PolarHBondContact O-N 3.21Å
931	L	70.2	Confident	59.3	Low	116 Å²	116	102.1 Å²	102.1	61%	0.607	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-35.6	174	-75.5	165.9	0	0	0	112.5	H927 T935	H927-L931 WeakPolarHBondContact O-CB 3.47Å; H927-L931 WeakPolarHBondContact O-CG 3.34Å; H927-L931 PolarHBondContact O-N 2.87Å; L931-T935 WeakPolarHBondContact O-CB 3.38Å; L931-T935 WeakPolarHBondContact O-CG2 3.45Å; L931-T935 PolarHBondContact O-N 3.21Å; L931-T935 PolarHBondContact O-OG1 2.96Å
932	L	68.8	Low	58.9	Low	76 Å²	76	99.6 Å²	99.6	40%	0.398	52%	0.522	S	S	.	.	H	α-helix	trans	-68.1	-37.7	174.3	-171.2	66.5	0	0	0	111.9	A928 N929 D930 T935 Q936	A928-L932 VanDerWaalsContact O-CB 3.3Å; A928-L932 WeakPolarHBondContact O-CB 3.37Å; A928-L932 PolarHBondContact O-N 3.24Å; N929-L932 PolarHBondContact O-N 3.49Å; D930-L932 VanDerWaalsContact C-N 3.32Å; D930-L932 PolarHBondContact O-N 2.82Å; L932-T935 WeakPolarHBondContact CA-OG1 3.24Å; L932-T935 PolarHBondContact O-OG1 2.72Å; L932-T935 VanDerWaalsContact O-OG1 3.11Å; L932-Q936 WeakPolarHBondContact O-CB 3.47Å; L932-Q936 WeakPolarHBondContact O-CG 3.42Å; L932-Q936 PolarHBondContact O-N 3.06Å
933	M	54.3	Low	57.9	Low	128 Å²	128	106.2 Å²	106.2	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-68.7	-43.4	174.9	-72.9	-73.3	-71.3	0	0	111.7	N929 D930 Q936 K937	N929-M933 WeakPolarHBondContact O-CB 3.32Å; N929-M933 VanDerWaalsContact O-CG 3.29Å; N929-M933 WeakPolarHBondContact O-CG 3.31Å; N929-M933 PolarHBondContact O-N 3.26Å; D930-M933 PolarHBondContact O-N 2.97Å; M933-Q936 PolarHBondContact O-N 2.71Å; M933-K937 VanDerWaalsContact O-CB 3.24Å; M933-K937 WeakPolarHBondContact O-CB 3.42Å; M933-K937 PolarHBondContact O-N 3.44Å
934	E	65.4	Low	56.5	Low	87 Å²	87	104.2 Å²	104.2	41%	0.407	54%	0.536	S	S	.	.	H	α-helix	trans	-66.5	-39.3	178	-159.7	63.7	-123.5	0	0	111.2	D930 K937 N938	D930-E934 WeakPolarHBondContact O-CB 3.48Å; D930-E934 PolarHBondContact O-N 3.21Å; E934-K937 PolarHBondContact O-N 2.9Å; E934-K937 WeakPolarHBondContact OE1-CD 3.45Å; E934-K937 VanDerWaalsContact OE1-CE 3.31Å; E934-K937 WeakPolarHBondContact OE1-CE 3.2Å; E934-K937 IonicContact OE1-NZ 2.52Å; E934-K937 PolarHBondContact OE1-NZ 2.72Å; E934-K937 IonicContact OE2-NZ 3.73Å; E934-K937 PolarHBondContact OE2-NZ 2.99Å; E934-N938 WeakPolarHBondContact O-CB 3.49Å; E934-N938 PolarHBondContact O-N 3.49Å; E934-N938 PolarHBondContact O-ND2 2.89Å; E934-N938 VanDerWaalsContact O-ND2 3.09Å
935	T	60.7	Low	55.4	Low	67 Å²	67	103.8 Å²	103.8	41%	0.411	54%	0.539	S	S	.	.	H	α-helix	trans	-69.5	-39.8	173.1	48.7	0	0	0	0	113.1	L931 L932 K937 N938 L939	L931-T935 WeakPolarHBondContact O-CB 3.38Å; L931-T935 WeakPolarHBondContact O-CG2 3.45Å; L931-T935 PolarHBondContact O-N 3.21Å; L931-T935 PolarHBondContact O-OG1 2.96Å; L932-T935 WeakPolarHBondContact CA-OG1 3.24Å; L932-T935 PolarHBondContact O-OG1 2.72Å; L932-T935 VanDerWaalsContact O-OG1 3.11Å; T935-K937 VanDerWaalsContact C-N 3.33Å; T935-K937 PolarHBondContact O-N 2.74Å; T935-N938 PolarHBondContact O-N 3.4Å; T935-L939 VanDerWaalsContact O-CB 3.32Å; T935-L939 WeakPolarHBondContact O-CB 3.29Å; T935-L939 VanDerWaalsContact O-CG 3.25Å; T935-L939 WeakPolarHBondContact O-CG 2.9Å; T935-L939 PolarHBondContact O-N 2.68Å
936	Q	70.1	Confident	54.2	Low	91 Å²	91	106.3 Å²	106.3	43%	0.425	54%	0.543	S	S	.	.	H	α-helix	trans	-62	-39.5	173.5	-76.9	175.8	23	0	0	112.6	L932 M933 L941	L932-Q936 WeakPolarHBondContact O-CB 3.47Å; L932-Q936 WeakPolarHBondContact O-CG 3.42Å; L932-Q936 PolarHBondContact O-N 3.06Å; M933-Q936 PolarHBondContact O-N 2.71Å; Q936-L941 PolarHBondContact O-N 3.38Å
937	K	61.5	Low	53.1	Low	128 Å²	128	105.3 Å²	105.3	56%	0.557	54%	0.536	S	S	*	.	H	α-helix	trans	-62.6	-43.5	172.9	172.2	-176.4	164.8	-156.3	0	111.9	M933 E934 T935	M933-K937 VanDerWaalsContact O-CB 3.24Å; M933-K937 WeakPolarHBondContact O-CB 3.42Å; M933-K937 PolarHBondContact O-N 3.44Å; E934-K937 PolarHBondContact O-N 2.9Å; E934-K937 WeakPolarHBondContact OE1-CD 3.45Å; E934-K937 VanDerWaalsContact OE1-CE 3.31Å; E934-K937 WeakPolarHBondContact OE1-CE 3.2Å; E934-K937 IonicContact OE1-NZ 2.52Å; E934-K937 PolarHBondContact OE1-NZ 2.72Å; E934-K937 IonicContact OE2-NZ 3.73Å; E934-K937 PolarHBondContact OE2-NZ 2.99Å; T935-K937 VanDerWaalsContact C-N 3.33Å; T935-K937 PolarHBondContact O-N 2.74Å
938	N	63	Low	51.7	Low	104 Å²	104	106.1 Å²	106.1	56%	0.556	54%	0.535	S	S	*	.	H	α-helix	trans	-75.9	-25.7	179.5	-69.7	-27.9	0	0	0	114.1	E934 T935 G940	E934-N938 WeakPolarHBondContact O-CB 3.49Å; E934-N938 PolarHBondContact O-N 3.49Å; E934-N938 PolarHBondContact O-ND2 2.89Å; E934-N938 VanDerWaalsContact O-ND2 3.09Å; T935-N938 PolarHBondContact O-N 3.4Å; N938-G940 VanDerWaalsContact C-N 3.3Å; N938-G940 PolarHBondContact O-N 2.91Å
939	L	61.9	Low	50	Low	115 Å²	115	109.2 Å²	109.2	60%	0.602	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-1	177.5	-74.9	167.5	0	0	0	114.1	T935 L941	T935-L939 VanDerWaalsContact O-CB 3.32Å; T935-L939 WeakPolarHBondContact O-CB 3.29Å; T935-L939 VanDerWaalsContact O-CG 3.25Å; T935-L939 WeakPolarHBondContact O-CG 2.9Å; T935-L939 PolarHBondContact O-N 2.68Å; L939-L941 HydrophobicContact CB-CD1 3.99Å; L939-L941 HydrophobicContact CB-CG 4.08Å; L939-L941 HydrophobicContact CD1-CD1 4.3Å; L939-L941 PolarHBondContact O-N 3.29Å; L939-L941 VanDerWaalsContact O-N 3.14Å
940	G	39.9	Very low	49.1	Very low	47 Å²	47	112.5 Å²	112.5	49%	0.485	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	67.2	9.7	-178.6	0	0	0	0	0	114.6	N938 I942	N938-G940 VanDerWaalsContact C-N 3.3Å; N938-G940 PolarHBondContact O-N 2.91Å; G940-I942 PolarHBondContact O-N 3.37Å
941	L	40.1	Very low	47.8	Very low	122 Å²	122	113.4 Å²	113.4	64%	0.639	56%	0.563	S	S	*	*			trans	-78.7	38.8	-174.5	-71.4	172.8	0	0	0	113.4	Q936 L939 K943	Q936-L941 PolarHBondContact O-N 3.38Å; L939-L941 HydrophobicContact CB-CD1 3.99Å; L939-L941 HydrophobicContact CB-CG 4.08Å; L939-L941 HydrophobicContact CD1-CD1 4.3Å; L939-L941 PolarHBondContact O-N 3.29Å; L939-L941 VanDerWaalsContact O-N 3.14Å; L941-K943 VanDerWaalsContact C-N 3.27Å; L941-K943 PolarHBondContact O-N 3.42Å
942	I	36.2	Very low	46.7	Very low	117 Å²	117	112 Å²	112	60%	0.6	55%	0.553	S	S	*	*			trans	-76.6	77.5	178.4	-51.2	-179.8	0	0	0	109.6	G940 H944	G940-I942 PolarHBondContact O-N 3.37Å; I942-H944 PolarHBondContact O-N 3.45Å; I942-H944 VanDerWaalsContact O-N 3.09Å
943	K	36.8	Very low	45.6	Very low	198 Å²	198	114.8 Å²	114.8	86%	0.861	56%	0.564	S	S	*	*			trans	-67.5	103.6	158.4	-81.2	-173.2	175.2	177	0	107.8	L941 P945	L941-K943 VanDerWaalsContact C-N 3.27Å; L941-K943 PolarHBondContact O-N 3.42Å; K943-P945 WeakPolarHBondContact O-CD 3.37Å
944	H	30.9	Very low	45	Very low	97 Å²	97	112 Å²	112	45%	0.449	55%	0.549	S	S	.	.			trans	-54.5	117.9	-165.3	-135.6	-62	0	0	0	112.2	P420 I942	P420-H944 WeakPolarHBondContact CD-CE1 3.49Å; I942-H944 PolarHBondContact O-N 3.45Å; I942-H944 VanDerWaalsContact O-N 3.09Å
945	P	34.1	Very low	44.1	Very low	93 Å²	93	114.2 Å²	114.2	60%	0.604	56%	0.56	S	S	*	*			trans	-92.2	131.5	-167.8	33	-34.1	0	0	0	112.6	K943	K943-P945 WeakPolarHBondContact O-CD 3.37Å
946	Y	34.3	Very low	43.4	Very low	142 Å²	142	115.8 Å²	115.8	56%	0.557	56%	0.562	S	S	*	*			trans	-147.4	130.7	149.9	-96.9	-68.7	0	0	0	109.9
947	Y	29.8	Very low	41.9	Very low	126 Å²	126	119.2 Å²	119.2	49%	0.494	58%	0.578	S	S	.	*	S	Bend	trans	58.5	70.4	169.1	-70.3	-79.5	0	0	0	119.4	K455 D456	K455-Y947 HydrophobicContact CD-CE2 4.41Å; K455-Y947 VanDerWaalsContact CE-CE2 3.41Å; K455-Y947 VanDerWaalsContact CE-CZ 3.42Å; K455-Y947 WeakPolarHBondContact CE-OH 3.38Å; K455-Y947 HydrophobicContact CG-CE2 4.04Å; K455-Y947 PolarHBondContact NZ-OH 2.78Å; K455-Y947 VanDerWaalsContact NZ-OH 3.09Å; D456-Y947 VanDerWaalsContact OD1-CD1 3.29Å; D456-Y947 WeakPolarHBondContact OD1-CD1 3.42Å; D456-Y947 VanDerWaalsContact OD1-CE1 3.31Å; D456-Y947 WeakPolarHBondContact OD1-CE1 3.27Å
948	Y	30.6	Very low	40.8	Very low	147 Å²	147	120.9 Å²	120.9	58%	0.576	59%	0.588	S	S	*	*			trans	-151.4	11.2	150.5	-141.5	-108.1	0	0	0	119.2	Q952	Y948-Q952 HydrophobicContact CE1-CG 4.43Å
949	T	32.9	Very low	39.2	Very low	120 Å²	120	126.2 Å²	126.2	74%	0.736	60%	0.6	S	S	*	*	S	Bend	trans	-93.6	-35.2	-178	42.4	0	0	0	0	115	Q951	T949-Q951 PolarHBondContact O-N 2.85Å
950	Q	39.7	Very low	37.8	Very low	155 Å²	155	130 Å²	130	72%	0.724	62%	0.615	S	S	*	*	H	α-helix	trans	-71.3	-25	-173.2	-156.5	170.1	39.9	0	0	114.1
951	Q	43	Very low	37.4	Very low	106 Å²	106	130.7 Å²	130.7	50%	0.495	62%	0.622	S	S	.	*	H	α-helix	trans	-87.3	-7.7	-176.3	-159	171.7	80.3	0	0	114.3	T949 Q955	T949-Q951 PolarHBondContact O-N 2.85Å; Q951-Q955 PolarHBondContact O-NE2 3.12Å
952	Q	47.2	Very low	37.2	Very low	86 Å²	86	131.1 Å²	131.1	40%	0.402	63%	0.632	S	S	.	*	H	α-helix	trans	-91.9	-34.4	174.2	-68.1	-161.3	-1.8	0	0	113.2	Y948 Q955	Y948-Q952 HydrophobicContact CE1-CG 4.43Å; Q952-Q955 PolarHBondContact O-N 3.21Å
953	Q	44.5	Very low	36.7	Very low	134 Å²	134	136.5 Å²	136.5	63%	0.626	65%	0.646	S	S	*	*	H	α-helix	trans	-68.7	-35.8	179.5	-70.6	-179.9	-18.2	0	0	112.8	Q955 Q956	Q953-Q955 PolarHBondContact O-N 3.14Å; Q953-Q956 PolarHBondContact O-N 3.48Å; Q953-Q956 VanDerWaalsContact O-N 3.08Å
954	Q	42.5	Very low	36.3	Very low	71 Å²	71	132.3 Å²	132.3	33%	0.332	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	-24.2	177	-72.5	-174.6	-26.8	0	0	113.7	N640 Q956	N640-Q954 PolarHBondContact ND2-OE1 2.83Å; N640-Q954 VanDerWaalsContact ND2-OE1 3.08Å; Q954-Q956 VanDerWaalsContact C-N 3.3Å; Q954-Q956 PolarHBondContact O-N 3.13Å
955	Q	47.3	Very low	36.3	Very low	133 Å²	133	137.1 Å²	137.1	62%	0.621	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-4.8	177.1	-79.2	172	75.4	0	0	114	Q951 Q952 Q953	Q951-Q955 PolarHBondContact O-NE2 3.12Å; Q952-Q955 PolarHBondContact O-N 3.21Å; Q953-Q955 PolarHBondContact O-N 3.14Å
956	Q	44.2	Very low	36.3	Very low	99 Å²	99	139.9 Å²	139.9	46%	0.463	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	-27	174.8	-67.1	-173.1	-15.7	0	0	113.3	F757 Q953 Q954 Q958	F757-Q956 HydrophobicContact CE2-CG 3.77Å; F757-Q956 HydrophobicContact CZ-CG 3.83Å; Q953-Q956 PolarHBondContact O-N 3.48Å; Q953-Q956 VanDerWaalsContact O-N 3.08Å; Q954-Q956 VanDerWaalsContact C-N 3.3Å; Q954-Q956 PolarHBondContact O-N 3.13Å; Q956-Q958 PolarHBondContact O-N 3.02Å
957	Q	40.1	Very low	36.2	Very low	163 Å²	163	139 Å²	139	76%	0.762	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-10.7	-171.4	-66.8	-175	-7.4	0	0	115.2	R959	Q957-R959 VanDerWaalsContact C-N 3.27Å; Q957-R959 PolarHBondContact O-N 3.14Å
958	Q	36.9	Very low	36.3	Very low	163 Å²	163	137.8 Å²	137.8	76%	0.762	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	13	171.6	-65.8	-168.8	4.2	0	0	114.2	Q956	Q956-Q958 PolarHBondContact O-N 3.02Å
959	R	30.2	Very low	36.3	Very low	217 Å²	217	136.3 Å²	136.3	82%	0.819	70%	0.702	S	S	*	*	S	Bend	trans	-124.4	58.8	169.6	-65.9	-139.8	-54.1	-156.7	2.5	113.5	Q957	Q957-R959 VanDerWaalsContact C-N 3.27Å; Q957-R959 PolarHBondContact O-N 3.14Å
960	Q	33.2	Very low	36.1	Very low	195 Å²	195	138.4 Å²	138.4	91%	0.911	70%	0.704	S	S	*	*			trans	-160	91.9	152.4	-109.7	146.1	102.7	0	0	112.2
961	G	31.8	Very low	35.7	Very low	61 Å²	61	139.2 Å²	139.2	63%	0.629	71%	0.707	S	S	*	*	S	Bend	trans	-121.6	144	157	0	0	0	0	0	107.4	Y963	G961-Y963 PolarHBondContact O-N 3.49Å
962	P	34.7	Very low	34.8	Very low	131 Å²	131	143.5 Å²	143.5	85%	0.851	72%	0.72	S	S	*	*			trans	-71.5	130.6	-148.5	24.1	-34.5	0	0	0	115
963	Y	26.7	Very low	34.1	Very low	229 Å²	229	147.8 Å²	147.8	90%	0.898	74%	0.74	S	S	*	*			trans	-63	138.2	153.6	-84.3	-93.7	0	0	0	109.9	G961	G961-Y963 PolarHBondContact O-N 3.49Å
964	C	28.6	Very low	33.1	Very low	110 Å²	110	145.6 Å²	145.6	74%	0.743	74%	0.739	S	S	*	*			trans	-154.6	115.3	158.1	-97.7	0	0	0	0	110.7
965	F	31	Very low	32.7	Very low	198 Å²	198	149.5 Å²	149.5	87%	0.868	76%	0.763	S	S	*	*			trans	61	93.3	153.9	-63	-78.4	0	0	0	121.1
966	L	32.4	Very low	31.7	Very low	152 Å²	152	150.4 Å²	150.4	80%	0.796	77%	0.772	S	S	*	*				-43.4	175.3	127.8	-75.6	158.4	0	0	0	113.5
967	P	33.2	Very low	31.2	Very low	122 Å²	122	153.1 Å²	153.1	79%	0.792	78%	0.784	S	S	*	*			cis	-137.2	179.9	17.3	32.1	-8.2	0	0	0	117.9
968	S	31.6	Very low	30.9	Very low	101 Å²	101	153.7 Å²	153.7	71%	0.706	79%	0.787	S	S	*	*			trans	-73.7	163.5	177.2	-34.2	0	0	0	0	115
969	S	30.8	Very low	30.6	Very low	116 Å²	116	150 Å²	150	81%	0.811	78%	0.779	S	S	*	*				-179.3	-178.6	111.1	47.3	0	0	0	0	113.5
970	H	29	Very low	30.8	Very low	165 Å²	165	148.1 Å²	148.1	76%	0.764	78%	0.78	S	S	*	*			trans	-66.9	172.1	-172.8	-64.1	-97.6	0	0	0	112.6
971	Q	30	Very low	30.8	Very low	172 Å²	172	147.3 Å²	147.3	80%	0.804	78%	0.776	S	S	*	*			cis	-164.8	176.7	40.6	-148.3	140	-54.3	0	0	114.8
972	Y	25.4	Very low	30.7	Very low	195 Å²	195	149.8 Å²	149.8	77%	0.765	78%	0.779	S	S	*	*			trans	-37.5	140.5	179.2	-77.8	-107.7	0	0	0	118.6
973	H	31.2	Very low	30.7	Very low	177 Å²	177	151.6 Å²	151.6	82%	0.819	78%	0.776	S	S	*	*				168	124.4	123.3	-96.8	-90	0	0	0	106.5
974	S	25.3	Very low	31	Very low	87 Å²	87	147.9 Å²	147.9	61%	0.608	77%	0.767	S	S	*	*				76.5	84.1	51.8	-60.1	0	0	0	0	113.7
975	D	33.8	Very low	31.2	Very low	154 Å²	154	149.8 Å²	149.8	82%	0.824	76%	0.763	S	S	*	*			trans	174.7	125.3	152.1	-88.2	-21.5	0	0	0	107
976	N	25.7	Very low	31.1	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	76%	0.757	S	S	*	*			cis	82.1	71.1	7.1	-158.6	36.7	0	0	0	118.3
977	Q	34.2	Very low	31.1	Very low	157 Å²	157	151.3 Å²	151.3	73%	0.734	76%	0.759	S	S	*	*			trans	-149.7	122.6	156.1	-111.5	169.3	56.4	0	0	112.4
978	Q	32.9	Very low	30.8	Very low	175 Å²	175	153.9 Å²	153.9	82%	0.818	76%	0.76	S	S	*	*			trans	58.2	150.6	135.4	-74	164.8	-0.8	0	0	120.1
979	S	31.9	Very low	30.6	Very low	86 Å²	86	157.2 Å²	157.2	60%	0.601	77%	0.765	S	S	*	*			cis	-158.5	142.2	6.5	42.7	0	0	0	0	112.2
980	Q	33.7	Very low	30.3	Very low	176 Å²	176	158.9 Å²	158.9	82%	0.822	76%	0.762	S	S	*	*			trans	59.4	156.3	139.3	-62.2	160.1	-18.4	0	0	118.3
981	E	33	Very low	30.2	Very low	178 Å²	178	157.5 Å²	157.5	83%	0.832	76%	0.76	S	S	*	*			cis	-127.9	136.2	4.3	-62.5	170.3	125.9	0	0	108
982	T	29.7	Very low	30	Very low	114 Å²	114	154 Å²	154	70%	0.699	75%	0.754	S	S	*	*				54.9	98.9	65.2	56.1	0	0	0	0	117.2
983	Q	34.3	Very low	30.2	Very low	168 Å²	168	150.2 Å²	150.2	79%	0.785	76%	0.756	S	S	*	*				173.2	146.1	107.8	-92.5	176.9	25.8	0	0	114.4
984	H	33.2	Very low	30.1	Very low	151 Å²	151	147.5 Å²	147.5	70%	0.699	76%	0.755	S	S	*	*			trans	60.3	147.3	154.9	-76	-131.4	0	0	0	119.2
985	F	32.6	Very low	30.2	Very low	151 Å²	151	152.9 Å²	152.9	66%	0.662	77%	0.767	S	S	*	*			cis	-158.9	125.5	-12.2	-134	-138.8	0	0	0	103.8
986	Q	30.3	Very low	29.8	Very low	162 Å²	162	151.3 Å²	151.3	76%	0.757	77%	0.768	S	S	*	*			cis	88.2	135.2	40.8	-157.9	171.4	18.4	0	0	113.9
987	R	31	Very low	29.8	Very low	220 Å²	220	149 Å²	149	83%	0.83	76%	0.762	S	S	*	*			trans	83.2	117.9	-163.6	-55.7	173.6	177.6	-125.6	-3.2	112.8
988	Q	27.1	Very low	29.6	Very low	175 Å²	175	148.3 Å²	148.3	82%	0.818	76%	0.764	S	S	*	*			cis	85.4	143.6	31.7	-60.1	-176.5	-17.4	0	0	115.4
989	Q	27.9	Very low	29.2	Very low	171 Å²	171	146.7 Å²	146.7	80%	0.799	76%	0.761	S	S	*	*			trans	73.2	144.5	-172.4	-49.2	176.5	7.2	0	0	112.3
990	M	25.3	Very low	29	Very low	152 Å²	152	148.6 Å²	148.6	75%	0.749	76%	0.763	S	S	*	*			cis	-128.9	176.9	14.3	-83.6	-68	-170.3	0	0	114.1
991	N	25.6	Very low	28.4	Very low	136 Å²	136	151.3 Å²	151.3	73%	0.727	77%	0.768	S	S	*	*			trans	-69.9	170.2	-179.4	-49.1	-45.1	0	0	0	115.2
992	S	25.8	Very low	27.9	Very low	98 Å²	98	146.4 Å²	146.4	69%	0.685	75%	0.753	S	S	*	*			trans	62	145.6	141.6	58.2	0	0	0	0	121.5
993	S	30.6	Very low	27.7	Very low	115 Å²	115	147.6 Å²	147.6	80%	0.804	75%	0.754	S	S	*	*			trans	-47.6	154	169.3	-46.9	0	0	0	0	114
994	P	27.8	Very low	27.3	Very low	121 Å²	121	145.5 Å²	145.5	79%	0.786	75%	0.749	S	S	*	*				-139.9	178.8	97	40.6	-30.8	0	0	0	115.1
995	K	27.9	Very low	27	Very low	200 Å²	200	143.5 Å²	143.5	87%	0.87	75%	0.747	S	S	*	*			trans	-62.2	142.4	161.4	-45.9	155.8	-176.5	168.8	0	109.4
996	S	25.6	Very low	26.9	Very low	120 Å²	120	142.5 Å²	142.5	84%	0.839	75%	0.749	S	S	*	*				-177.1	171.9	117.7	64	0	0	0	0	111.6
997	C	25.5	Very low	26.7	Very low	102 Å²	102	141 Å²	141	69%	0.689	75%	0.745	S	S	*	*			trans	-101	168.9	174.9	-50.6	0	0	0	0	111.1
998	N	29.6	Very low	26.4	Very low	143 Å²	143	137 Å²	137	77%	0.765	74%	0.739	S	S	*	*			trans	70.6	140.1	155.1	-51.9	-19	0	0	0	118.5
999	N	25.9	Very low	26.3	Very low	142 Å²	142	135.8 Å²	135.8	76%	0.759	73%	0.729	S	S	*	*				158.3	149.2	121.1	-78.3	-10.1	0	0	0	110.4
1000	L	26	Very low	26.2	Very low	125 Å²	125	132.7 Å²	132.7	65%	0.654	72%	0.722	S	S	*	*			cis	-158.6	123.4	-19.2	-115.5	167.2	0	0	0	109	S1002	L1000-S1002 VanDerWaalsContact CD2-N 3.28Å
1001	Y	22.4	Very low	26.3	Very low	234 Å²	234	130.8 Å²	130.8	92%	0.918	72%	0.722	S	S	*	*				-119.6	111.4	129.6	-87.8	-96.3	0	0	0	103.2
1002	S	22.9	Very low	26.3	Very low	75 Å²	75	130 Å²	130	52%	0.524	72%	0.718	S	S	.	*				71	112.3	64.4	-158.5	0	0	0	0	108.8	L1000	L1000-S1002 VanDerWaalsContact CD2-N 3.28Å
1003	L	24.6	Very low	26.3	Very low	138 Å²	138	130.9 Å²	130.9	72%	0.723	72%	0.715	S	S	*	*			cis	-135.3	168.6	17.3	-78.7	93.9	0	0	0	114
1004	D	26.4	Very low	26.1	Very low	124 Å²	124	132 Å²	132	66%	0.663	71%	0.712	S	S	*	*			trans	59.8	112.9	142.6	-63	-8.5	0	0	0	120.9
1005	T	27.3	Very low	26.1	Very low	109 Å²	109	130.4 Å²	130.4	67%	0.669	70%	0.704	S	S	*	*				60.4	128.2	86.6	72.4	0	0	0	0	114
1006	N	29.6	Very low	26	Very low	131 Å²	131	129.6 Å²	129.6	70%	0.701	70%	0.703	S	S	*	*			cis	-148.8	156.7	44.2	-80.5	-78.6	0	0	0	115.8
1007	L	26.8	Very low	26	Very low	130 Å²	130	128 Å²	128	68%	0.681	69%	0.692	S	S	*	*			trans	17.6	132.8	142.2	-69.5	97.1	0	0	0	120.2
1008	L	24.7	Very low	26.1	Very low	135 Å²	135	130 Å²	130	71%	0.707	69%	0.693	S	S	*	*				69.8	153.3	64.8	-66.4	164.9	0	0	0	113.4
1009	Y	24.6	Very low	26.1	Very low	150 Å²	150	130 Å²	130	59%	0.588	69%	0.688	S	S	*	*			cis	-138.2	-177.3	16.2	-132.7	-82.9	0	0	0	112.8	V87	V87-Y1009 HydrophobicContact CG1-CD1 3.93Å; V87-Y1009 HydrophobicContact CG1-CD2 4.26Å; V87-Y1009 HydrophobicContact CG1-CE1 4.31Å; V87-Y1009 HydrophobicContact CG1-CG 3.97Å; V87-Y1009 HydrophobicContact CG2-CD2 3.67Å; V87-Y1009 HydrophobicContact CG2-CE2 3.75Å; V87-Y1009 HydrophobicContact CG2-CG 4.23Å
1010	T	25.2	Very low	26.2	Very low	107 Å²	107	128.7 Å²	128.7	66%	0.656	68%	0.681	S	S	*	*			trans	-64.1	162.4	-162.9	54.9	0	0	0	0	121
1011	C	28.7	Very low	26.2	Very low	112 Å²	112	127.6 Å²	127.6	76%	0.757	68%	0.675	S	S	*	*			trans	-21.3	155.5	141.8	-39.7	0	0	0	0	117.7
1012	N	25.2	Very low	26.6	Very low	120 Å²	120	121.4 Å²	121.4	64%	0.642	66%	0.655	S	S	*	*				-162.4	158.2	104.5	-127.1	-4.9	0	0	0	114.7
1013	N	26.2	Very low	27.2	Very low	116 Å²	116	120.1 Å²	120.1	62%	0.62	64%	0.644	S	S	*	*			trans	29.8	146.6	137.9	-66.6	-7	0	0	0	122
1014	N	25.4	Very low	27.3	Very low	137 Å²	137	119.2 Å²	119.2	73%	0.733	64%	0.641	S	S	*	*			cis	-157.7	175	-4.4	-126.8	-23.6	0	0	0	113.7
1015	S	28	Very low	27.5	Very low	89 Å²	89	119.6 Å²	119.6	62%	0.622	64%	0.638	S	S	*	*			trans	-55.6	145	170.4	57.3	0	0	0	0	115.5
1016	Q	25.8	Very low	27.5	Very low	183 Å²	183	121.5 Å²	121.5	86%	0.855	64%	0.637	S	S	*	*				-160.3	127.5	106.7	-102.1	163	0.7	0	0	109.8
1017	S	25.3	Very low	27.4	Very low	87 Å²	87	122.2 Å²	122.2	61%	0.608	64%	0.636	S	S	*	*				70.8	96.8	93.8	-160.5	0	0	0	0	111.5
1018	M	28.4	Very low	27.3	Very low	142 Å²	142	122.5 Å²	122.5	70%	0.7	64%	0.637	S	S	*	*				58	116.9	83.4	-67.4	-101.7	-67	0	0	113.2
1019	H	28.5	Very low	27.4	Very low	143 Å²	143	121.5 Å²	121.5	66%	0.662	64%	0.637	S	S	*	*				-175.1	130.3	114.8	-94.9	-50.6	0	0	0	109.2
1020	N	27.7	Very low	27.4	Very low	116 Å²	116	118.8 Å²	118.8	62%	0.62	64%	0.64	S	S	*	*				105	160.5	94.7	-87.1	0.9	0	0	0	111.8
1021	L	26	Very low	27.4	Very low	102 Å²	102	120.4 Å²	120.4	53%	0.534	64%	0.644	S	S	.	*			cis	-124.6	153	-21.4	-90.6	128.1	0	0	0	106.4	Q18	Q18-L1021 PolarHBondContact NE2-O 3.09Å
1022	Q	31.7	Very low	27.4	Very low	104 Å²	104	122.9 Å²	122.9	49%	0.486	65%	0.645	S	S	.	*				72.6	163.2	67.9	-109.7	-144.6	-24.6	0	0	114.6	S19 H20	S19-Q1022 WeakPolarHBondContact OG-CA 3.26Å; S19-Q1022 PolarHBondContact OG-N 3.13Å; H20-Q1022 HydrophobicContact CB-CG 4.23Å; H20-Q1022 PolarHBondContact CD2-N 3.18Å
1023	P	35.5	Very low	27.5	Very low	47 Å²	47	122.6 Å²	122.6	31%	0.305	64%	0.642	S	S	.	*				-142.2	-154.5	-112.4	45.1	-25	0	0	0	116	Q18 S19	Q18-P1023 WeakPolarHBondContact O-CB 3.25Å; S19-P1023 WeakPolarHBondContact O-CB 3.01Å
1024	N	27.3	Very low	27.5	Very low	120 Å²	120	123.5 Å²	123.5	64%	0.642	65%	0.647	S	S	*	*			trans	84.8	156.3	162.4	-69.3	-33.5	0	0	0	116.3
1025	H	29.5	Very low	27.7	Very low	132 Å²	132	123.2 Å²	123.2	61%	0.611	64%	0.644	S	S	*	*			cis	-148.3	169.9	13	-114.4	-17.8	0	0	0	113.3
1026	K	28.3	Very low	27.8	Very low	148 Å²	148	125.7 Å²	125.7	64%	0.643	65%	0.645	S	S	*	*			trans	7.8	152.8	142.8	-44.9	153.5	177.6	163.6	0	118.9
1027	H	26.4	Very low	28	Very low	146 Å²	146	122.2 Å²	122.2	68%	0.676	63%	0.629	S	S	*	*			cis	-165.3	175.1	47.4	-120	-78	0	0	0	112.8
1028	L	25.9	Very low	28.2	Very low	137 Å²	137	122.3 Å²	122.3	72%	0.717	63%	0.63	S	S	*	*			trans	-5.9	155.2	146.7	-85.8	49	0	0	0	119
1029	T	26.5	Very low	28.3	Very low	114 Å²	114	122.4 Å²	122.4	70%	0.699	63%	0.628	S	S	*	*			cis	-156.7	152.4	17.7	-3.8	0	0	0	0	112.3
1030	S	24.9	Very low	28.3	Very low	92 Å²	92	122.9 Å²	122.9	64%	0.643	63%	0.631	S	S	*	*				30.4	134.7	129.7	-57	0	0	0	0	124.3
1031	D	24.7	Very low	28.2	Very low	141 Å²	141	123 Å²	123	75%	0.754	63%	0.628	S	S	*	*			trans	69	139.1	139.1	-55.9	-30.3	0	0	0	122.4
1032	H	27.5	Very low	28.2	Very low	165 Å²	165	123.2 Å²	123.2	76%	0.764	64%	0.638	S	S	*	*			trans	66	146.2	156.7	-84.8	-130.9	0	0	0	118.2
1033	L	27.1	Very low	27.9	Very low	113 Å²	113	125 Å²	125	59%	0.592	65%	0.649	S	S	*	*			cis	-164.8	164.2	-23	-154.5	70.2	0	0	0	108.1
1034	L	27.8	Very low	27.4	Very low	136 Å²	136	132.6 Å²	132.6	71%	0.712	67%	0.673	S	S	*	*			trans	66	154	158.3	-72.7	164.8	0	0	0	118.9
1035	I	27.9	Very low	27.2	Very low	131 Å²	131	130.8 Å²	130.8	67%	0.672	67%	0.67	S	S	*	*			trans	53.7	126.4	138	-68.3	168.2	0	0	0	118.4
1036	Q	30.4	Very low	27.1	Very low	141 Å²	141	132.3 Å²	132.3	66%	0.659	68%	0.677	S	S	*	*			cis	-154.1	165.9	-7.2	-121.9	175.2	-54.5	0	0	108
1037	Q	30.3	Very low	27.1	Very low	110 Å²	110	131.7 Å²	131.7	51%	0.514	69%	0.686	S	S	.	*				19.7	134.6	108.1	-64.4	174.1	-37.2	0	0	116.4	N1191	Q1037-N1191 PolarHBondContact NE2-ND2 2.88Å; Q1037-N1191 VanDerWaalsContact NE2-ND2 3.14Å
1038	S	29.3	Very low	27.4	Very low	89 Å²	89	129.1 Å²	129.1	62%	0.622	69%	0.685	S	S	*	*			cis	-177.5	175.8	-3.9	49.9	0	0	0	0	110.7
1039	Q	31	Very low	27.7	Very low	143 Å²	143	130.6 Å²	130.6	67%	0.668	69%	0.687	S	S	*	*			trans	74.6	137.6	146.7	-80.7	174.7	16.5	0	0	119.8
1040	Q	27.6	Very low	28	Very low	153 Å²	153	133 Å²	133	72%	0.715	69%	0.691	S	S	*	*			trans	67.7	145.6	139.8	-69.8	171.7	9	0	0	118.5
1041	H	26.2	Very low	28.2	Very low	120 Å²	120	132.9 Å²	132.9	56%	0.556	69%	0.69	S	S	*	*			cis	165.7	129.5	-22.2	-132.3	-106.2	0	0	0	102.2	Q1186	H1041-Q1186 PolarHBondContact CE1-NE2 3.18Å; H1041-Q1186 PolarHBondContact NE2-NE2 3.44Å
1042	S	26.1	Very low	28.5	Very low	106 Å²	106	133 Å²	133	74%	0.741	69%	0.691	S	S	*	*			trans	58.5	151.9	177.1	46.5	0	0	0	0	113.5
1043	I	26.1	Very low	28.6	Very low	142 Å²	142	129.3 Å²	129.3	73%	0.728	68%	0.683	S	S	*	*				-160.2	153.7	67.4	-89.5	170	0	0	0	108
1044	Y	24.3	Very low	28.8	Very low	205 Å²	205	129.5 Å²	129.5	80%	0.804	69%	0.689	S	S	*	*			trans	-3	146.7	150	-63.7	-101.8	0	0	0	118.5
1045	S	24.4	Very low	28.8	Very low	83 Å²	83	129.6 Å²	129.6	58%	0.58	69%	0.691	S	S	*	*			cis	-179.9	-156.7	-6.4	47.1	0	0	0	0	108.9
1046	E	25.7	Very low	28.8	Very low	164 Å²	164	126.9 Å²	126.9	77%	0.766	68%	0.683	S	S	*	*			trans	80.6	108.9	148.9	-80.7	172.9	-166.9	0	0	120.8
1047	T	30	Very low	28.7	Very low	134 Å²	134	127 Å²	127	82%	0.822	69%	0.688	S	S	*	*			trans	76.3	148.2	142.9	70.9	0	0	0	0	118.1
1048	S	31.4	Very low	28.6	Very low	93 Å²	93	128.5 Å²	128.5	65%	0.65	70%	0.699	S	S	*	*			cis	-145.8	143.2	9.1	34.3	0	0	0	0	112.8
1049	H	32.1	Very low	28.4	Very low	167 Å²	167	131.4 Å²	131.4	77%	0.773	70%	0.703	S	S	*	*			trans	56.8	148.3	150.2	-56.9	-43.9	0	0	0	120.1
1050	Q	32.7	Very low	28.1	Very low	166 Å²	166	130.4 Å²	130.4	78%	0.776	70%	0.702	S	S	*	*			cis	-145.2	140.2	7.8	-135.5	152.4	24.3	0	0	112.5
1051	S	28.8	Very low	27.9	Very low	89 Å²	89	128 Å²	128	62%	0.622	70%	0.702	S	S	*	*			trans	-42.1	149.2	165.4	52.1	0	0	0	0	114.3
1052	N	31.1	Very low	27.9	Very low	144 Å²	144	127 Å²	127	77%	0.77	71%	0.708	S	S	*	*				-165.3	159.9	71.6	-108.6	-32.1	0	0	0	115.3
1053	S	31	Very low	27.9	Very low	87 Å²	87	128.9 Å²	128.9	61%	0.608	71%	0.709	S	S	*	*			trans	35.5	113.1	155.1	60.5	0	0	0	0	118
1054	T	30.1	Very low	27.8	Very low	116 Å²	116	128.4 Å²	128.4	71%	0.712	71%	0.707	S	S	*	*				55.2	140.2	57.8	87.3	0	0	0	0	111.6
1055	D	28	Very low	27.8	Very low	139 Å²	139	126 Å²	126	74%	0.743	70%	0.701	S	S	*	*			cis	-146.3	173.3	19.8	-76.6	-76.1	0	0	0	108.6
1056	S	28.1	Very low	27.9	Very low	74 Å²	74	129.4 Å²	129.4	52%	0.517	71%	0.705	S	S	.	*			cis	168.9	159.8	-31.8	70.6	0	0	0	0	105.7
1057	D	28.6	Very low	27.9	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	70%	0.703	S	S	*	*			trans	68.4	171.1	150.4	-51.4	-35.3	0	0	0	122.7
1058	L	28	Very low	27.7	Very low	143 Å²	143	126.7 Å²	126.7	75%	0.749	70%	0.696	S	S	*	*			trans	74.8	84.8	175.8	-72.3	101.7	0	0	0	120.5
1059	E	25.1	Very low	27.5	Very low	150 Å²	150	128.8 Å²	128.8	70%	0.701	70%	0.699	S	S	*	*				75.8	128.1	105.1	-77.7	-165.3	-146.4	0	0	121.9
1060	N	23.9	Very low	27.3	Very low	122 Å²	122	126 Å²	126	65%	0.652	70%	0.698	S	S	*	*				48	149.6	124.2	-55.7	-36.8	0	0	0	122.4
1061	S	25.1	Very low	27.1	Very low	102 Å²	102	121.2 Å²	121.2	71%	0.713	69%	0.687	S	S	*	*			trans	86.5	155.5	148.1	-32.6	0	0	0	0	118.1
1062	S	25.8	Very low	27	Very low	98 Å²	98	123.6 Å²	123.6	69%	0.685	69%	0.692	S	S	*	*			trans	70	109	138	-67.7	0	0	0	0	118.8
1063	I	25.8	Very low	26.8	Very low	146 Å²	146	122.8 Å²	122.8	75%	0.749	69%	0.688	S	S	*	*				90.6	121	68.8	-81.2	166.5	0	0	0	112.4
1064	L	23.8	Very low	26.7	Very low	132 Å²	132	121.9 Å²	121.9	69%	0.691	68%	0.682	S	S	*	*			trans	57.2	121.1	154.8	-98.6	80.9	0	0	0	120.8
1065	F	23.8	Very low	26.4	Very low	155 Å²	155	124.7 Å²	124.7	68%	0.68	69%	0.685	S	S	*	*				78.1	134.5	121.3	-87.8	-155.8	0	0	0	121.4
1066	K	27	Very low	26.3	Very low	155 Å²	155	123.4 Å²	123.4	67%	0.674	68%	0.677	S	S	*	*			trans	65.1	111.7	134.2	-72.7	-178	-180	176	0	118.3
1067	T	25.8	Very low	26.2	Very low	118 Å²	118	126.1 Å²	126.1	72%	0.724	69%	0.686	S	S	*	*				72	155.9	129.3	70.6	0	0	0	0	114.9
1068	N	25.6	Very low	26	Very low	123 Å²	123	124.7 Å²	124.7	66%	0.658	68%	0.678	S	S	*	*			cis	-160.4	170.5	37.1	-134.5	-18.5	0	0	0	112.5
1069	L	27.7	Very low	25.9	Very low	136 Å²	136	123.6 Å²	123.6	71%	0.712	67%	0.673	S	S	*	*			trans	37.8	102.6	146.3	-67.8	161.6	0	0	0	116.3
1070	S	27.8	Very low	26	Very low	108 Å²	108	122 Å²	122	76%	0.755	67%	0.669	S	S	*	*				124.2	171.5	76.1	67.4	0	0	0	0	108.1
1071	A	28.1	Very low	26.2	Very low	66 Å²	66	121.5 Å²	121.5	55%	0.545	67%	0.666	S	S	.	*			cis	-146.9	159	6	0	0	0	0	0	110.8
1072	N	27.3	Very low	26.3	Very low	139 Å²	139	122.9 Å²	122.9	74%	0.743	67%	0.666	S	S	*	*			trans	65.8	139.4	138.6	-64.9	-5.5	0	0	0	119.7
1073	N	27	Very low	26.4	Very low	127 Å²	127	123.3 Å²	123.3	68%	0.679	67%	0.668	S	S	*	*			cis	-170.3	143.5	-21.5	-126.1	-12.6	0	0	0	109.1
1074	S	27.9	Very low	26.4	Very low	69 Å²	69	122.6 Å²	122.6	48%	0.483	67%	0.666	S	S	.	*			trans	56.4	-167.1	142.2	73.6	0	0	0	0	116.7
1075	F	25.4	Very low	26.5	Very low	174 Å²	174	120.2 Å²	120.2	76%	0.763	66%	0.66	S	S	*	*			cis	-93.1	131.5	-36	-91.6	-97.4	0	0	0	106.4
1076	I	24.7	Very low	26.6	Very low	113 Å²	113	117.3 Å²	117.3	58%	0.579	65%	0.651	S	S	*	*				62.9	136.3	63.2	-65.2	166.2	0	0	0	110.7
1077	N	25.3	Very low	26.6	Very low	131 Å²	131	115.3 Å²	115.3	70%	0.701	65%	0.652	S	S	*	*			trans	70.5	149	171.2	-71.8	-1.4	0	0	0	115.8
1078	N	26	Very low	26.6	Very low	111 Å²	111	114.8 Å²	114.8	59%	0.594	65%	0.653	S	S	*	*			cis	-146.5	155.2	2.2	-125.7	-12.1	0	0	0	112.6
1079	N	26.1	Very low	26.6	Very low	121 Å²	121	114.6 Å²	114.6	65%	0.647	66%	0.66	S	S	*	*				17.5	141.3	117.5	-59.9	0.3	0	0	0	116.5
1080	N	26.7	Very low	26.8	Very low	117 Å²	117	114.4 Å²	114.4	63%	0.626	67%	0.665	S	S	*	*			cis	-168.6	162.7	43.7	-135.1	-7.4	0	0	0	113.5
1081	N	27.4	Very low	26.9	Very low	110 Å²	110	112.9 Å²	112.9	59%	0.588	67%	0.666	S	S	*	*			trans	59.9	118.5	145.4	-66.9	-21.7	0	0	0	119.6
1082	N	26.7	Very low	26.9	Very low	132 Å²	132	116.3 Å²	116.3	71%	0.706	68%	0.675	S	S	*	*				86	166.4	56.5	-72.1	-26.8	0	0	0	113.2
1083	S	28	Very low	27	Very low	106 Å²	106	116.2 Å²	116.2	74%	0.741	67%	0.673	S	S	*	*			trans	70.7	89.3	-177.8	33	0	0	0	0	113.1
1084	N	26.6	Very low	27	Very low	132 Å²	132	117.8 Å²	117.8	71%	0.706	68%	0.681	S	S	*	*				74.4	160.5	52.4	-49	0.6	0	0	0	113.9
1085	S	26.7	Very low	27.1	Very low	81 Å²	81	118.8 Å²	118.8	57%	0.566	69%	0.688	S	S	*	*			trans	91.3	102.4	160.6	67.8	0	0	0	0	115.9	E711	E711-S1085 PolarHBondContact OE2-N 2.79Å
1086	I	25.3	Very low	27.3	Very low	94 Å²	94	116 Å²	116	48%	0.482	69%	0.685	S	S	.	*				83.5	140.1	52	-63.8	158.8	0	0	0	110.2	E711	E711-I1086 VanDerWaalsContact OE1-CG1 3.23Å; E711-I1086 WeakPolarHBondContact OE1-CG1 3.15Å; E711-I1086 WeakPolarHBondContact OE2-CG1 3.2Å; E711-I1086 PolarHBondContact OE2-N 3.36Å; E711-I1086 VanDerWaalsContact OE2-N 3.09Å
1087	T	25.9	Very low	27.4	Very low	114 Å²	114	117.3 Å²	117.3	70%	0.699	69%	0.692	S	S	*	*			trans	69.4	154.4	168.1	37.3	0	0	0	0	118.2
1088	S	26.5	Very low	27.5	Very low	107 Å²	107	117 Å²	117	75%	0.748	69%	0.69	S	S	*	*			cis	-145.1	158.6	-2.9	36.2	0	0	0	0	113
1089	C	26.7	Very low	27.6	Very low	119 Å²	119	117.3 Å²	117.3	80%	0.804	69%	0.692	S	S	*	*			trans	-70.7	151.8	165.4	-52.2	0	0	0	0	111.6
1090	T	31.4	Very low	27.8	Very low	132 Å²	132	117.1 Å²	117.1	81%	0.81	69%	0.691	S	S	*	*			trans	-142.3	63.4	151.5	19.6	0	0	0	0	110.7
1091	G	28.6	Very low	28	Very low	75 Å²	75	118.3 Å²	118.3	77%	0.773	69%	0.692	S	S	*	*			trans	-72.7	131.2	146.7	0	0	0	0	0	107.5
1092	N	29.9	Very low	28.1	Very low	139 Å²	139	119.2 Å²	119.2	74%	0.743	69%	0.693	S	S	*	*			trans	-84.3	152.8	-158.4	-113	-18	0	0	0	115
1093	I	28.5	Very low	28.3	Very low	137 Å²	137	119.5 Å²	119.5	70%	0.703	69%	0.69	S	S	*	*			trans	78	115.3	152.7	-67.6	160.9	0	0	0	118.4
1094	L	27.2	Very low	28.3	Very low	159 Å²	159	119.5 Å²	119.5	83%	0.832	68%	0.682	S	S	*	*			trans	55.5	146.5	151.9	-84.5	47.4	0	0	0	118.9
1095	S	29.8	Very low	28.3	Very low	91 Å²	91	118.8 Å²	118.8	64%	0.636	68%	0.677	S	S	*	*			cis	-166.1	156	-4.8	50.4	0	0	0	0	110.6
1096	T	28.8	Very low	28.3	Very low	115 Å²	115	121.2 Å²	121.2	71%	0.706	68%	0.684	S	S	*	*			trans	26.2	136.7	141.5	60.5	0	0	0	0	120.2
1097	I	27.4	Very low	28.4	Very low	140 Å²	140	124.3 Å²	124.3	72%	0.718	70%	0.701	S	S	*	*			cis	-171.9	163.2	3.5	-123.8	164.5	0	0	0	107.9
1098	N	27.7	Very low	28.4	Very low	125 Å²	125	122.8 Å²	122.8	67%	0.668	70%	0.695	S	S	*	*			trans	61	110.4	159.6	-77.4	19	0	0	0	121.5
1099	N	28	Very low	28.4	Very low	118 Å²	118	122.7 Å²	122.7	63%	0.631	68%	0.684	S	S	*	*				84.3	140.3	108.8	-77	39.8	0	0	0	124.2
1100	D	30.6	Very low	28.4	Very low	116 Å²	116	122.1 Å²	122.1	62%	0.62	68%	0.677	S	S	*	*			trans	75.5	91.6	130.2	-58.8	-8.7	0	0	0	121.3
1101	H	29.8	Very low	28.2	Very low	142 Å²	142	120.9 Å²	120.9	66%	0.657	67%	0.665	S	S	*	*				91.6	139.6	105.5	-91.1	-68.5	0	0	0	121.6
1102	H	30.8	Very low	28.2	Very low	130 Å²	130	121.6 Å²	121.6	60%	0.602	65%	0.654	S	S	*	*			trans	74.4	102.8	137.6	-74.4	-42.9	0	0	0	120.9
1103	H	30.5	Very low	28.1	Very low	138 Å²	138	120 Å²	120	64%	0.639	65%	0.652	S	S	*	*				96	119.9	110.7	-85.5	-37.2	0	0	0	119.8
1104	N	27.3	Very low	28	Very low	106 Å²	106	120.3 Å²	120.3	57%	0.567	66%	0.66	S	S	*	*				85.6	108.1	123.5	-68.6	-3.8	0	0	0	118.7
1105	N	27.7	Very low	28.2	Very low	116 Å²	116	120.2 Å²	120.2	62%	0.62	66%	0.659	S	S	*	*				77.9	100.6	116.3	-62.1	-11.4	0	0	0	117.3
1106	N	26.6	Very low	28.1	Very low	132 Å²	132	121.2 Å²	121.2	71%	0.706	67%	0.665	S	S	*	*				84.9	138.5	114.7	-67.6	-19.3	0	0	0	117.5
1107	L	27.3	Very low	28.3	Very low	159 Å²	159	121.6 Å²	121.6	83%	0.832	67%	0.668	S	S	*	*			trans	64.9	113.2	158	-61.1	160.3	0	0	0	113.3
1108	S	25.5	Very low	28.5	Very low	82 Å²	82	120.9 Å²	120.9	57%	0.573	67%	0.672	S	S	*	*			cis	-177.2	-164.7	24.4	43.8	0	0	0	0	111.7
1109	M	25.7	Very low	28.4	Very low	105 Å²	105	120.4 Å²	120.4	52%	0.517	67%	0.674	S	S	.	*			trans	88.8	49.7	154.7	-52.6	-82.6	135	0	0	120.3	H298 L299	H298-M1109 HydrophobicContact CB-CE 4.18Å; H298-M1109 HydrophobicContact CB-SD 4.28Å; H298-M1109 PolarHBondContact CD2-SD 3.45Å; H298-M1109 WeakPolarHBondContact CE1-CA 3.12Å; H298-M1109 PolarHBondContact CE1-O 2.76Å; H298-M1109 VanDerWaalsContact CG-SD 3.54Å; H298-M1109 WeakPolarHBondContact ND1-CA 3.06Å; H298-M1109 PolarHBondContact NE2-SD 3.17Å; H298-M1109 VanDerWaalsContact NE2-SD 3.39Å; L299-M1109 VanDerWaalsContact CD1-N 3.29Å
1110	T	27.8	Very low	28.3	Very low	108 Å²	108	121.8 Å²	121.8	66%	0.663	68%	0.68	S	S	*	*			trans	-140.6	123	148.7	47.6	0	0	0	0	113.3	H298 L299	H298-T1110 PolarHBondContact CE1-N 3.15Å; L299-T1110 VanDerWaalsContact CD1-N 3.27Å; L299-T1110 VanDerWaalsContact CD1-O 3.28Å; L299-T1110 WeakPolarHBondContact CD1-O 3.05Å; L299-T1110 VanDerWaalsContact CG-O 3.24Å; L299-T1110 WeakPolarHBondContact CG-O 3.4Å
1111	N	26.7	Very low	28	Very low	105 Å²	105	123.9 Å²	123.9	56%	0.561	69%	0.689	S	S	*	*			trans	-172.7	105.4	157.9	-108.8	-4.6	0	0	0	110.7	R297 L299	R297-N1111 WeakPolarHBondContact CB-O 3.43Å; R297-N1111 WeakPolarHBondContact CG-O 3.42Å; L299-N1111 HydrophobicContact CG-CB 4.15Å
1112	V	29.3	Very low	27.6	Very low	90 Å²	90	122.6 Å²	122.6	55%	0.545	69%	0.692	S	S	.	*			trans	-179.7	141.3	170.8	130.9	0	0	0	0	107.6	R297	R297-V1112 HydrophobicContact CB-CG2 4.39Å; R297-V1112 HydrophobicContact CG-CB 3.7Å; R297-V1112 HydrophobicContact CG-CG1 4.43Å; R297-V1112 HydrophobicContact CG-CG2 3.8Å
1113	P	26.6	Very low	27.3	Very low	107 Å²	107	121.1 Å²	121.1	70%	0.695	70%	0.696	S	S	*	*			cis	-137.4	127.3	-28.3	37.8	-19.9	0	0	0	113.8
1114	V	26	Very low	27	Very low	143 Å²	143	119.5 Å²	119.5	87%	0.867	70%	0.699	S	S	*	*			trans	-145.1	155.1	156.7	-166.5	0	0	0	0	108.2
1115	I	32	Very low	26.9	Very low	157 Å²	157	120.8 Å²	120.8	81%	0.805	70%	0.702	S	S	*	*			trans	83	114.8	-179.3	-50.5	165	0	0	0	114
1116	S	28.2	Very low	26.9	Very low	111 Å²	111	120.4 Å²	120.4	78%	0.776	70%	0.703	S	S	*	*			trans	-162.9	106	158.8	-73.4	0	0	0	0	109.8
1117	T	32.8	Very low	26.9	Very low	124 Å²	124	119.8 Å²	119.8	76%	0.761	70%	0.7	S	S	*	*				27.1	159.5	118.3	39	0	0	0	0	120.5
1118	P	32.2	Very low	27	Very low	125 Å²	125	115.6 Å²	115.6	81%	0.812	68%	0.684	S	S	*	*			cis	-142.8	169.3	30.2	42.5	-23.5	0	0	0	119.6
1119	T	25.4	Very low	27.1	Very low	114 Å²	114	116.1 Å²	116.1	70%	0.699	69%	0.688	S	S	*	*			trans	-104.6	140.9	157.3	39.7	0	0	0	0	110.9
1120	I	24.5	Very low	27.1	Very low	148 Å²	148	117.2 Å²	117.2	76%	0.759	70%	0.701	S	S	*	*			trans	75.7	146.9	140.7	-66.5	166.7	0	0	0	119.1
1121	I	24.2	Very low	27.2	Very low	159 Å²	159	119.5 Å²	119.5	82%	0.815	71%	0.707	S	S	*	*			trans	79.5	170.2	164.2	-83.4	162.8	0	0	0	118
1122	T	22.8	Very low	27.4	Very low	116 Å²	116	118.9 Å²	118.9	71%	0.712	71%	0.711	S	S	*	*			trans	-115.2	-174.8	-140.7	51	0	0	0	0	114.9
1123	S	23.6	Very low	27.2	Very low	98 Å²	98	121.5 Å²	121.5	69%	0.685	72%	0.721	S	S	*	*			trans	83.7	110.5	151.3	22	0	0	0	0	120.2
1124	C	24.3	Very low	27.1	Very low	105 Å²	105	123.4 Å²	123.4	71%	0.709	72%	0.719	S	S	*	*				87	102	127.4	-60	0	0	0	0	122.7
1125	E	25.4	Very low	27.1	Very low	133 Å²	133	122.5 Å²	122.5	62%	0.621	71%	0.709	S	S	*	*				88.7	146	110.5	-74.2	-175.1	157.5	0	0	123.5
1126	T	28.1	Very low	26.8	Very low	107 Å²	107	120.4 Å²	120.4	66%	0.656	71%	0.707	S	S	*	*			trans	71	141.3	166.7	59.4	0	0	0	0	118.2
1127	N	26.7	Very low	26.7	Very low	120 Å²	120	123.7 Å²	123.7	64%	0.642	71%	0.707	S	S	*	*			cis	-151.5	134.4	10.3	-127.3	-26.4	0	0	0	115.1
1128	S	28.5	Very low	26.5	Very low	71 Å²	71	123.8 Å²	123.8	50%	0.497	70%	0.703	S	S	.	*			trans	59	164.9	149.3	85.4	0	0	0	0	119.8
1129	S	28.3	Very low	26.2	Very low	92 Å²	92	122.7 Å²	122.7	64%	0.643	70%	0.699	S	S	*	*			cis	-143.3	155.2	9.3	-66.1	0	0	0	0	113
1130	T	26.5	Very low	26.4	Very low	129 Å²	129	124.3 Å²	124.3	79%	0.791	70%	0.698	S	S	*	*			trans	62.2	149.1	161.3	57.6	0	0	0	0	118.5
1131	I	29.6	Very low	26.4	Very low	156 Å²	156	122.1 Å²	122.1	80%	0.8	69%	0.688	S	S	*	*			cis	-167.4	153.7	-18.5	-114.7	166.9	0	0	0	105.3
1132	S	29.3	Very low	26.5	Very low	91 Å²	91	118.4 Å²	118.4	64%	0.636	67%	0.669	S	S	*	*			cis	-144.4	153.8	-15	55.5	0	0	0	0	105.8
1133	L	26	Very low	26.8	Very low	146 Å²	146	119.5 Å²	119.5	76%	0.764	67%	0.666	S	S	*	*				61.5	132	54.9	-67.6	133.7	0	0	0	115.3
1134	F	24.6	Very low	27	Very low	147 Å²	147	120.6 Å²	120.6	65%	0.645	67%	0.665	S	S	*	*			cis	179.1	170.4	-26.5	-128.4	-74.2	0	0	0	109.3
1135	N	25.8	Very low	27.4	Very low	123 Å²	123	125 Å²	125	66%	0.658	67%	0.671	S	S	*	*			trans	67.2	130.9	148.3	-77	-26.2	0	0	0	119.2
1136	C	25	Very low	27.5	Very low	113 Å²	113	125.5 Å²	125.5	76%	0.764	68%	0.678	S	S	*	*				81.4	139.9	58.8	-65.5	0	0	0	0	114
1137	K	27.7	Very low	27.6	Very low	181 Å²	181	129.1 Å²	129.1	79%	0.787	69%	0.685	S	S	*	*			trans	162.7	150.1	162.6	-90.6	-170.6	167.7	-93.8	0	107.2
1138	D	28.5	Very low	27.8	Very low	125 Å²	125	126.3 Å²	126.3	67%	0.668	68%	0.684	S	S	*	*			cis	-158.2	169	-15.4	-103.2	-17.4	0	0	0	109.7
1139	S	25.7	Very low	28.1	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	70%	0.698	S	S	*	*			trans	-51.2	166.1	177.3	-37.7	0	0	0	0	118.6
1140	Q	28.5	Very low	28.1	Very low	147 Å²	147	132.4 Å²	132.4	69%	0.687	70%	0.697	S	S	*	*				171.6	119.5	100	-86.9	-158.4	11.6	0	0	118.6	S338 E339	S338-Q1140 CarbonylContact O-C 3.6Å; S338-Q1140 VanDerWaalsContact O-C 3.29Å; E339-Q1140 CarbonylContact O-C 3.23Å
1141	L	25.9	Very low	28.3	Very low	103 Å²	103	134.5 Å²	134.5	54%	0.539	70%	0.698	S	S	.	*			trans	73.1	146	140.9	-86	89.2	0	0	0	123.6	S338	S338-L1141 VanDerWaalsContact N-C 3.34Å; S338-L1141 PolarHBondContact O-N 3.47Å; S338-L1141 PolarHBondContact OG-O 3.16Å
1142	N	26.2	Very low	28.4	Very low	80 Å²	80	130.4 Å²	130.4	43%	0.428	69%	0.694	S	S	.	*			trans	31.7	151.5	133.5	-76.6	14	0	0	0	122.1	I337 S338	I337-N1142 PolarHBondContact O-N 3.18Å; I337-N1142 PolarHBondContact O-OD1 3.31Å; S338-N1142 PolarHBondContact OG-N 3.01Å; S338-N1142 VanDerWaalsContact OG-N 3.13Å
1143	E	27.8	Very low	28.6	Very low	140 Å²	140	132.9 Å²	132.9	65%	0.654	70%	0.7	S	S	*	*			cis	-167.4	150.5	20.4	-134.8	166.9	-105.8	0	0	117.3
1144	N	28	Very low	28.8	Very low	121 Å²	121	131.6 Å²	131.6	65%	0.647	69%	0.694	S	S	*	*			trans	25	125.4	145.1	-68.9	-32	0	0	0	124.2
1145	K	32.9	Very low	29.1	Very low	196 Å²	196	130.7 Å²	130.7	85%	0.852	70%	0.696	S	S	*	*				-173.6	134.8	119.5	-94.9	141.5	-167.8	159.5	0	110.8
1146	L	28.9	Very low	29.3	Very low	144 Å²	144	129.6 Å²	129.6	75%	0.754	70%	0.698	S	S	*	*				63.7	138.4	70.8	-94.2	77.2	0	0	0	113.5
1147	K	30.4	Very low	29.6	Very low	184 Å²	184	130.5 Å²	130.5	80%	0.8	70%	0.695	S	S	*	*			cis	-165.3	156.4	24.4	-155.9	176.3	-176.8	-179.3	0	114.3
1148	G	30.7	Very low	29.7	Very low	60 Å²	60	128.3 Å²	128.3	62%	0.619	69%	0.692	S	S	*	*			trans	87.8	151.3	158.5	0	0	0	0	0	115.7
1149	H	33.4	Very low	29.7	Very low	172 Å²	172	126.1 Å²	126.1	80%	0.796	69%	0.686	S	S	*	*			cis	-160.8	162.4	-6.9	-86.8	-41.4	0	0	0	106.8
1150	L	28.3	Very low	29.9	Very low	119 Å²	119	128.2 Å²	128.2	62%	0.623	69%	0.69	S	S	*	*			cis	-163.1	160.3	-21.1	-108	169	0	0	0	107.1
1151	E	30.4	Very low	30	Very low	173 Å²	173	124.9 Å²	124.9	81%	0.808	68%	0.683	S	S	*	*			trans	54.9	134.5	155	-69.4	151	-141.5	0	0	120.7
1152	G	32.2	Very low	30.1	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	69%	0.694	S	S	*	*			cis	172	169.9	-7.9	0	0	0	0	0	115.5
1153	N	33.8	Very low	30.3	Very low	144 Å²	144	129.6 Å²	129.6	77%	0.77	71%	0.709	S	S	*	*			trans	76.4	96.2	153.6	-67.7	-8.9	0	0	0	122.9
1154	N	30.6	Very low	30.5	Very low	119 Å²	119	126.8 Å²	126.8	64%	0.636	70%	0.704	S	S	*	*				87.1	106.9	103.1	-67.1	-5.5	0	0	0	123
1155	N	30.1	Very low	30.6	Very low	127 Å²	127	127.3 Å²	127.3	68%	0.679	71%	0.707	S	S	*	*				102.4	130.5	105.1	-73	-6	0	0	0	122.4
1156	S	31	Very low	30.5	Very low	100 Å²	100	123.8 Å²	123.8	70%	0.699	70%	0.698	S	S	*	*			trans	76	146.4	131.6	68.8	0	0	0	0	120
1157	N	31	Very low	30.5	Very low	132 Å²	132	123 Å²	123	71%	0.706	69%	0.694	S	S	*	*			cis	-165.4	158.6	-10.8	-110.3	-3.3	0	0	0	110.9
1158	N	28.4	Very low	30.5	Very low	135 Å²	135	120.6 Å²	120.6	72%	0.722	69%	0.69	S	S	*	*			trans	57.7	152.5	142.3	-66.4	5	0	0	0	121
1159	S	30.4	Very low	30.6	Very low	79 Å²	79	124.9 Å²	124.9	55%	0.552	70%	0.699	S	S	*	*			cis	-176.2	153.8	-13	-96.8	0	0	0	0	110.4
1160	N	29.2	Very low	30.5	Very low	147 Å²	147	121.2 Å²	121.2	79%	0.786	69%	0.692	S	S	*	*			trans	64.2	157.5	141.8	-65.5	0.6	0	0	0	121.4
1161	S	29.6	Very low	30.7	Very low	78 Å²	78	123.2 Å²	123.2	55%	0.545	70%	0.704	S	S	.	*			cis	-172.5	149.8	-29.6	58.3	0	0	0	0	111.6
1162	N	29	Very low	30.7	Very low	144 Å²	144	119.7 Å²	119.7	77%	0.77	70%	0.698	S	S	*	*			trans	63.6	163.7	151.9	-52.5	-15.9	0	0	0	117.5
1163	N	30.1	Very low	30.6	Very low	138 Å²	138	121.5 Å²	121.5	74%	0.738	70%	0.695	S	S	*	*			cis	-151.5	150.4	-1.6	-143	-3.8	0	0	0	114.3
1164	S	31.7	Very low	30.3	Very low	81 Å²	81	121.3 Å²	121.3	57%	0.566	69%	0.694	S	S	*	*			trans	42.4	125.2	142.5	-82.8	0	0	0	0	125.7
1165	N	30.7	Very low	30.3	Very low	131 Å²	131	123.7 Å²	123.7	70%	0.701	71%	0.706	S	S	*	*				103.4	117.8	120	-70.2	1.9	0	0	0	123.6
1166	N	30.1	Very low	30.1	Very low	123 Å²	123	122.4 Å²	122.4	66%	0.658	71%	0.707	S	S	*	*				88.1	108.6	128.6	-67.3	-5.7	0	0	0	123.7
1167	N	30.2	Very low	30	Very low	128 Å²	128	125.7 Å²	125.7	68%	0.684	72%	0.716	S	S	*	*				90	117	122.6	-67.4	-6.7	0	0	0	123
1168	N	30.5	Very low	29.7	Very low	132 Å²	132	125.2 Å²	125.2	71%	0.706	72%	0.723	S	S	*	*				85.9	94.1	129.9	-64	-7.8	0	0	0	122.2
1169	N	31.4	Very low	29.8	Very low	151 Å²	151	125.6 Å²	125.6	81%	0.807	72%	0.721	S	S	*	*				92.6	135.5	116.7	-92.2	-2.7	0	0	0	123.6
1170	S	31.6	Very low	30.1	Very low	94 Å²	94	127.2 Å²	127.2	66%	0.657	73%	0.729	S	S	*	*			trans	70.3	107.4	148.9	47.9	0	0	0	0	121.2
1171	N	32	Very low	30.3	Very low	161 Å²	161	128.1 Å²	128.1	86%	0.861	73%	0.733	S	S	*	*				59.6	141.2	119.8	-60.3	5.9	0	0	0	119.6
1172	S	30.4	Very low	30.3	Very low	99 Å²	99	130.4 Å²	130.4	69%	0.692	74%	0.744	S	S	*	*			cis	-161.9	158.5	16.3	48.2	0	0	0	0	115.1
1173	T	30.7	Very low	30.1	Very low	108 Å²	108	130 Å²	130	66%	0.663	75%	0.75	S	S	*	*			trans	63.8	107.3	143.9	51.6	0	0	0	0	122.6
1174	D	27.8	Very low	30	Very low	140 Å²	140	126.1 Å²	126.1	75%	0.749	74%	0.743	S	S	*	*				83.9	132.5	115	-60.7	-8.1	0	0	0	124.1
1175	L	30.3	Very low	30	Very low	170 Å²	170	128.5 Å²	128.5	89%	0.89	75%	0.754	S	S	*	*			trans	73.7	139.9	161.4	-62.1	159.2	0	0	0	116.5
1176	S	26.6	Very low	29.9	Very low	100 Å²	100	128.2 Å²	128.2	70%	0.699	75%	0.749	S	S	*	*			cis	-154.3	148.2	8.6	56.2	0	0	0	0	115.1
1177	L	27.5	Very low	30.2	Very low	168 Å²	168	131.3 Å²	131.3	88%	0.88	76%	0.757	S	S	*	*			trans	22.1	119.4	145.7	-69.7	155.9	0	0	0	121.1
1178	S	25.9	Very low	30.3	Very low	122 Å²	122	131.3 Å²	131.3	85%	0.853	76%	0.763	S	S	*	*				-175.5	168.7	110.6	52.4	0	0	0	0	112.9
1179	E	30.1	Very low	30.3	Very low	144 Å²	144	130 Å²	130	67%	0.673	76%	0.76	S	S	*	*			trans	-101	-155.4	-169.5	-59.2	177.5	132	0	0	112.5
1180	P	37.5	Very low	30.5	Very low	112 Å²	112	129.2 Å²	129.2	73%	0.727	76%	0.761	S	S	*	*				-125.7	-174.3	-87.8	40	-23.9	0	0	0	113.4
1181	L	32.2	Very low	30.4	Very low	166 Å²	166	129 Å²	129	87%	0.869	75%	0.752	S	S	*	*			trans	-161.5	167.2	149.3	-112.7	170.5	0	0	0	113.3
1182	T	29.6	Very low	30.4	Very low	126 Å²	126	126.3 Å²	126.3	77%	0.773	75%	0.747	S	S	*	*			trans	-133.2	162.3	-165.5	57.7	0	0	0	0	113.6
1183	C	25.4	Very low	30.4	Very low	135 Å²	135	128.3 Å²	128.3	91%	0.912	75%	0.749	S	S	*	*				158	146.5	124.3	-169	0	0	0	0	114
1184	G	28.4	Very low	30.4	Very low	57 Å²	57	126.9 Å²	126.9	59%	0.588	74%	0.743	S	S	*	*			trans	135.4	113.7	140.7	0	0	0	0	0	120.8
1185	V	31.1	Very low	30.5	Very low	132 Å²	132	126.4 Å²	126.4	80%	0.8	74%	0.741	S	S	*	*			trans	66.4	133.8	138.5	-172.7	0	0	0	0	119.3
1186	Q	29.5	Very low	30.3	Very low	124 Å²	124	127.9 Å²	127.9	58%	0.579	73%	0.734	S	S	*	*			cis	-167.1	174.4	-29.4	-120.3	173.8	-15.1	0	0	110.4	H1041	H1041-Q1186 PolarHBondContact CE1-NE2 3.18Å; H1041-Q1186 PolarHBondContact NE2-NE2 3.44Å
1187	F	34.8	Very low	30.4	Very low	189 Å²	189	129 Å²	129	83%	0.829	73%	0.732	S	S	*	*			trans	-92	175.5	-174.4	-76.2	-95.2	0	0	0	115.1
1188	P	33.3	Very low	30.4	Very low	127 Å²	127	124.5 Å²	124.5	83%	0.825	72%	0.715	S	S	*	*				-130.6	174.9	100.1	39.2	-32.6	0	0	0	115.5
1189	V	31.2	Very low	30.4	Very low	106 Å²	106	125.4 Å²	125.4	64%	0.642	71%	0.709	S	S	*	*			trans	-115.6	165.8	-179	-147.2	0	0	0	0	109.5
1190	T	34	Very low	30.2	Very low	134 Å²	134	124.2 Å²	124.2	82%	0.822	71%	0.707	S	S	*	*				-158.8	160	94	31.5	0	0	0	0	115.7
1191	N	29.3	Very low	29.6	Very low	88 Å²	88	125.4 Å²	125.4	47%	0.471	71%	0.707	S	S	.	*			trans	-36.8	157.8	169	-63	1.6	0	0	0	116	Q1037 L1193	Q1037-N1191 PolarHBondContact NE2-ND2 2.88Å; Q1037-N1191 VanDerWaalsContact NE2-ND2 3.14Å; N1191-L1193 HydrophobicContact CB-CD1 4.12Å
1192	S	32.7	Very low	29.4	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	71%	0.71	S	S	*	*				-160.6	131.2	52.4	-57.4	0	0	0	0	117.7
1193	L	31.2	Very low	29.2	Very low	141 Å²	141	130.8 Å²	130.8	74%	0.738	71%	0.714	S	S	*	*				46.1	145.9	124.8	-75.7	83.9	0	0	0	122	N1191	N1191-L1193 HydrophobicContact CB-CD1 4.12Å
1194	S	30.4	Very low	29.2	Very low	78 Å²	78	127.5 Å²	127.5	55%	0.545	70%	0.703	S	S	.	*			cis	-179.4	153.4	-10.6	55.6	0	0	0	0	115.5
1195	N	28.7	Very low	29.1	Very low	130 Å²	130	133 Å²	133	70%	0.695	72%	0.717	S	S	*	*			trans	76	153	141.3	-64.1	-3.4	0	0	0	120.8
1196	W	26.2	Very low	28.7	Very low	201 Å²	201	131.3 Å²	131.3	76%	0.761	71%	0.712	S	S	*	*			cis	-167	173.7	-8.7	-113.2	28.4	0	0	0	107.7
1197	L	28.9	Very low	28.7	Very low	122 Å²	122	131.4 Å²	131.4	64%	0.639	72%	0.72	S	S	*	*			cis	-169.9	171.3	-41.4	-131	-177.3	0	0	0	108.8
1198	S	27	Very low	28.3	Very low	75 Å²	75	127.7 Å²	127.7	52%	0.524	71%	0.713	S	S	.	*			trans	85	113.1	142	-78.9	0	0	0	0	124.6
1199	L	26.2	Very low	28	Very low	141 Å²	141	128 Å²	128	74%	0.738	71%	0.708	S	S	*	*				100.3	124.9	118.9	-68.5	170.3	0	0	0	124.1
1200	N	25.9	Very low	27.8	Very low	118 Å²	118	130.8 Å²	130.8	63%	0.631	71%	0.708	S	S	*	*			trans	85.4	115.4	131.2	-74.5	-18.9	0	0	0	124.4
1201	N	26	Very low	27.6	Very low	137 Å²	137	132.6 Å²	132.6	73%	0.733	71%	0.712	S	S	*	*				54.2	106.9	128.8	-61.5	-33.6	0	0	0	120.9
1202	R	28	Very low	27.5	Very low	245 Å²	245	131 Å²	131	93%	0.925	72%	0.716	S	S	*	*				-171.4	165.1	118.1	-107.9	165.5	-175.4	-176.4	2.6	116.5
1203	N	25.8	Very low	27.2	Very low	161 Å²	161	135 Å²	135	86%	0.861	72%	0.715	S	S	*	*			trans	-64.1	140.8	178.1	-49.4	-41.5	0	0	0	113.7
1204	G	25.8	Very low	26.9	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	71%	0.71	S	S	*	*				100	125	129.5	0	0	0	0	0	120.9
1205	I	24.5	Very low	26.7	Very low	171 Å²	171	136.4 Å²	136.4	88%	0.877	72%	0.721	S	S	*	*				67.8	106.9	126.2	-59.5	173.1	0	0	0	119.2
1206	S	23.8	Very low	26.6	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	72%	0.721	S	S	*	*			trans	91.4	104.7	130.2	-170.2	0	0	0	0	123.8
1207	V	28.5	Very low	26.7	Very low	125 Å²	125	130.4 Å²	130.4	76%	0.758	70%	0.703	S	S	*	*				68.3	110	126.7	-175.4	0	0	0	0	121
1208	T	26.4	Very low	26.7	Very low	112 Å²	112	130.4 Å²	130.4	69%	0.687	70%	0.704	S	S	*	*			trans	-4.8	135.5	147.5	62	0	0	0	0	121.6
1209	N	27.1	Very low	26.9	Very low	132 Å²	132	132.5 Å²	132.5	71%	0.706	71%	0.709	S	S	*	*				-146.1	134.6	120.2	-86.3	-35.3	0	0	0	107.2
1210	Y	26.5	Very low	27	Very low	165 Å²	165	133.4 Å²	133.4	65%	0.647	71%	0.707	S	S	*	*				75.3	101.3	67	-108.3	-71.6	0	0	0	114.8	Y468	Y468-Y1210 HydrophobicContact CD1-CD2 4.36Å; Y468-Y1210 HydrophobicContact CD1-CE2 4.16Å; Y468-Y1210 HydrophobicContact CG-CE2 4.31Å
1211	L	30.9	Very low	27.1	Very low	172 Å²	172	130.2 Å²	130.2	90%	0.901	69%	0.692	S	S	*	*			trans	164.1	138	151.2	-90.1	172.2	0	0	0	105.9
1212	G	26.2	Very low	27.2	Very low	54 Å²	54	127.5 Å²	127.5	56%	0.557	68%	0.676	S	S	*	*			cis	150.1	126.3	-9.9	0	0	0	0	0	111
1213	W	26.3	Very low	27	Very low	191 Å²	191	122.2 Å²	122.2	72%	0.723	66%	0.664	S	S	*	*			trans	70.1	145.5	178.3	-52	85.9	0	0	0	114.4	P445	P445-W1213 HydrophobicContact CB-CH2 4.01Å; P445-W1213 HydrophobicContact CB-CZ2 4.11Å; P445-W1213 HydrophobicContact CG-CH2 4.43Å
1214	S	25.1	Very low	26.9	Very low	92 Å²	92	119.5 Å²	119.5	64%	0.643	65%	0.654	S	S	*	*			cis	-169.3	167	-9.7	44.9	0	0	0	0	113.2
1215	M	26.9	Very low	26.9	Very low	156 Å²	156	121 Å²	121	77%	0.768	65%	0.654	S	S	*	*			trans	75.6	121.8	157.3	-70.1	-60.2	175.1	0	0	121.3
1216	L	26.3	Very low	27	Very low	133 Å²	133	119.2 Å²	119.2	70%	0.696	65%	0.646	S	S	*	*			trans	-76	164.5	143.7	-66.8	153.3	0	0	0	108.2
1217	N	28.6	Very low	27.3	Very low	72 Å²	72	120.6 Å²	120.6	39%	0.385	65%	0.645	S	S	.	*			cis	-150.2	174.5	34.8	-97.1	-58.9	0	0	0	111.7	L198 L200	L198-N1217 HydrophobicContact CD2-CB 4.41Å; L200-N1217 HydrophobicContact CD1-CB 4.24Å
1218	N	28.6	Very low	27.4	Very low	122 Å²	122	121.2 Å²	121.2	65%	0.652	64%	0.644	S	S	*	*			trans	-56.8	148.2	174.6	-48.4	-39.9	0	0	0	113.5
1219	D	30.8	Very low	27.6	Very low	119 Å²	119	121.2 Å²	121.2	64%	0.636	64%	0.639	S	S	*	*				-152.5	159.5	100.3	-119.5	-27	0	0	0	113.7
1220	K	29.9	Very low	28	Very low	160 Å²	160	121.5 Å²	121.5	70%	0.696	64%	0.641	S	S	*	*			trans	-58	149.9	176.6	-79.4	-172.7	174.6	-177.7	0	112.2
1221	T	27.5	Very low	28.2	Very low	51 Å²	51	119.6 Å²	119.6	31%	0.313	64%	0.641	S	S	.	*			cis	-176.8	-164.7	19.1	19	0	0	0	0	112.7	D1367 C1368	T1221-D1367 WeakPolarHBondContact CB-OD1 3.23Å; T1221-D1367 HydrophobicContact CG2-CB 4.1Å; T1221-D1367 WeakPolarHBondContact CG2-OD1 3.03Å; T1221-C1368 WeakPolarHBondContact OG1-CA 3.09Å; T1221-C1368 PolarHBondContact OG1-O 3.01Å
1222	M	26.8	Very low	28.2	Very low	81 Å²	81	117.9 Å²	117.9	40%	0.399	63%	0.633	S	S	.	*			trans	-35	172.6	178	-94.2	-174.9	-169.8	0	0	120	I1366 D1367	M1222-I1366 HydrophobicContact CE-CD1 3.89Å; M1222-I1366 HydrophobicContact CE-CG1 3.92Å; M1222-I1366 HydrophobicContact CE-CG2 4.35Å; M1222-I1366 HydrophobicContact SD-CG2 4.41Å; M1222-D1367 HydrophobicContact CB-CB 4.18Å; M1222-D1367 WeakPolarHBondContact CB-OD1 3.49Å; M1222-D1367 VanDerWaalsContact CE-OD2 3.28Å; M1222-D1367 WeakPolarHBondContact CE-OD2 3.09Å; M1222-D1367 HydrophobicContact CG-CB 4.34Å; M1222-D1367 WeakPolarHBondContact CG-OD1 3.49Å; M1222-D1367 WeakPolarHBondContact CG-OD2 3.07Å; M1222-D1367 PolarHBondContact N-OD1 2.84Å; M1222-D1367 HydrophobicContact SD-CB 4.12Å
1223	I	24.6	Very low	28.6	Very low	133 Å²	133	123.7 Å²	123.7	68%	0.682	65%	0.645	S	S	*	*			cis	-146.6	173.5	22.8	-144.6	148.1	0	0	0	115.7
1224	T	24.2	Very low	28.8	Very low	105 Å²	105	121.4 Å²	121.4	64%	0.644	65%	0.647	S	S	*	*			trans	-55.8	156.5	-171.7	52.2	0	0	0	0	120.8
1225	S	26.1	Very low	29.1	Very low	97 Å²	97	122.1 Å²	122.1	68%	0.678	65%	0.649	S	S	*	*			trans	72.4	145.9	144.1	72.3	0	0	0	0	118.7
1226	N	26.7	Very low	29.1	Very low	134 Å²	134	121.6 Å²	121.6	72%	0.717	64%	0.644	S	S	*	*			cis	-146.1	135.9	31.9	-101.9	-47.9	0	0	0	116.4
1227	I	28.9	Very low	29.2	Very low	127 Å²	127	123.2 Å²	123.2	65%	0.651	65%	0.648	S	S	*	*				9.9	126.4	127.2	-42.5	174	0	0	0	118.2
1228	N	30.7	Very low	29	Very low	137 Å²	137	123.7 Å²	123.7	73%	0.733	66%	0.657	S	S	*	*				179.5	113.6	118.5	-94.5	-50.4	0	0	0	115.6
1229	N	31.3	Very low	28.9	Very low	112 Å²	112	124.7 Å²	124.7	60%	0.599	66%	0.661	S	S	*	*			trans	34.3	124.7	131.1	-44	-13	0	0	0	121.4
1230	N	35.7	Very low	28.7	Very low	139 Å²	139	124.6 Å²	124.6	74%	0.743	66%	0.661	S	S	*	*				-168.9	143.2	96.5	-85.6	-16.3	0	0	0	109.3
1231	I	29.9	Very low	28.5	Very low	125 Å²	125	122.4 Å²	122.4	64%	0.641	66%	0.657	S	S	*	*			cis	77.1	122.2	45.3	-63.1	174.6	0	0	0	109.2
1232	D	32.1	Very low	28.5	Very low	136 Å²	136	125.8 Å²	125.8	73%	0.727	67%	0.673	S	S	*	*			cis	-154.2	-179.9	21.9	-136	-25.2	0	0	0	117.1
1233	E	32.7	Very low	28.5	Very low	175 Å²	175	128 Å²	128	82%	0.818	69%	0.687	S	S	*	*			trans	81.4	117.8	147.1	-78.9	179.9	170.6	0	0	124.8
1234	L	30.9	Very low	28.6	Very low	144 Å²	144	129 Å²	129	75%	0.754	69%	0.688	S	S	*	*			trans	-84.3	-160.3	159.3	-91.9	158.9	0	0	0	108.6
1235	P	32.3	Very low	28.7	Very low	106 Å²	106	129.7 Å²	129.7	69%	0.688	68%	0.684	S	S	*	*			cis	-144.2	165.7	9.1	44.2	-24.4	0	0	0	119.6
1236	H	26.5	Very low	28.8	Very low	145 Å²	145	133 Å²	133	67%	0.671	69%	0.688	S	S	*	*			trans	29.7	165	136.2	-67.8	-90.1	0	0	0	125.2
1237	H	27.9	Very low	28.7	Very low	168 Å²	168	131.8 Å²	131.8	78%	0.778	68%	0.681	S	S	*	*			trans	87.8	135.6	159.4	-63.8	-62.6	0	0	0	117
1238	S	24.8	Very low	28.4	Very low	81 Å²	81	131 Å²	131	57%	0.566	68%	0.677	S	S	*	*			cis	-160.2	178.8	-11	-126.5	0	0	0	0	111.2
1239	L	26	Very low	28.1	Very low	144 Å²	144	129.9 Å²	129.9	75%	0.754	67%	0.668	S	S	*	*			trans	12.8	141.3	135.6	-53.9	168.4	0	0	0	117.5
1240	D	27.3	Very low	27.9	Very low	117 Å²	117	130.4 Å²	130.4	63%	0.626	67%	0.669	S	S	*	*			cis	-161.8	154.3	33.1	-139.8	-0.2	0	0	0	117
1241	N	25.8	Very low	27.5	Very low	114 Å²	114	129.8 Å²	129.8	61%	0.61	67%	0.666	S	S	*	*			trans	35.2	131.8	137.3	-86	-37.3	0	0	0	124.2
1242	N	26.5	Very low	27.3	Very low	122 Å²	122	129.5 Å²	129.5	65%	0.652	67%	0.666	S	S	*	*				94.6	141.9	122	-76.1	-21.6	0	0	0	123.1
1243	N	28.3	Very low	27	Very low	128 Å²	128	129.8 Å²	129.8	68%	0.684	67%	0.666	S	S	*	*			trans	73.4	138.1	145.6	-68	-7	0	0	0	119.9
1244	H	27	Very low	26.5	Very low	153 Å²	153	127.6 Å²	127.6	71%	0.708	66%	0.66	S	S	*	*			cis	-162.2	-163.8	-19.7	-145.2	27.3	0	0	0	111
1245	H	26.3	Very low	26.2	Very low	120 Å²	120	125.5 Å²	125.5	56%	0.556	66%	0.656	S	S	*	*			trans	-39.4	158.6	156.9	-64.4	-71.1	0	0	0	113.5
1246	Q	26.5	Very low	25.9	Very low	165 Å²	165	127.8 Å²	127.8	77%	0.771	66%	0.661	S	S	*	*			cis	-125.5	160.7	24.7	-93.1	98.9	4.7	0	0	112.4
1247	I	24.4	Very low	26.2	Very low	110 Å²	110	125.3 Å²	125.3	56%	0.564	66%	0.658	S	S	*	*			cis	72.5	143.8	43.7	-69.4	169.8	0	0	0	112.1
1248	D	24.2	Very low	26.2	Very low	109 Å²	109	121.1 Å²	121.1	58%	0.583	65%	0.648	S	S	*	*			trans	65.4	139.8	170	-65.1	-12.2	0	0	0	117.1
1249	E	24.8	Very low	26.5	Very low	114 Å²	114	121.5 Å²	121.5	53%	0.533	65%	0.647	S	S	.	*			cis	-172.7	-174.6	-2.7	-128	-178.4	154	0	0	110.3
1250	I	27.1	Very low	26.8	Very low	123 Å²	123	119.1 Å²	119.1	63%	0.631	64%	0.638	S	S	*	*			trans	68.8	133	140	-77.8	163.5	0	0	0	120.3
1251	N	26.7	Very low	26.8	Very low	127 Å²	127	120.4 Å²	120.4	68%	0.679	64%	0.64	S	S	*	*			trans	77.1	98.7	167.9	-65.7	-29	0	0	0	117.3
1252	N	25.1	Very low	27	Very low	119 Å²	119	120.7 Å²	120.7	64%	0.636	64%	0.637	S	S	*	*				85.6	123.2	69.6	-75.2	-23.1	0	0	0	110.6
1253	I	25.3	Very low	27.2	Very low	141 Å²	141	121.2 Å²	121.2	72%	0.723	64%	0.636	S	S	*	*				50.6	97.1	79.6	-54.2	171.7	0	0	0	107
1254	D	23.4	Very low	27.1	Very low	130 Å²	130	121.9 Å²	121.9	70%	0.695	64%	0.636	S	S	*	*				-153.3	167.5	54	-128.9	-33.2	0	0	0	116.9
1255	C	23.8	Very low	27.3	Very low	100 Å²	100	122.5 Å²	122.5	68%	0.676	64%	0.637	S	S	*	*			trans	-40.7	158.9	150.6	-48	0	0	0	0	114.3
1256	I	25.8	Very low	27.3	Very low	154 Å²	154	122 Å²	122	79%	0.79	65%	0.646	S	S	*	*				-177.4	143.2	113.2	-97	163	0	0	0	110.5
1257	P	32.4	Very low	27.5	Very low	93 Å²	93	119.3 Å²	119.3	60%	0.604	64%	0.644	S	S	*	*			trans	-95.1	176	-175.5	39	-37.7	0	0	0	113.6
1258	S	29.1	Very low	27.8	Very low	80 Å²	80	122.2 Å²	122.2	56%	0.559	66%	0.655	S	S	*	*			trans	-168.3	150.2	167	-85.5	0	0	0	0	107.7	T810	T810-S1258 WeakPolarHBondContact CG2-O 3.46Å
1259	T	31.6	Very low	28.1	Very low	89 Å²	89	123.1 Å²	123.1	55%	0.546	66%	0.66	S	S	.	*			cis	-133.3	169.7	8.2	46.1	0	0	0	0	112.5	T810 N811	T810-T1259 VanDerWaalsContact CG2-N 3.33Å; N811-T1259 PolarHBondContact ND2-O 3.42Å; N811-T1259 PolarHBondContact OD1-O 3.02Å; N811-T1259 VanDerWaalsContact OD1-O 3.12Å
1260	V	31	Very low	28.2	Very low	93 Å²	93	125.9 Å²	125.9	56%	0.564	67%	0.671	S	S	*	*	S	Bend	trans	73.1	109.8	169.7	-167.9	0	0	0	0	114.4	N811	N811-V1260 PolarHBondContact ND2-O 3.43Å
1261	H	28.3	Very low	28.2	Very low	144 Å²	144	126.1 Å²	126.1	67%	0.667	67%	0.673	S	S	*	*	S	Bend	cis	-156.1	138	0.9	-150.3	-134.7	0	0	0	113
1262	H	28.8	Very low	28.3	Very low	120 Å²	120	126.8 Å²	126.8	56%	0.556	68%	0.677	S	S	*	*			trans	62.1	142.1	164.3	-80.6	55.9	0	0	0	119.7
1263	Q	31	Very low	28.5	Very low	133 Å²	133	128.9 Å²	128.9	62%	0.621	69%	0.686	S	S	*	*			cis	-171.1	131.3	-27.4	-127.1	-177.1	13.7	0	0	109.8
1264	M	27	Very low	28.6	Very low	142 Å²	142	127 Å²	127	70%	0.7	68%	0.683	S	S	*	*			trans	59	153.2	149.6	-66.4	157.9	51.8	0	0	119
1265	K	30.8	Very low	28.7	Very low	166 Å²	166	128 Å²	128	72%	0.722	69%	0.687	S	S	*	*			cis	-158.4	127.3	-9.4	-112.6	176.6	177.5	-171.1	0	106.3
1266	C	26.9	Very low	28.7	Very low	110 Å²	110	127.2 Å²	127.2	74%	0.743	68%	0.683	S	S	*	*				79.5	145.8	97.9	-68.3	0	0	0	0	117.3
1267	C	31.1	Very low	28.7	Very low	108 Å²	108	126.1 Å²	126.1	73%	0.73	68%	0.679	S	S	*	*			trans	71.3	145.2	163.3	-58.8	0	0	0	0	117.4
1268	E	29.8	Very low	28.5	Very low	172 Å²	172	127 Å²	127	80%	0.804	68%	0.678	S	S	*	*			cis	-160.8	-169.4	-24.2	-136	146.9	-109.3	0	0	111.3
1269	N	29.7	Very low	28.4	Very low	127 Å²	127	128.7 Å²	128.7	68%	0.679	68%	0.682	S	S	*	*			trans	-75.4	176.1	-169.7	-67.1	-36.3	0	0	0	116.4
1270	F	27.8	Very low	28.3	Very low	173 Å²	173	129.9 Å²	129.9	76%	0.759	68%	0.684	S	S	*	*			trans	104.2	107.7	150.1	-60.8	-68.1	0	0	0	120
1271	D	26.9	Very low	28.2	Very low	127 Å²	127	131.1 Å²	131.1	68%	0.679	69%	0.688	S	S	*	*				76.1	154.5	124.6	-59.1	-6.9	0	0	0	123.7
1272	N	29.1	Very low	28.4	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	68%	0.684	S	S	*	*			trans	69.4	86.1	157.5	-59.6	-38.4	0	0	0	118.9
1273	I	28.4	Very low	28.4	Very low	163 Å²	163	129 Å²	129	84%	0.836	69%	0.686	S	S	*	*				-20	124.5	120.5	-66.2	169.5	0	0	0	110
1274	P	28.3	Very low	28.4	Very low	101 Å²	101	130 Å²	130	66%	0.656	70%	0.695	S	S	*	*				-153.7	159.6	88.5	41.7	-23.3	0	0	0	119.3
1275	L	24.6	Very low	28.5	Very low	150 Å²	150	126.9 Å²	126.9	79%	0.785	70%	0.7	S	S	*	*			trans	60.5	106.2	137.9	-72.6	167.9	0	0	0	120.8
1276	S	24.9	Very low	28.2	Very low	84 Å²	84	128.3 Å²	128.3	59%	0.587	71%	0.706	S	S	*	*				90.1	162.7	108.5	80.4	0	0	0	0	119.5
1277	N	25.7	Very low	28.2	Very low	131 Å²	131	129.4 Å²	129.4	70%	0.701	70%	0.704	S	S	*	*			trans	62.8	129.3	146.5	-68.3	-2	0	0	0	117.6
1278	N	26.9	Very low	28	Very low	111 Å²	111	129.9 Å²	129.9	59%	0.594	70%	0.699	S	S	*	*			cis	-172.4	178	1.3	-123	-9.4	0	0	0	108.5
1279	N	27.6	Very low	27.9	Very low	117 Å²	117	128.2 Å²	128.2	63%	0.626	70%	0.696	S	S	*	*			trans	42.5	131.1	134.2	-59.7	3.7	0	0	0	118.6
1280	N	29.5	Very low	27.9	Very low	113 Å²	113	129.7 Å²	129.7	60%	0.604	70%	0.704	S	S	*	*			cis	-178.2	168.5	24.6	-119.3	8.1	0	0	0	109
1281	N	29	Very low	27.9	Very low	119 Å²	119	127 Å²	127	64%	0.636	70%	0.702	S	S	*	*			trans	47.3	135.8	131.3	-57.8	13.7	0	0	0	119.9
1282	N	31.9	Very low	27.8	Very low	110 Å²	110	127.3 Å²	127.3	59%	0.588	70%	0.699	S	S	*	*			cis	-163.1	161	17.4	-121.8	20.8	0	0	0	112.9
1283	D	30.4	Very low	27.7	Very low	111 Å²	111	127.8 Å²	127.8	59%	0.594	70%	0.695	S	S	*	*			trans	58.8	121.7	135.5	-63.6	-12.3	0	0	0	123.1
1284	N	29.5	Very low	27.6	Very low	152 Å²	152	126.2 Å²	126.2	81%	0.813	69%	0.688	S	S	*	*				63.6	120.7	124.3	-54.6	-31.5	0	0	0	119.9
1285	G	29.2	Very low	27.6	Very low	78 Å²	78	130.5 Å²	130.5	80%	0.804	70%	0.699	S	S	*	*			trans	-179.3	71	172.3	0	0	0	0	0	113.5
1286	F	25.3	Very low	27.7	Very low	195 Å²	195	127.6 Å²	127.6	86%	0.855	69%	0.691	S	S	*	*			trans	-60.3	143.4	-178	-103.9	-130.8	0	0	0	114.6
1287	L	26.4	Very low	27.8	Very low	134 Å²	134	130 Å²	130	70%	0.702	70%	0.697	S	S	*	*			trans	82.7	142.6	141.4	-73.5	170.5	0	0	0	123.1
1288	N	28	Very low	27.9	Very low	117 Å²	117	132.5 Å²	132.5	63%	0.626	71%	0.705	S	S	*	*			trans	76.6	112.2	147.6	-66.5	-20.5	0	0	0	120.2
1289	N	26	Very low	27.7	Very low	137 Å²	137	132.5 Å²	132.5	73%	0.733	71%	0.712	S	S	*	*				33	112	115.1	-48.1	-19.8	0	0	0	116.5
1290	D	30.9	Very low	27.7	Very low	159 Å²	159	132.6 Å²	132.6	85%	0.85	72%	0.718	S	S	*	*				-154	-179.4	110	-118.2	-28	0	0	0	113.5
1291	T	27.7	Very low	27.5	Very low	115 Å²	115	135.8 Å²	135.8	71%	0.706	73%	0.726	S	S	*	*			trans	-65.5	146	-168.1	54.3	0	0	0	0	117.2
1292	E	24.8	Very low	27.5	Very low	134 Å²	134	134.8 Å²	134.8	63%	0.626	72%	0.724	S	S	*	*			trans	57.5	141.4	137.6	-72.7	-159.4	173.5	0	0	123.2
1293	K	26.7	Very low	27.5	Very low	153 Å²	153	138.7 Å²	138.7	67%	0.665	74%	0.736	S	S	*	*			trans	80.4	117.9	151.8	-76.4	-174	-168.9	81.3	0	120.8
1294	D	25.8	Very low	27.5	Very low	129 Å²	129	138.4 Å²	138.4	69%	0.69	74%	0.735	S	S	*	*			trans	71.6	146.4	134.2	-53.7	-26.9	0	0	0	120
1295	Q	28.4	Very low	27.7	Very low	191 Å²	191	136.9 Å²	136.9	89%	0.893	72%	0.721	S	S	*	*			trans	70.1	135.8	175.2	-54	169.1	61.5	0	0	114.1
1296	S	26.4	Very low	27.6	Very low	89 Å²	89	138.6 Å²	138.6	62%	0.622	71%	0.71	S	S	*	*			cis	-160.9	-172.4	-11.1	56.9	0	0	0	0	108.7
1297	N	26.8	Very low	27.9	Very low	134 Å²	134	134.8 Å²	134.8	72%	0.717	69%	0.694	S	S	*	*			trans	39.1	104	143.5	-57.6	-20.5	0	0	0	116.7
1298	Q	28.4	Very low	28.1	Very low	184 Å²	184	132 Å²	132	86%	0.86	68%	0.68	S	S	*	*				-175.9	178.4	64.9	-105.1	157.4	10.5	0	0	113.6
1299	C	22.9	Very low	28.2	Very low	111 Å²	111	131.4 Å²	131.4	75%	0.75	68%	0.684	S	S	*	*			trans	-34.2	155.5	154.3	-56.4	0	0	0	0	114.8
1300	T	28	Very low	28.5	Very low	120 Å²	120	132.9 Å²	132.9	74%	0.736	69%	0.69	S	S	*	*			cis	-165.6	153.4	10.3	-0.5	0	0	0	0	113.3
1301	F	24.8	Very low	28.3	Very low	180 Å²	180	132.8 Å²	132.8	79%	0.789	69%	0.688	S	S	*	*			trans	27.7	106.9	140.8	-84.6	-115.1	0	0	0	120.1
1302	T	29.7	Very low	28.3	Very low	97 Å²	97	131.9 Å²	131.9	60%	0.595	69%	0.687	S	S	*	*				77.9	132.5	81.5	66.5	0	0	0	0	118.3
1303	K	32.5	Very low	28.6	Very low	192 Å²	192	130.5 Å²	130.5	84%	0.835	69%	0.689	S	S	*	*				178.3	113.9	111.7	-95.3	169.8	-179	174.5	0	109.8
1304	N	28.6	Very low	28.7	Very low	106 Å²	106	133 Å²	133	57%	0.567	70%	0.696	S	S	*	*				75	112.3	79.5	-90.8	-17.4	0	0	0	116
1305	K	33.8	Very low	28.9	Very low	120 Å²	120	134.8 Å²	134.8	52%	0.522	70%	0.704	S	S	.	*			trans	-147.2	108.3	146.1	-79.1	-153.1	163.1	-165	0	111.8	H27 L28	H27-K1305 HydrophobicContact CB-CD 4.17Å; H27-K1305 PolarHBondContact O-NZ 3.5Å; L28-K1305 HydrophobicContact CB-CB 4.07Å; L28-K1305 HydrophobicContact CB-CD 4.09Å; L28-K1305 HydrophobicContact CB-CG 4.43Å; L28-K1305 HydrophobicContact CD1-CB 4.25Å; L28-K1305 WeakPolarHBondContact O-CE 3.35Å; L28-K1305 PolarHBondContact O-NZ 3.08Å
1306	I	27.9	Very low	28.8	Very low	113 Å²	113	128.5 Å²	128.5	58%	0.579	68%	0.681	S	S	*	*			trans	-133.7	169.8	166.1	-60.8	173.5	0	0	0	106.1	S29 N30	S29-I1306 CarbonylContact C-O 3.33Å; S29-I1306 WeakPolarHBondContact CA-O 2.97Å; S29-I1306 WeakPolarHBondContact CB-O 3.38Å; N30-I1306 PolarHBondContact N-O 3.28Å; N30-I1306 VanDerWaalsContact OD1-C 3.28Å; N30-I1306 WeakPolarHBondContact OD1-CB 3.35Å; N30-I1306 PolarHBondContact OD1-N 3.07Å; N30-I1306 PolarHBondContact OD1-O 2.86Å
1307	K	31.4	Very low	28.9	Very low	116 Å²	116	128.8 Å²	128.8	50%	0.504	68%	0.675	S	S	.	*			trans	-158.5	164.5	159.8	-149.7	164.9	-176.1	110.1	0	113.2	L28 S29 N30	L28-K1307 HydrophobicContact CD2-CB 3.68Å; S29-K1307 VanDerWaalsContact C-CD 3.46Å; S29-K1307 PolarHBondContact O-NZ 2.78Å; N30-K1307 PolarHBondContact O-NZ 3.33Å
1308	D	29.9	Very low	29	Very low	76 Å²	76	128.2 Å²	128.2	41%	0.406	68%	0.681	S	S	.	*			trans	-98.9	170.6	-174	-26.8	-92.7	0	0	0	110.6	T31	T31-D1308 WeakPolarHBondContact CB-OD2 3.34Å; T31-D1308 VanDerWaalsContact CG2-CG 3.42Å; T31-D1308 WeakPolarHBondContact CG2-OD1 3.46Å; T31-D1308 WeakPolarHBondContact CG2-OD2 3.48Å; T31-D1308 PolarHBondContact N-OD2 2.75Å; T31-D1308 PolarHBondContact OG1-OD1 2.74Å; T31-D1308 PolarHBondContact OG1-OD2 3.12Å
1309	S	31.4	Very low	28.9	Very low	103 Å²	103	125.7 Å²	125.7	72%	0.72	68%	0.678	S	S	*	*			cis	-150.6	151.2	9.5	-43.2	0	0	0	0	111
1310	I	31.6	Very low	29.3	Very low	168 Å²	168	127.7 Å²	127.7	86%	0.862	67%	0.674	S	S	*	*			trans	-134.9	122.2	153.6	-59.4	-179.2	0	0	0	108.7
1311	I	27.4	Very low	29.2	Very low	157 Å²	157	124.4 Å²	124.4	81%	0.805	66%	0.656	S	S	*	*			trans	-124.4	124.9	171.3	-62.5	176.6	0	0	0	108.2
1312	S	27.8	Very low	29.3	Very low	97 Å²	97	122.6 Å²	122.6	68%	0.678	65%	0.645	S	S	*	*			trans	-153.5	120	163.7	-161.3	0	0	0	0	109.3
1313	P	30.2	Very low	29.3	Very low	104 Å²	104	125.7 Å²	125.7	68%	0.675	66%	0.656	S	S	*	*			trans	-105.9	117.8	-161.9	36.1	-29.9	0	0	0	113.3
1314	Y	29.4	Very low	29	Very low	207 Å²	207	120.8 Å²	120.8	81%	0.812	65%	0.645	S	S	*	*			trans	-138.5	103.5	170.7	-76.3	-75	0	0	0	113.4	S1316	Y1314-S1316 PolarHBondContact O-N 3.3Å
1315	I	29.2	Very low	28.9	Very low	166 Å²	166	122.8 Å²	122.8	85%	0.851	66%	0.656	S	S	*	*			trans	-60.5	125.5	165.4	-62.8	168.2	0	0	0	108.2
1316	S	26.7	Very low	28.8	Very low	59 Å²	59	120.3 Å²	120.3	41%	0.413	65%	0.648	S	S	.	*			trans	-116.9	76.8	174.3	56.2	0	0	0	0	110.8	Y1314	Y1314-S1316 PolarHBondContact O-N 3.3Å
1317	N	28.9	Very low	28.8	Very low	95 Å²	95	119.6 Å²	119.6	51%	0.508	65%	0.645	S	S	.	*			trans	-152.6	164	171.3	-111.9	-39.5	0	0	0	112.2
1318	C	29.1	Very low	28.9	Very low	122 Å²	122	121.4 Å²	121.4	82%	0.824	66%	0.655	S	S	*	*			trans	65.9	114.3	178.9	-65.2	0	0	0	0	117.1
1319	T	26.8	Very low	29	Very low	130 Å²	130	125.3 Å²	125.3	80%	0.798	67%	0.671	S	S	*	*			trans	-94.8	125.7	159.9	48.2	0	0	0	0	109.1
1320	F	30.5	Very low	29	Very low	154 Å²	154	128.6 Å²	128.6	68%	0.675	67%	0.672	S	S	*	*			trans	-170.9	-148.6	133.3	-114.6	-91.5	0	0	0	109.6
1321	S	26.3	Very low	28.8	Very low	51 Å²	51	129 Å²	129	36%	0.357	68%	0.675	S	S	.	*			trans	-139.7	140.7	-143.9	-161.1	0	0	0	0	116.1	K462	K462-S1321 PolarHBondContact NZ-OG 2.79Å
1322	Y	26.9	Very low	29.1	Very low	142 Å²	142	128 Å²	128	56%	0.557	67%	0.667	S	S	*	*			trans	71.5	162.9	-179.9	-62.8	-95.2	0	0	0	113.8	D460 K462	D460-Y1322 WeakPolarHBondContact CB-OH 3.15Å; D460-Y1322 PolarHBondContact O-OH 2.9Å; K462-Y1322 HydrophobicContact CD-CE1 4.31Å; K462-Y1322 VanDerWaalsContact CE-CD1 3.41Å; K462-Y1322 HydrophobicContact CG-CE1 4.11Å; K462-Y1322 VanDerWaalsContact NZ-CD2 3.29Å; K462-Y1322 VanDerWaalsContact NZ-CE2 3.34Å
1323	I	29.2	Very low	29.3	Very low	161 Å²	161	129.1 Å²	129.1	83%	0.826	67%	0.665	S	S	*	*			cis	-122.6	172	9.5	-67.4	170.2	0	0	0	110.4
1324	C	25.9	Very low	29.6	Very low	90 Å²	90	133.2 Å²	133.2	61%	0.608	67%	0.672	S	S	*	*			trans	-98.8	173.6	179.2	-64.5	0	0	0	0	114.3
1325	N	27.5	Very low	30	Very low	147 Å²	147	128.9 Å²	128.9	79%	0.786	66%	0.66	S	S	*	*			trans	76.8	144.7	170.4	-44.9	-16.3	0	0	0	113.7
1326	L	31	Very low	30.5	Very low	69 Å²	69	125.8 Å²	125.8	36%	0.361	64%	0.641	S	S	.	*			cis	-114.6	159.7	19.8	-92.9	63.4	0	0	0	114.6	K869 L872 L873	K869-L1326 HydrophobicContact CB-CD2 4.18Å; K869-L1326 HydrophobicContact CG-CD2 3.85Å; K869-L1326 HydrophobicContact CG-CG 4.2Å; K869-L1326 VanDerWaalsContact O-CD2 3.3Å; K869-L1326 WeakPolarHBondContact O-CD2 3.02Å; L872-L1326 HydrophobicContact CB-CD1 4Å; L872-L1326 HydrophobicContact CB-CD2 3.81Å; L873-L1326 HydrophobicContact CD1-CD2 4.28Å; L873-L1326 HydrophobicContact CG-CD2 3.97Å
1327	D	28.6	Very low	30.8	Very low	97 Å²	97	126.6 Å²	126.6	52%	0.519	64%	0.641	S	S	.	*			trans	-91.5	155.4	163.7	-21.6	-104.6	0	0	0	112.4	K869	K869-D1327 WeakPolarHBondContact CD-O 3.13Å; K869-D1327 VanDerWaalsContact CE-O 3.25Å; K869-D1327 WeakPolarHBondContact CE-O 3.47Å; K869-D1327 WeakPolarHBondContact CE-OD2 3.33Å; K869-D1327 IonicContact NZ-OD2 3.06Å; K869-D1327 PolarHBondContact NZ-OD2 2.77Å
1328	E	32.7	Very low	31.2	Very low	154 Å²	154	127.4 Å²	127.4	72%	0.72	65%	0.645	S	S	*	*			trans	-142.4	161.6	144.2	-133.6	163.9	-130.1	0	0	111.3
1329	H	32.5	Very low	31.9	Very low	158 Å²	158	127.9 Å²	127.9	73%	0.731	63%	0.633	S	S	*	*			trans	-146.2	153.1	-144.7	-149.9	-64.7	0	0	0	113.7
1330	K	30.8	Very low	32.5	Very low	173 Å²	173	128.2 Å²	128.2	75%	0.752	62%	0.62	S	S	*	*			trans	75.8	113.2	167.9	-47.1	171.3	-175.4	171.5	0	116.8
1331	L	27.7	Very low	32.9	Very low	175 Å²	175	126.1 Å²	126.1	92%	0.916	62%	0.616	S	S	*	*	S	Bend	trans	179.4	80.1	136.2	-102	166.7	0	0	0	112.5
1332	H	33.3	Very low	33.5	Very low	138 Å²	138	132.5 Å²	132.5	64%	0.639	64%	0.637	S	S	*	*			trans	-169.7	-4.4	149.3	-130.7	-76.4	0	0	0	117.4	K1334 E1335	H1332-K1334 PolarHBondContact O-N 3.08Å; H1332-E1335 IonicContact CE1-OE2 3.3Å
1333	N	31.2	Very low	33.9	Very low	119 Å²	119	132.4 Å²	132.4	64%	0.636	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	29.4	-171.1	-66.7	22.8	0	0	0	115.9
1334	K	37.6	Very low	34.1	Very low	190 Å²	190	131.4 Å²	131.4	83%	0.826	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-8.8	176.4	-139.9	179.1	-177.3	-175.1	0	114.7	H1332	H1332-K1334 PolarHBondContact O-N 3.08Å
1335	E	37.9	Very low	34.2	Very low	117 Å²	117	135.6 Å²	135.6	55%	0.547	65%	0.651	S	S	.	*	S	Bend	trans	-116.9	-9.5	175.4	-64.6	-172.3	121.1	0	0	114.6	H1332 K1339	H1332-E1335 IonicContact CE1-OE2 3.3Å; E1335-K1339 WeakPolarHBondContact O-CD 3.13Å; E1335-K1339 PolarHBondContact O-NZ 3.14Å
1336	E	38.4	Very low	34.5	Very low	100 Å²	100	138 Å²	138	47%	0.467	66%	0.657	S	S	.	*	S	Bend	trans	-80.4	-29.2	171.3	-78.7	-151.9	154.5	0	0	112.3	K1339 R1340	E1336-K1339 CarbonylContact O-C 3.02Å; E1336-K1339 PolarHBondContact O-N 2.71Å; E1336-K1339 VanDerWaalsContact O-N 3.14Å; E1336-R1340 PolarHBondContact O-N 3.4Å; E1336-R1340 IonicContact OE2-CZ 2.99Å; E1336-R1340 VanDerWaalsContact OE2-CZ 3.3Å; E1336-R1340 IonicContact OE2-NH1 3.16Å; E1336-R1340 PolarHBondContact OE2-NH1 3.23Å; E1336-R1340 IonicContact OE2-NH2 2.74Å; E1336-R1340 PolarHBondContact OE2-NH2 2.9Å
1337	N	34.9	Very low	34.5	Very low	77 Å²	77	143.7 Å²	143.7	41%	0.412	68%	0.679	S	S	.	*	H	α-helix	trans	-69.3	-38.7	-175.4	-75.3	-3.5	0	0	0	111.9	K1339 R1340 N1341	N1337-K1339 PolarHBondContact O-N 2.72Å; N1337-R1340 PolarHBondContact O-N 2.96Å; N1337-R1340 VanDerWaalsContact O-N 3.12Å; N1337-N1341 WeakPolarHBondContact O-CB 3.4Å; N1337-N1341 PolarHBondContact O-N 3.46Å; N1337-N1341 PolarHBondContact O-OD1 2.89Å
1338	D	36.9	Very low	34.5	Very low	111 Å²	111	146.9 Å²	146.9	59%	0.594	70%	0.695	S	S	*	*	H	α-helix	trans	-70	-13.7	174.2	-60.2	-23.7	0	0	0	113.2
1339	K	43.5	Very low	34.2	Very low	132 Å²	132	148.1 Å²	148.1	57%	0.574	70%	0.701	S	S	*	*	H	α-helix	trans	-92.8	-29.1	171.2	-67.7	167.2	-172.1	142.2	0	112.1	E1335 E1336 N1337 I1343	E1335-K1339 WeakPolarHBondContact O-CD 3.13Å; E1335-K1339 PolarHBondContact O-NZ 3.14Å; E1336-K1339 CarbonylContact O-C 3.02Å; E1336-K1339 PolarHBondContact O-N 2.71Å; E1336-K1339 VanDerWaalsContact O-N 3.14Å; N1337-K1339 PolarHBondContact O-N 2.72Å; K1339-I1343 WeakPolarHBondContact O-CD1 3.49Å; K1339-I1343 WeakPolarHBondContact O-CG1 3.15Å
1340	R	40	Very low	33.9	Very low	137 Å²	137	150.4 Å²	150.4	52%	0.517	71%	0.705	S	S	.	*	H	α-helix	trans	-69.1	-42.7	167.3	-75.2	-172.3	174.1	86.7	15	111.6	E1336 N1337 K1342 I1343	E1336-R1340 PolarHBondContact O-N 3.4Å; E1336-R1340 IonicContact OE2-CZ 2.99Å; E1336-R1340 VanDerWaalsContact OE2-CZ 3.3Å; E1336-R1340 IonicContact OE2-NH1 3.16Å; E1336-R1340 PolarHBondContact OE2-NH1 3.23Å; E1336-R1340 IonicContact OE2-NH2 2.74Å; E1336-R1340 PolarHBondContact OE2-NH2 2.9Å; N1337-R1340 PolarHBondContact O-N 2.96Å; N1337-R1340 VanDerWaalsContact O-N 3.12Å; R1340-K1342 PolarHBondContact O-N 3.14Å; R1340-I1343 PolarHBondContact O-N 3.4Å; R1340-I1343 VanDerWaalsContact O-N 3.13Å
1341	N	37.7	Very low	33.8	Very low	110 Å²	110	149.4 Å²	149.4	59%	0.588	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	6.8	-178	-65.8	-5.8	0	0	0	114.3	N1337	N1337-N1341 WeakPolarHBondContact O-CB 3.4Å; N1337-N1341 PolarHBondContact O-N 3.46Å; N1337-N1341 PolarHBondContact O-OD1 2.89Å
1342	K	40.3	Very low	33.7	Very low	185 Å²	185	148.2 Å²	148.2	80%	0.804	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	15	171.9	-72.7	-171.8	172.2	-177.3	0	113.5	R1340	R1340-K1342 PolarHBondContact O-N 3.14Å
1343	I	35.1	Very low	33.4	Very low	141 Å²	141	147.8 Å²	147.8	72%	0.723	70%	0.703	S	S	*	*			trans	-136.7	56.6	178.2	-46.5	174.2	0	0	0	109.4	K1339 R1340	K1339-I1343 WeakPolarHBondContact O-CD1 3.49Å; K1339-I1343 WeakPolarHBondContact O-CG1 3.15Å; R1340-I1343 PolarHBondContact O-N 3.4Å; R1340-I1343 VanDerWaalsContact O-N 3.13Å
1344	I	32.3	Very low	33.3	Very low	140 Å²	140	151.9 Å²	151.9	72%	0.718	71%	0.711	S	S	*	*	S	Bend	trans	-119.9	-11.7	179.1	-72.5	178.1	0	0	0	112.3
1345	E	29.3	Very low	32.9	Very low	178 Å²	178	153 Å²	153	83%	0.832	71%	0.711	S	S	*	*	S	Bend	trans	-103.7	161.8	172.8	-64.9	178.3	150.7	0	0	111.4
1346	H	32.1	Very low	32.3	Very low	197 Å²	197	152.5 Å²	152.5	91%	0.912	72%	0.721	S	S	*	*			trans	59.9	66.7	-173.2	-89.6	-80.2	0	0	0	116.8
1347	K	30.8	Very low	31.8	Very low	189 Å²	189	153.1 Å²	153.1	82%	0.822	74%	0.737	S	S	*	*			trans	-128.4	100.2	161.5	-167.7	-171.5	-172	-171.6	0	109
1348	N	29	Very low	31.5	Very low	163 Å²	163	155.2 Å²	155.2	87%	0.872	76%	0.757	S	S	*	*			trans	174.2	96.5	158.2	-91.9	-12.6	0	0	0	111.4
1349	E	26.5	Very low	31.3	Very low	181 Å²	181	155.6 Å²	155.6	85%	0.846	77%	0.768	S	S	*	*			trans	-174.4	159.7	144.3	-111.2	178.3	-165.5	0	0	109
1350	Y	26.4	Very low	30.7	Very low	206 Å²	206	155 Å²	155	81%	0.808	78%	0.781	S	S	*	*	S	Bend	trans	54.5	85.2	-177.4	-85.6	-95.9	0	0	0	116.4
1351	I	29.4	Very low	30.4	Very low	152 Å²	152	153.2 Å²	153.2	78%	0.779	79%	0.79	S	S	*	*				-170.9	81.5	94.7	-81.2	149.1	0	0	0	107.6
1352	D	26	Very low	30.2	Very low	150 Å²	150	153.3 Å²	153.3	80%	0.802	80%	0.799	S	S	*	*			trans	-93.2	164.6	133.8	-79.5	-55.5	0	0	0	107.5
1353	N	27.1	Very low	29.8	Very low	128 Å²	128	148.8 Å²	148.8	68%	0.684	79%	0.79	S	S	*	*			trans	83.6	55.2	-169.6	-53.2	-69.9	0	0	0	117
1354	Y	28.6	Very low	29.6	Very low	206 Å²	206	148.2 Å²	148.2	81%	0.808	79%	0.794	S	S	*	*	S	Bend	trans	-152.7	120	133	-113.4	-82.9	0	0	0	107.8
1355	Y	27.9	Very low	29.4	Very low	212 Å²	212	148.1 Å²	148.1	83%	0.831	79%	0.793	S	S	*	*	S	Bend	trans	74.4	50.2	-167.3	-57.1	-78.6	0	0	0	117.5
1356	S	26	Very low	29.4	Very low	108 Å²	108	145.1 Å²	145.1	76%	0.755	78%	0.782	S	S	*	*			trans	-176.9	123.3	137.4	-83.8	0	0	0	0	110.1
1357	S	28.8	Very low	29.1	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	75%	0.753	S	S	*	*			trans	-156.3	60.2	178.5	64.9	0	0	0	0	113
1358	S	28	Very low	29.1	Very low	120 Å²	120	133.3 Å²	133.3	84%	0.839	74%	0.74	S	S	*	*			trans	-164.7	86.6	162.8	57.7	0	0	0	0	110.3
1359	S	31.7	Very low	29.3	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	72%	0.721	S	S	*	*			trans	-155.1	121	179.8	58.3	0	0	0	0	113.3
1360	S	32.6	Very low	29.6	Very low	119 Å²	119	126.6 Å²	126.6	83%	0.832	71%	0.712	S	S	*	*			trans	-166.1	137.5	168	50.4	0	0	0	0	107.5
1361	S	33.8	Very low	29.8	Very low	101 Å²	101	123.2 Å²	123.2	71%	0.706	71%	0.708	S	S	*	*			cis	-167.7	147.2	5.8	45.8	0	0	0	0	112.4
1362	S	33.1	Very low	30	Very low	112 Å²	112	121.1 Å²	121.1	78%	0.783	71%	0.707	S	S	*	*			trans	66	151.9	142.4	-62.3	0	0	0	0	121
1363	S	31.7	Very low	30.3	Very low	89 Å²	89	118.6 Å²	118.6	62%	0.622	70%	0.701	S	S	*	*			cis	-175.7	139.2	-19.2	50.4	0	0	0	0	112.3
1364	T	30.9	Very low	30.4	Very low	129 Å²	129	118 Å²	118	79%	0.791	70%	0.702	S	S	*	*			trans	64.6	158.1	145.5	59.2	0	0	0	0	118.4
1365	I	28	Very low	30.3	Very low	139 Å²	139	115.1 Å²	115.1	71%	0.713	70%	0.7	S	S	*	*			cis	-162	160.3	6	-131.5	167.5	0	0	0	112.2
1366	I	28.1	Very low	30.1	Very low	115 Å²	115	110.3 Å²	110.3	59%	0.59	70%	0.696	S	S	*	*			trans	59	101.7	156.2	-66.2	172.1	0	0	0	120.3	M1222	M1222-I1366 HydrophobicContact CE-CD1 3.89Å; M1222-I1366 HydrophobicContact CE-CG1 3.92Å; M1222-I1366 HydrophobicContact CE-CG2 4.35Å; M1222-I1366 HydrophobicContact SD-CG2 4.41Å
1367	D	26.1	Very low	30.1	Very low	57 Å²	57	109.1 Å²	109.1	31%	0.305	69%	0.688	S	S	.	*				100.1	170.9	99.6	-69.1	-78.8	0	0	0	113.1	T1221 M1222	T1221-D1367 WeakPolarHBondContact CB-OD1 3.23Å; T1221-D1367 HydrophobicContact CG2-CB 4.1Å; T1221-D1367 WeakPolarHBondContact CG2-OD1 3.03Å; M1222-D1367 HydrophobicContact CB-CB 4.18Å; M1222-D1367 WeakPolarHBondContact CB-OD1 3.49Å; M1222-D1367 VanDerWaalsContact CE-OD2 3.28Å; M1222-D1367 WeakPolarHBondContact CE-OD2 3.09Å; M1222-D1367 HydrophobicContact CG-CB 4.34Å; M1222-D1367 WeakPolarHBondContact CG-OD1 3.49Å; M1222-D1367 WeakPolarHBondContact CG-OD2 3.07Å; M1222-D1367 PolarHBondContact N-OD1 2.84Å; M1222-D1367 HydrophobicContact SD-CB 4.12Å
1368	C	31.1	Very low	29.9	Very low	81 Å²	81	111.7 Å²	111.7	55%	0.547	69%	0.689	S	S	.	*			cis	-147.3	-154.4	8.8	-154.5	0	0	0	0	114.5	T1221	T1221-C1368 WeakPolarHBondContact OG1-CA 3.09Å; T1221-C1368 PolarHBondContact OG1-O 3.01Å
1369	V	33.4	Very low	29.8	Very low	77 Å²	77	112 Å²	112	47%	0.467	68%	0.68	S	S	.	*			trans	-128	158.8	-158	136.1	0	0	0	0	111.6
1370	N	32.6	Very low	29.6	Very low	126 Å²	126	112.3 Å²	112.3	67%	0.674	67%	0.673	S	S	*	*			cis	-167.6	177.3	-9.2	-116.5	-16.6	0	0	0	113.8
1371	N	31.7	Very low	29.4	Very low	135 Å²	135	113.2 Å²	113.2	72%	0.722	67%	0.668	S	S	*	*			trans	87.5	122.3	143.4	-79.7	-3.5	0	0	0	125.4
1372	S	32.1	Very low	29.3	Very low	108 Å²	108	113 Å²	113	76%	0.755	67%	0.666	S	S	*	*			trans	58.4	144.5	137	60.3	0	0	0	0	123.1
1373	S	32.7	Very low	29.2	Very low	97 Å²	97	113.6 Å²	113.6	68%	0.678	67%	0.665	S	S	*	*			cis	-172.2	176.5	-14.3	56.6	0	0	0	0	112.9
1374	T	30.1	Very low	29.2	Very low	114 Å²	114	115.8 Å²	115.8	70%	0.699	67%	0.668	S	S	*	*			trans	72.9	124.9	145.9	39.5	0	0	0	0	123.4
1375	L	25.4	Very low	29.4	Very low	146 Å²	146	118.1 Å²	118.1	76%	0.764	67%	0.67	S	S	*	*			trans	72.6	128.3	141.8	-95.3	74.7	0	0	0	122.4
1376	C	24.6	Very low	29.6	Very low	112 Å²	112	114.8 Å²	114.8	76%	0.757	67%	0.67	S	S	*	*			trans	64.1	159	140.8	-67.2	0	0	0	0	119.5
1377	S	25.4	Very low	29.9	Very low	82 Å²	82	117 Å²	117	57%	0.573	68%	0.683	S	S	*	*			cis	-176.4	155.8	-26.7	57	0	0	0	0	107.8
1378	M	24.8	Very low	30.7	Very low	168 Å²	168	118.4 Å²	118.4	83%	0.828	70%	0.695	S	S	*	*			trans	66.3	166.8	164.9	-59.5	-179.1	-175.5	0	0	114.3
1379	I	26.6	Very low	31	Very low	126 Å²	126	121.6 Å²	121.6	65%	0.646	71%	0.707	S	S	*	*			cis	-161.1	145.9	-22	-109.8	169.7	0	0	0	107.7
1380	N	26.3	Very low	31.1	Very low	126 Å²	126	124.8 Å²	124.8	67%	0.674	72%	0.722	S	S	*	*			trans	62.1	131.2	158.2	-73.3	0.8	0	0	0	119.7
1381	N	28.8	Very low	31.3	Very low	138 Å²	138	123.2 Å²	123.2	74%	0.738	72%	0.72	S	S	*	*				74.9	146.9	85.6	-57.3	-14.9	0	0	0	113.9
1382	S	31.6	Very low	31.6	Very low	95 Å²	95	122.9 Å²	122.9	66%	0.664	72%	0.723	S	S	*	*			cis	-177.7	149.2	-2.1	39	0	0	0	0	113.1
1383	V	30.5	Very low	31.8	Very low	125 Å²	125	123 Å²	123	76%	0.758	73%	0.731	S	S	*	*			trans	70.3	156.6	148.1	179.5	0	0	0	0	113.7
1384	I	32	Very low	31.9	Very low	135 Å²	135	121.7 Å²	121.7	69%	0.692	73%	0.733	S	S	*	*				-164.1	139.7	65.6	-59.8	-101.3	0	0	0	110.9
1385	H	34.8	Very low	32.7	Very low	178 Å²	178	121.6 Å²	121.6	82%	0.824	73%	0.734	S	S	*	*			trans	21.4	156.5	161.5	-51.3	-48.1	0	0	0	124.4
1386	G	33.8	Very low	33.3	Very low	69 Å²	69	121 Å²	121	71%	0.711	74%	0.737	S	S	*	*			cis	155	141.6	-12.1	0	0	0	0	0	116.9
1387	N	34.1	Very low	34	Very low	161 Å²	161	121.1 Å²	121.1	86%	0.861	74%	0.736	S	S	*	*			trans	47.5	167.6	149.6	-95.2	10.2	0	0	0	124.3
1388	P	43.5	Very low	34.3	Very low	88 Å²	88	122 Å²	122	57%	0.571	74%	0.742	S	S	*	*			cis	-146.8	-175.6	-37.5	42.2	-23.2	0	0	0	118.1
1389	N	35.5	Very low	34.7	Very low	148 Å²	148	122 Å²	122	79%	0.791	74%	0.744	S	S	*	*			trans	73.8	149.6	155.5	-57.5	-21.8	0	0	0	120.3
1390	N	36.2	Very low	34.9	Very low	144 Å²	144	120.9 Å²	120.9	77%	0.77	75%	0.748	S	S	*	*			cis	-176.6	164.2	38.4	-146.7	5.7	0	0	0	115.1
1391	S	37.1	Very low	35.7	Very low	92 Å²	92	119.6 Å²	119.6	64%	0.643	75%	0.747	S	S	*	*			trans	69.8	169.5	155.3	-58.3	0	0	0	0	122.9
1392	T	37.1	Very low	35.9	Very low	128 Å²	128	119 Å²	119	79%	0.785	75%	0.748	S	S	*	*			cis	-169.8	143.9	-49	46.2	0	0	0	0	114.8
1393	A	37.1	Very low	36	Very low	111 Å²	111	119.5 Å²	119.5	92%	0.917	75%	0.747	S	S	*	*			trans	63.7	158.4	160.1	0	0	0	0	0	120.5
1394	G	34.1	Very low	36	Very low	70 Å²	70	120.2 Å²	120.2	72%	0.722	75%	0.747	S	S	*	*			cis	-163.6	-169.5	7.2	0	0	0	0	0	114.3
1395	P	46.5	Very low	35.9	Very low	112 Å²	112	118.6 Å²	118.6	73%	0.727	74%	0.744	S	S	*	*			trans	-135.7	155.3	-144.6	41.9	-26.9	0	0	0	123.3
1396	T	38.5	Very low	35.7	Very low	134 Å²	134	117.3 Å²	117.3	82%	0.822	74%	0.741	S	S	*	*			trans	64.5	176.2	148.2	58.3	0	0	0	0	120.6
1397	P	38.9	Very low	35.6	Very low	113 Å²	113	117.8 Å²	117.8	73%	0.734	74%	0.738	S	S	*	*			cis	-140.8	169.2	0.3	44.6	-25.8	0	0	0	120.6
1398	S	32.6	Very low	35.5	Very low	100 Å²	100	117.2 Å²	117.2	70%	0.699	74%	0.735	S	S	*	*			trans	11.3	144.6	150.3	65.3	0	0	0	0	127.8
1399	L	33.6	Very low	34.9	Very low	168 Å²	168	118.9 Å²	118.9	88%	0.88	74%	0.739	S	S	*	*				171.7	178.5	113.7	-93	166.2	0	0	0	116.4
1400	S	31.2	Very low	34.9	Very low	103 Å²	103	118.3 Å²	118.3	72%	0.72	74%	0.736	S	S	*	*			trans	-157.6	-163	-170.8	62.6	0	0	0	0	111.3
1401	P	42.8	Very low	34.6	Very low	100 Å²	100	117.7 Å²	117.7	65%	0.649	73%	0.733	S	S	*	*			cis	-144.9	-166.5	-3.8	39.2	-15.4	0	0	0	117.8
1402	T	33.1	Very low	34.4	Very low	124 Å²	124	118.6 Å²	118.6	76%	0.761	73%	0.73	S	S	*	*			trans	69.3	163.7	152.2	42.5	0	0	0	0	121.3
1403	T	32	Very low	34	Very low	107 Å²	107	119.2 Å²	119.2	66%	0.656	73%	0.729	S	S	*	*			cis	-163	160.3	6.5	-0.2	0	0	0	0	113.6
1404	N	30.7	Very low	33.7	Very low	140 Å²	140	117.9 Å²	117.9	75%	0.749	71%	0.713	S	S	*	*			trans	63.2	158.7	142.7	-69.3	-2.6	0	0	0	122.9
1405	T	31.7	Very low	33.5	Very low	101 Å²	101	120.5 Å²	120.5	62%	0.62	71%	0.71	S	S	*	*			cis	-168	150.4	-17.3	28.6	0	0	0	0	112.9
1406	I	28.7	Very low	32.7	Very low	151 Å²	151	121.9 Å²	121.9	77%	0.774	71%	0.712	S	S	*	*			trans	50.8	127.7	137.9	-57.9	161.9	0	0	0	120.8
1407	A	32.4	Very low	32.5	Very low	79 Å²	79	128.9 Å²	128.9	65%	0.653	73%	0.731	S	S	*	*				161.5	132.8	119.6	0	0	0	0	0	114.2
1408	N	33.3	Very low	32.2	Very low	148 Å²	148	129.7 Å²	129.7	79%	0.791	73%	0.731	S	S	*	*				46.7	150.9	127.1	-60.8	14	0	0	0	122.1
1409	N	28.9	Very low	32.1	Very low	123 Å²	123	131.3 Å²	131.3	66%	0.658	73%	0.732	S	S	*	*			cis	-171.2	177.2	-26.3	-143.8	53.5	0	0	0	107
1410	D	35.7	Very low	32	Very low	136 Å²	136	129.2 Å²	129.2	73%	0.727	72%	0.724	S	S	*	*			trans	65.1	157.7	158.6	-51.9	-33.9	0	0	0	118.3
1411	N	29.8	Very low	32.1	Very low	132 Å²	132	130.8 Å²	130.8	71%	0.706	72%	0.724	S	S	*	*			cis	-156.1	-177.7	-46.7	-156.6	26.6	0	0	0	108.7
1412	D	33.1	Very low	31.4	Very low	110 Å²	110	132.7 Å²	132.7	59%	0.588	73%	0.729	S	S	*	*			trans	66.8	112.6	148.4	-81.8	-57.2	0	0	0	121.5
1413	N	29.5	Very low	31.3	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	73%	0.727	S	S	*	*				53.3	125.5	121.7	-82.5	-58.6	0	0	0	119.4
1414	S	30	Very low	31.3	Very low	83 Å²	83	135.1 Å²	135.1	58%	0.58	73%	0.732	S	S	*	*			cis	164.4	172.1	33.9	52.9	0	0	0	0	110.8
1415	N	30.8	Very low	31.3	Very low	125 Å²	125	134.8 Å²	134.8	67%	0.668	73%	0.731	S	S	*	*			trans	66.5	100.2	148.3	-66.9	-42.2	0	0	0	121.4
1416	N	29.8	Very low	31.3	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	74%	0.74	S	S	*	*				64.2	114.1	120.9	-51.9	-24.6	0	0	0	120.4
1417	K	33.6	Very low	31.5	Very low	282 Å²	282	136.4 Å²	136.4	100%	1.226	74%	0.737	S	S	*	*				-150	0	99.7	-115.9	174.7	-177.1	175.1	0	112.8

Retrieved 1,417 of 1,417 residues in 158.5 ms (Link to these results)

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