A0A087XAA1_POEFO Loading...

Methylcytosine dioxygenase TET

Dioxygenase that catalyzes the conversion of the modified genomic base 5-methylcytosine (5mC) into 5-hydroxymethylcytosine (5hmC) and plays a key role in epigenetic chromatin reprogramming during embryonic development.

AlphaFold DB , UniProt , Accession A0A087XAA1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,228 aa.

						>A0A087XAA1_POEFO|A0A087XAA1
NGPKASPDDVSLPLKKIKLEEPWLWITEQTTTQLTRQDDDTCEDPLSMLAAVVCLSVTERKGLEEKLLGTQKDELKKNTPANLQRTPQPIKSEPPQSVLLPSVQSLAERRNLSFDQAIAIEALTQLAVIPQSPSGPIKAESNGEHPISSSSPGFHTNPAQQAAKRASAIHYNKVSVISSPLHQTSVIRPPVARQGNVIQCSRRLSSDTKPSVEEMPSNCRGTNQSQSPYVIHSQCSYEDSSRGHERLGEDRERCVIKMRRNRDEEEVAAQLAELAFIIQARHNQQSDNGPPKGTPVSAIKYNYKSQQSPCQKKPPLKKTKTTPSKPRKKKSDGLQEGASRRTGQGGETPHRSRGQNGLPHGKSSRQPKNNFFLPLAQIDLKKYLAEAQEGRRQLIHQSNIHNTSLSQNPNNLFTTNHTGAGENHQWSLPNGLPLPHNQCNGFVAGPAESHVLSQVAPPAGELQHGTHPIASPAKPAFTSNVNGFRVLSNGFSGPPDSPPPSQQNYYKLETSGSVTVLSTATDGAHPVESTPTRNGVNSFLESPMSFLDTPIKNLLSTPSKKLADLPSCHCVDQVIEKEEGPYYTHLGAGPNVAAVREMMENRYGAKGNAVRVEVVVYTGKEGKSSQGCPIAKWVIRRGSEEEKLLCLVRQRPGHYCDTAVLVILILAWEGIPRTVADHLYQDLTETLFKYGSPTSRRCALNEDRTCACQGLNPDTCGASFSFGCSWSMYFNGCKFARSKVPRKFRLLGDLREEEAKIESNLQSLATDLAPLYKKLAPVAFQNQVECEAAGDACRLGRMEGRPFSGVTACVDFCAHAHKDTSNMNNGSTVVCTLTKEDNRAVRNIPEDEQLHVLPLYKISDKDEFGQVEGQWAKIRSGALHVLSSFPREVRLLAEPVKSARKIRQEARLKAQAEKMEKKLGMSSLTPGKVKSETPNKGSTAHLIIRTFLLFHSVSSCSSPGAGIASQREVLPSSHHSVSNLQFKHNGVAVGYHTAGATMSGLTPASGEQGALLERIPPQNLNNDFPFKAEPSEMHAQWTSSGCRRCCRRGQSLPLQTPPLEEPQQAKQEEVWSDSEHNFLDEDIGGVAVAPSHGSILIECARRELHATTPILKPNRRHPTRISLVFYQHKALNEPGHGMAMWDAKMAKREREREEEAERLRMEGSGGAGKNRKTSGGREGEEDEDKETAEARRVMNVPTRQAFTAPTGGVITVSPYALTHVTGPYNRWS
					

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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	N	27.8	Very low	39.6	Very low	168 Å²	168	124.4 Å²	124.4	90%	0.898	76%	0.755	S	S	*	*				0	136.7	0	-61.8	-9.5	0	0	0	109	A996 T997	N1-A996 PolarHBondContact N-O 2.63Å; N1-T997 PolarHBondContact N-O 3.48Å; N1-T997 PolarHBondContact O-OG1 2.66Å
2	G	39.9	Very low	38.6	Very low	52 Å²	52	127.1 Å²	127.1	54%	0.536	76%	0.76	S	S	.	*			trans	-89.6	-160.8	165.8	0	0	0	0	0	111.5
3	P	65.4	Low	39.4	Very low	119 Å²	119	125 Å²	125	77%	0.773	75%	0.752	S	S	*	*			cis	-99	169.5	11.2	2.8	21.2	0	0	0	113.5
4	K	46.1	Very low	38.5	Very low	205 Å²	205	126.9 Å²	126.9	89%	0.891	76%	0.755	S	S	*	*			cis	68.8	153.7	48	-51.8	-175.1	174	-173.2	0	113.7
5	A	40.6	Very low	37.8	Very low	90 Å²	90	131.7 Å²	131.7	74%	0.744	76%	0.762	S	S	*	*			cis	-157.7	179.5	7.6	0	0	0	0	0	108.8
6	S	36.8	Very low	37.7	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	77%	0.77	S	S	*	*			cis	-169.3	162.1	-14.1	36.5	0	0	0	0	109.7
7	P	61.1	Low	37.1	Very low	108 Å²	108	138.6 Å²	138.6	70%	0.701	78%	0.778	S	S	*	*			trans	-103.4	-173.8	177.1	33.3	-17.9	0	0	0	113.6
8	D	33.5	Very low	36.6	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	78%	0.779	S	S	*	*			trans	153.2	147.4	131.7	-75.7	-21.4	0	0	0	115.1
9	D	26.2	Very low	36.1	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	77%	0.774	S	S	*	*			trans	-160.7	106.3	171.4	-158.6	36.8	0	0	0	107
10	V	30	Very low	35.5	Very low	124 Å²	124	141.7 Å²	141.7	75%	0.752	77%	0.774	S	S	*	*				72.8	141.3	71.7	-179.5	0	0	0	0	114.7
11	S	28.7	Very low	35.1	Very low	86 Å²	86	143.3 Å²	143.3	60%	0.601	78%	0.776	S	S	*	*				-163.2	155.7	-55.7	72.1	0	0	0	0	112.6
12	L	26.7	Very low	35.8	Very low	157 Å²	157	139.6 Å²	139.6	82%	0.822	76%	0.761	S	S	*	*			trans	68.4	172.4	152.2	-63.9	167.9	0	0	0	119.2
13	P	49.3	Very low	35	Very low	100 Å²	100	147 Å²	147	65%	0.649	77%	0.773	S	S	*	*				-142.4	159.3	-54.6	41.4	-25.9	0	0	0	118.7
14	L	27.7	Very low	33	Very low	151 Å²	151	147.1 Å²	147.1	79%	0.791	77%	0.766	S	S	*	*			trans	66.3	126.9	139.1	-71.5	167.1	0	0	0	125.7
15	K	27.9	Very low	32.1	Very low	199 Å²	199	147.1 Å²	147.1	87%	0.865	76%	0.761	S	S	*	*			trans	86.9	154.2	140.6	-77.1	178.1	177.9	179.6	0	121.6
16	K	35.3	Very low	31.6	Very low	204 Å²	204	149.6 Å²	149.6	89%	0.887	76%	0.76	S	S	*	*			trans	-107.2	152.7	-168.3	-57.9	178.8	178.3	-177.7	0	112.5
17	I	28.3	Very low	31.3	Very low	178 Å²	178	148.9 Å²	148.9	91%	0.913	75%	0.751	S	S	*	*			trans	-130.2	170.6	164.5	-66.6	-176.8	0	0	0	109.1
18	K	26.8	Very low	29.8	Very low	183 Å²	183	151.7 Å²	151.7	80%	0.796	76%	0.755	S	S	*	*			trans	-128.5	-170.2	-168.7	-157.1	-170.6	177.4	-166.1	0	110
19	L	27.5	Very low	29.7	Very low	130 Å²	130	152 Å²	152	68%	0.681	75%	0.751	S	S	*	*			trans	77.8	148.5	172.8	-90.5	68.2	0	0	0	115.5
20	E	23.9	Very low	29.7	Very low	164 Å²	164	150.3 Å²	150.3	77%	0.766	75%	0.747	S	S	*	*			cis	-151.4	-164.5	-11	-151.4	145.9	-128.8	0	0	111.1
21	E	28.4	Very low	29.5	Very low	176 Å²	176	150 Å²	150	82%	0.822	75%	0.745	S	S	*	*			trans	-81.2	-156.4	-173	-35.2	-175.7	131.3	0	0	113.1
22	P	41.6	Very low	29.5	Very low	90 Å²	90	150.9 Å²	150.9	58%	0.584	75%	0.747	S	S	*	*			cis	-147.8	-174.4	19.1	27.1	3.2	0	0	0	119
23	W	23.5	Very low	29.5	Very low	207 Å²	207	151.3 Å²	151.3	78%	0.784	75%	0.745	S	S	*	*			trans	71.3	131.1	168.4	-43.6	100.2	0	0	0	117.6
24	L	23.6	Very low	28.4	Very low	121 Å²	121	152.8 Å²	152.8	63%	0.634	75%	0.747	S	S	*	*			cis	80.2	144.4	34.1	-56.1	175.6	0	0	0	113.7
25	W	27.7	Very low	28.3	Very low	206 Å²	206	151.7 Å²	151.7	78%	0.78	75%	0.746	S	S	*	*			cis	-162	-175.9	14.1	-135.6	-23	0	0	0	113.8
26	I	28.4	Very low	28.3	Very low	141 Å²	141	152.9 Å²	152.9	72%	0.723	75%	0.746	S	S	*	*			trans	80.5	136.3	156.9	-76	161.7	0	0	0	120
27	T	31.7	Very low	27.9	Very low	96 Å²	96	151.4 Å²	151.4	59%	0.589	74%	0.742	S	S	*	*			cis	-98.4	-132.6	-0.1	-20.9	0	0	0	0	112.3
28	E	29.1	Very low	27.9	Very low	167 Å²	167	149.3 Å²	149.3	78%	0.78	73%	0.732	S	S	*	*			cis	-145.5	-170.3	-2.2	-151.5	99	-94.5	0	0	110.8
29	Q	30.4	Very low	27.9	Very low	160 Å²	160	148.3 Å²	148.3	75%	0.748	74%	0.736	S	S	*	*			trans	-139	161.3	-167	-56.1	-177.6	2.4	0	0	109.7
30	T	26.3	Very low	28	Very low	116 Å²	116	149.2 Å²	149.2	71%	0.712	74%	0.741	S	S	*	*			cis	-164.2	119.1	42.4	-43.3	0	0	0	0	111.8
31	T	27.6	Very low	28.3	Very low	117 Å²	117	147.1 Å²	147.1	72%	0.718	74%	0.74	S	S	*	*				56	130.9	128.8	-42.3	0	0	0	0	119.4
32	T	27.5	Very low	28.5	Very low	105 Å²	105	144.9 Å²	144.9	64%	0.644	74%	0.742	S	S	*	*			cis	-163.6	146	17.9	0.6	0	0	0	0	112.6
33	Q	27.5	Very low	28.1	Very low	166 Å²	166	147.1 Å²	147.1	78%	0.776	75%	0.745	S	S	*	*			trans	55.7	151.9	140	-70.4	-178.2	27.8	0	0	121.2
34	L	26.7	Very low	28.9	Very low	131 Å²	131	141.1 Å²	141.1	69%	0.686	73%	0.728	S	S	*	*			cis	-157.6	145.2	6.3	-129.5	170.7	0	0	0	112.6
35	T	25.3	Very low	29.8	Very low	128 Å²	128	140.4 Å²	140.4	79%	0.785	73%	0.731	S	S	*	*			trans	79.2	150.3	156.8	3.8	0	0	0	0	122.4
36	R	27.6	Very low	30.6	Very low	225 Å²	225	136.2 Å²	136.2	85%	0.849	72%	0.723	S	S	*	*			trans	-55.6	164.8	170.7	-80.2	174.7	166.6	165.9	-6.5	113.2
37	Q	26	Very low	31.3	Very low	172 Å²	172	132.7 Å²	132.7	80%	0.804	71%	0.711	S	S	*	*			cis	-150.8	175.3	36.9	-161.3	161.7	-23.8	0	0	114.1
38	D	28.3	Very low	31.8	Very low	134 Å²	134	134.9 Å²	134.9	72%	0.717	72%	0.716	S	S	*	*			trans	-70.4	143.8	-166.1	-33.4	-94.7	0	0	0	115.2
39	D	27.6	Very low	32.4	Very low	162 Å²	162	132.6 Å²	132.6	87%	0.866	71%	0.709	S	S	*	*				-162.4	159.5	118.3	-137.3	-23.9	0	0	0	111.6
40	D	29.8	Very low	32.9	Very low	150 Å²	150	127.6 Å²	127.6	80%	0.802	70%	0.695	S	S	*	*			trans	-92.2	133.9	-178	-109.4	-40.4	0	0	0	112.4
41	T	30.5	Very low	33.6	Very low	120 Å²	120	124.5 Å²	124.5	74%	0.736	68%	0.681	S	S	*	*			trans	-153	100.6	164.1	-55.3	0	0	0	0	111
42	C	30.9	Very low	34.3	Very low	129 Å²	129	123.5 Å²	123.5	87%	0.872	67%	0.674	S	S	*	*			trans	-92.9	113	172.2	-174.2	0	0	0	0	110.3
43	E	33.5	Very low	35	Very low	137 Å²	137	123 Å²	123	64%	0.64	67%	0.671	S	S	*	*			trans	-68.8	156.1	-176.7	-87.1	-66.8	150.8	0	0	115
44	D	41.7	Very low	35.5	Very low	80 Å²	80	119.3 Å²	119.3	43%	0.428	66%	0.662	S	S	.	*			trans	-81.2	127.4	-173.3	-178.1	-5.2	0	0	0	112.4	L46 S47	D44-L46 PolarHBondContact O-N 3.35Å; D44-L46 WeakPolarHBondContact OD1-CB 3.14Å; D44-L46 PolarHBondContact OD1-N 3.03Å; D44-S47 WeakPolarHBondContact O-CB 2.96Å; D44-S47 PolarHBondContact O-N 3.46Å
45	P	42.2	Very low	35.9	Very low	106 Å²	106	119.5 Å²	119.5	69%	0.688	66%	0.664	S	S	*	*	H	α-helix	trans	-50.9	-26.5	170.7	-28.6	36.1	0	0	0	115.4	M48 L49	P45-M48 PolarHBondContact O-N 3.16Å; P45-L49 PolarHBondContact O-N 3.04Å
46	L	44.5	Very low	36.5	Very low	119 Å²	119	117.9 Å²	117.9	62%	0.623	66%	0.657	S	S	*	*	H	α-helix	trans	-69.1	-32	176.4	-66.2	167.3	0	0	0	112.9	D44 M48 L49 A50	D44-L46 PolarHBondContact O-N 3.35Å; D44-L46 WeakPolarHBondContact OD1-CB 3.14Å; D44-L46 PolarHBondContact OD1-N 3.03Å; L46-M48 VanDerWaalsContact C-N 3.31Å; L46-M48 PolarHBondContact O-N 2.91Å; L46-L49 PolarHBondContact O-N 3.36Å; L46-A50 PolarHBondContact O-N 2.9Å
47	S	42.1	Very low	36.9	Very low	66 Å²	66	112.7 Å²	112.7	46%	0.462	65%	0.65	S	S	.	*	H	α-helix	trans	-62.5	-39.9	173.7	-67.5	0	0	0	0	111.3	D44 A50 A51	D44-S47 WeakPolarHBondContact O-CB 2.96Å; D44-S47 PolarHBondContact O-N 3.46Å; S47-A50 PolarHBondContact O-N 3.47Å; S47-A51 PolarHBondContact O-N 3.43Å; S47-A51 VanDerWaalsContact O-N 3.1Å
48	M	42.8	Very low	37.4	Very low	143 Å²	143	109.8 Å²	109.8	70%	0.704	64%	0.644	S	S	*	*	H	α-helix	trans	-69.9	-35.6	176.7	-165.8	168.3	-71	0	0	112	P45 L46 A51 V52	P45-M48 PolarHBondContact O-N 3.16Å; L46-M48 VanDerWaalsContact C-N 3.31Å; L46-M48 PolarHBondContact O-N 2.91Å; M48-A51 PolarHBondContact O-N 2.69Å; M48-V52 WeakPolarHBondContact O-CG2 3.34Å; M48-V52 PolarHBondContact O-N 3.32Å
49	L	42.2	Very low	37.9	Very low	119 Å²	119	112.1 Å²	112.1	62%	0.623	65%	0.651	S	S	*	*	H	α-helix	trans	-65.5	-40.1	173.1	-132	83.6	0	0	0	112	P45 L46 V52 V53	P45-L49 PolarHBondContact O-N 3.04Å; L46-L49 PolarHBondContact O-N 3.36Å; L49-V52 PolarHBondContact O-N 3.46Å; L49-V53 WeakPolarHBondContact O-CG2 2.84Å; L49-V53 PolarHBondContact O-N 2.72Å; L49-V53 VanDerWaalsContact O-N 3.13Å
50	A	40.3	Very low	38.2	Very low	55 Å²	55	115.9 Å²	115.9	46%	0.455	65%	0.653	S	S	.	*	H	α-helix	trans	-62.1	-43.5	176.3	0	0	0	0	0	111.8	L46 S47 V52 V53 C54	L46-A50 PolarHBondContact O-N 2.9Å; S47-A50 PolarHBondContact O-N 3.47Å; A50-V52 PolarHBondContact O-N 3.18Å; A50-V53 PolarHBondContact O-N 3.44Å; A50-C54 PolarHBondContact O-N 3.35Å; A50-C54 PolarHBondContact O-SG 3.31Å
51	A	40.8	Very low	38.4	Very low	51 Å²	51	118.8 Å²	118.8	42%	0.421	66%	0.659	S	S	.	*	H	α-helix	trans	-59	-44.7	176.5	0	0	0	0	0	112.7	S47 M48 V53 C54 L55	S47-A51 PolarHBondContact O-N 3.43Å; S47-A51 VanDerWaalsContact O-N 3.1Å; M48-A51 PolarHBondContact O-N 2.69Å; A51-V53 PolarHBondContact O-N 3.04Å; A51-C54 PolarHBondContact O-N 3.43Å; A51-L55 WeakPolarHBondContact O-CG 3.5Å; A51-L55 PolarHBondContact O-N 3.42Å
52	V	42.3	Very low	38.8	Very low	96 Å²	96	116.9 Å²	116.9	58%	0.582	66%	0.662	S	S	*	*	H	α-helix	trans	-66.5	-35.6	179.2	173.5	0	0	0	0	112.3	M48 L49 A50 S56	M48-V52 WeakPolarHBondContact O-CG2 3.34Å; M48-V52 PolarHBondContact O-N 3.32Å; L49-V52 PolarHBondContact O-N 3.46Å; A50-V52 PolarHBondContact O-N 3.18Å; V52-S56 PolarHBondContact O-OG 3.06Å; V52-S56 VanDerWaalsContact O-OG 3.07Å
53	V	43.6	Very low	38.6	Very low	93 Å²	93	118.8 Å²	118.8	56%	0.564	66%	0.663	S	S	*	*	H	α-helix	trans	-72.6	-36.1	175.1	174.3	0	0	0	0	111.8	L49 A50 A51 S56	L49-V53 WeakPolarHBondContact O-CG2 2.84Å; L49-V53 PolarHBondContact O-N 2.72Å; L49-V53 VanDerWaalsContact O-N 3.13Å; A50-V53 PolarHBondContact O-N 3.44Å; A51-V53 PolarHBondContact O-N 3.04Å; V53-S56 PolarHBondContact O-OG 2.91Å
54	C	36.7	Very low	38.4	Very low	89 Å²	89	122 Å²	122	60%	0.601	68%	0.678	S	S	*	*	H	α-helix	trans	-68.9	-35.2	175.8	-75.2	0	0	0	0	113.2	A50 A51 S56	A50-C54 PolarHBondContact O-N 3.35Å; A50-C54 PolarHBondContact O-SG 3.31Å; A51-C54 PolarHBondContact O-N 3.43Å; C54-S56 PolarHBondContact O-N 2.9Å
55	L	35	Very low	37.8	Very low	136 Å²	136	127 Å²	127	71%	0.712	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-10.9	179.2	-75.7	168.5	0	0	0	114.7	A51	A51-L55 WeakPolarHBondContact O-CG 3.5Å; A51-L55 PolarHBondContact O-N 3.42Å
56	S	38.8	Very low	37.2	Very low	94 Å²	94	131.5 Å²	131.5	66%	0.657	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	10.2	-177.8	43.6	0	0	0	0	114.5	V52 V53 C54	V52-S56 PolarHBondContact O-OG 3.06Å; V52-S56 VanDerWaalsContact O-OG 3.07Å; V53-S56 PolarHBondContact O-OG 2.91Å; C54-S56 PolarHBondContact O-N 2.9Å
57	V	36.4	Very low	36.4	Very low	115 Å²	115	134.1 Å²	134.1	70%	0.697	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-19.3	-178.2	-179.4	0	0	0	0	113.4
58	T	35.1	Very low	35.6	Very low	111 Å²	111	139.6 Å²	139.6	68%	0.681	75%	0.745	S	S	*	*	S	Bend	trans	-83	-22.9	-174	38.4	0	0	0	0	115.5	R60	T58-R60 PolarHBondContact O-N 2.88Å
59	E	38.9	Very low	34.7	Very low	183 Å²	183	136.2 Å²	136.2	86%	0.855	75%	0.746	S	S	*	*	S	Bend	trans	-100.6	71.5	-179.8	-67.8	-160.7	139.5	0	0	113.4
60	R	34.8	Very low	33.9	Very low	241 Å²	241	137.3 Å²	137.3	91%	0.909	76%	0.758	S	S	*	*	S	Bend	trans	-153.5	19.3	163.4	-124.1	174.3	-155.6	138.5	9	118.1	T58	T58-R60 PolarHBondContact O-N 2.88Å
61	K	34.2	Very low	33.1	Very low	212 Å²	212	144 Å²	144	92%	0.922	78%	0.78	S	S	*	*	S	Bend	trans	-142.2	92.5	166.3	-77.4	-167.3	174.9	-175.7	0	110.4
62	G	37.3	Very low	32.3	Very low	79 Å²	79	150.9 Å²	150.9	81%	0.814	80%	0.8	S	S	*	*	S	Bend	trans	164.4	18.7	178.5	0	0	0	0	0	117.4
63	L	28.1	Very low	31.4	Very low	169 Å²	169	153.4 Å²	153.4	89%	0.885	81%	0.81	S	S	*	*			trans	-148.1	42.8	-177.9	-140.6	121.5	0	0	0	115.5
64	E	29.9	Very low	30.6	Very low	205 Å²	205	155.2 Å²	155.2	96%	0.958	81%	0.813	S	S	*	*	S	Bend	trans	-127.1	38	164.2	-77	-161.6	132.8	0	0	111.9
65	E	29	Very low	30	Very low	184 Å²	184	156.8 Å²	156.8	86%	0.86	82%	0.815	S	S	*	*	S	Bend	trans	-139.4	60.7	175.1	-155.5	174.2	-130.9	0	0	113.1
66	K	28.2	Very low	29.5	Very low	202 Å²	202	157.8 Å²	157.8	88%	0.878	81%	0.813	S	S	*	*	S	Bend	trans	176.6	84.9	152.8	-99.7	156.8	-174.9	172.8	0	111.2
67	L	27.8	Very low	28.8	Very low	174 Å²	174	161.9 Å²	161.9	91%	0.911	82%	0.819	S	S	*	*			trans	-171	40.6	149.9	-109.1	168.8	0	0	0	114.6
68	L	24.9	Very low	28.1	Very low	181 Å²	181	163.2 Å²	163.2	95%	0.948	82%	0.822	S	S	*	*			trans	-125.3	102.5	159.9	-86.1	175.6	0	0	0	109.7
69	G	24.1	Very low	27.8	Very low	72 Å²	72	164.3 Å²	164.3	74%	0.742	83%	0.829	S	S	*	*			trans	-79.6	145.8	173.7	0	0	0	0	0	111.9	Q71	G69-Q71 PolarHBondContact O-N 3.39Å
70	T	25.9	Very low	27.7	Very low	141 Å²	141	161.2 Å²	161.2	87%	0.865	83%	0.825	S	S	*	*			trans	-41.9	127.8	167.8	45.1	0	0	0	0	114.8
71	Q	23.9	Very low	27.2	Very low	196 Å²	196	154 Å²	154	92%	0.916	82%	0.817	S	S	*	*				-157.7	146.3	114.4	-115.8	179.4	2.2	0	0	112	G69	G69-Q71 PolarHBondContact O-N 3.39Å
72	K	23.5	Very low	26.9	Very low	195 Å²	195	151 Å²	151	85%	0.848	81%	0.811	S	S	*	*			trans	-161.3	118.5	176	-177.1	-174.2	-177.3	-175.3	0	108.6
73	D	24.2	Very low	26.4	Very low	149 Å²	149	154.4 Å²	154.4	80%	0.797	81%	0.81	S	S	*	*			trans	-165.4	122.4	163.7	-98.1	-21	0	0	0	105.9
74	E	27	Very low	26.2	Very low	131 Å²	131	155.9 Å²	155.9	61%	0.612	81%	0.812	S	S	*	*				76.6	130.1	98.3	-77	-112.2	142.8	0	0	114.2	K76	E74-K76 IonicContact OE2-NZ 3.87Å; E74-K76 PolarHBondContact OE2-NZ 3.28Å
75	L	24	Very low	26.1	Very low	123 Å²	123	156.7 Å²	156.7	64%	0.644	81%	0.806	S	S	*	*			cis	-147	-112.9	-17.1	-161.7	72.9	0	0	0	108.4
76	K	23.9	Very low	25.7	Very low	156 Å²	156	153.7 Å²	153.7	68%	0.678	80%	0.801	S	S	*	*			cis	-121.7	-143	-11.1	-128.8	91.6	-144.4	152.5	0	108.5	E74	E74-K76 IonicContact OE2-NZ 3.87Å; E74-K76 PolarHBondContact OE2-NZ 3.28Å
77	K	24.2	Very low	26.2	Very low	181 Å²	181	150.1 Å²	150.1	79%	0.787	80%	0.798	S	S	*	*			trans	-152.4	148.1	-168.7	-150.3	-171.9	177.9	-179.5	0	112.6
78	N	21.7	Very low	26.3	Very low	142 Å²	142	150 Å²	150	76%	0.759	79%	0.793	S	S	*	*			trans	122.4	131.5	143.8	-62.4	-26.6	0	0	0	119.8
79	T	28.3	Very low	26.5	Very low	135 Å²	135	146.6 Å²	146.6	83%	0.828	78%	0.782	S	S	*	*			trans	-91.3	168.7	156.1	-4.9	0	0	0	0	109.8
80	P	37.3	Very low	26.6	Very low	118 Å²	118	149.6 Å²	149.6	77%	0.766	78%	0.779	S	S	*	*				-160.4	178.5	66.4	44.2	-21.8	0	0	0	120.2
81	A	24.8	Very low	26.5	Very low	89 Å²	89	152.2 Å²	152.2	74%	0.736	78%	0.778	S	S	*	*			trans	70.4	102.2	140.9	0	0	0	0	0	125.8
82	N	26.6	Very low	26.5	Very low	150 Å²	150	148.4 Å²	148.4	80%	0.802	77%	0.774	S	S	*	*				71.3	149.7	104.2	-147.2	9.9	0	0	0	125.1
83	L	28.3	Very low	26.5	Very low	149 Å²	149	146.5 Å²	146.5	78%	0.78	77%	0.768	S	S	*	*			trans	75.9	111.6	159.9	-70.7	176.5	0	0	0	123.8
84	Q	23.4	Very low	27.3	Very low	200 Å²	200	144.3 Å²	144.3	94%	0.935	76%	0.761	S	S	*	*				-159.1	179.6	125	-116.7	-174.4	13.1	0	0	112.5
85	R	26.5	Very low	27.8	Very low	223 Å²	223	144.1 Å²	144.1	84%	0.842	77%	0.772	S	S	*	*			trans	-152	138.5	-155.1	-161.7	-163.3	-167.2	-178.4	4.8	116.5
86	T	22	Very low	28.2	Very low	121 Å²	121	145.4 Å²	145.4	74%	0.742	78%	0.775	S	S	*	*			trans	65.3	164.6	158.5	34.7	0	0	0	0	118.5
87	P	37.9	Very low	28.4	Very low	126 Å²	126	143.5 Å²	143.5	82%	0.818	78%	0.781	S	S	*	*			cis	-124.6	-162.1	7.9	41	-23.4	0	0	0	116.4
88	Q	29.9	Very low	28.9	Very low	172 Å²	172	141.3 Å²	141.3	80%	0.804	78%	0.782	S	S	*	*			trans	-131.2	160.2	-168	-100.7	-91.8	-10.2	0	0	111.8
89	P	30.3	Very low	29.6	Very low	110 Å²	110	141.7 Å²	141.7	71%	0.714	78%	0.784	S	S	*	*			trans	-149.6	115.4	133	34.8	-15.6	0	0	0	118.6
90	I	25.2	Very low	30.5	Very low	135 Å²	135	140.1 Å²	140.1	69%	0.692	77%	0.769	S	S	*	*				68.4	130.5	119.4	-63.6	170.9	0	0	0	122.1
91	K	23.1	Very low	31.1	Very low	195 Å²	195	137.7 Å²	137.7	85%	0.848	75%	0.754	S	S	*	*			trans	76	144.8	164.5	-74.6	160.8	-169.6	176.1	0	117.9
92	S	24.1	Very low	33.2	Very low	116 Å²	116	137 Å²	137	81%	0.811	74%	0.743	S	S	*	*			cis	-161	157.9	-4.5	41.9	0	0	0	0	113.4
93	E	23.4	Very low	35	Very low	156 Å²	156	131.1 Å²	131.1	73%	0.729	71%	0.713	S	S	*	*			trans	-107.4	175.5	171.1	-124.9	-161.5	136.9	0	0	110.3
94	P	42.4	Very low	36.8	Very low	102 Å²	102	129.3 Å²	129.3	66%	0.662	70%	0.7	S	S	*	*			cis	-123.8	-139.1	-10.8	45.6	-27.4	0	0	0	110
95	P	36.8	Very low	39	Very low	128 Å²	128	121.5 Å²	121.5	83%	0.831	67%	0.668	S	S	*	*			cis	-109.4	170.8	16.2	42.2	-34.2	0	0	0	115.9
96	Q	32	Very low	40.9	Very low	150 Å²	150	112.4 Å²	112.4	70%	0.701	64%	0.636	S	S	*	*			trans	-106.4	135.2	178.5	-62.1	175.6	-5.6	0	0	113.5
97	S	27.9	Very low	43.3	Very low	116 Å²	116	107.1 Å²	107.1	81%	0.811	60%	0.604	S	S	*	*			trans	-168.7	132.8	148.1	59.8	0	0	0	0	109.4
98	V	34.4	Very low	44.7	Very low	135 Å²	135	107 Å²	107	82%	0.818	59%	0.593	S	S	*	*			cis	-129.7	124.4	-8.9	177.6	0	0	0	0	107.7
99	L	37.1	Very low	46.7	Very low	150 Å²	150	109 Å²	109	79%	0.785	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-86.9	125.9	174.5	-73.2	169.5	0	0	0	110.8
100	L	46.9	Very low	48.7	Very low	101 Å²	101	112.8 Å²	112.8	53%	0.529	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-68.9	142.1	164.1	-80.2	165.5	0	0	0	109.6
101	P	49.8	Very low	50.8	Low	67 Å²	67	113.8 Å²	113.8	44%	0.435	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-69.9	132.6	174.2	-9.4	25.2	0	0	0	109.5	L106	P101-L106 HydrophobicContact CB-CD1 4.46Å; P101-L106 HydrophobicContact CG-CD1 4.42Å
102	S	68.8	Low	53.1	Low	74 Å²	74	107.1 Å²	107.1	52%	0.517	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-60.5	145.3	176.1	58.6	0	0	0	0	112.3	Q104 S105 L106	S102-Q104 PolarHBondContact O-N 3.24Å; S102-S105 WeakPolarHBondContact O-CA 3.43Å; S102-S105 WeakPolarHBondContact O-CB 3.18Å; S102-S105 PolarHBondContact O-N 3.49Å; S102-L106 PolarHBondContact O-N 3.46Å
103	V	64.7	Low	55.7	Low	27 Å²	27	104.1 Å²	104.1	16%	0.164	55%	0.552	C	S	.	*	H	α-helix	trans	-27.6	-52.3	171.9	-179.6	0	0	0	0	113.7	L106 A107 F114 A117 I118 E121	V103-L106 WeakPolarHBondContact O-CB 3.48Å; V103-L106 PolarHBondContact O-N 3.18Å; V103-A107 WeakPolarHBondContact O-CB 3.43Å; V103-A107 PolarHBondContact O-N 3.42Å; V103-F114 HydrophobicContact CB-CE2 4.42Å; V103-F114 HydrophobicContact CB-CZ 4.3Å; V103-F114 HydrophobicContact CG1-CD1 4.23Å; V103-F114 HydrophobicContact CG1-CD2 3.98Å; V103-F114 HydrophobicContact CG1-CE1 3.94Å; V103-F114 HydrophobicContact CG1-CE2 3.68Å; V103-F114 HydrophobicContact CG1-CG 4.26Å; V103-F114 HydrophobicContact CG1-CZ 3.65Å; V103-A117 HydrophobicContact CG1-CB 3.75Å; V103-A117 WeakPolarHBondContact O-CB 3.42Å; V103-I118 HydrophobicContact CG1-CG1 3.56Å; V103-I118 HydrophobicContact CG2-CG1 4.18Å; V103-E121 WeakPolarHBondContact CA-OE2 3.45Å; V103-E121 HydrophobicContact CG2-CB 4.45Å; V103-E121 WeakPolarHBondContact CG2-OE2 3.44Å; V103-E121 PolarHBondContact N-OE2 2.83Å
104	Q	66.4	Low	58	Low	111 Å²	111	101.8 Å²	101.8	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-65.4	-44.4	-177.1	-171.8	170.5	-10.4	0	0	112.8	S102 L106 A107 E108 F114	S102-Q104 PolarHBondContact O-N 3.24Å; Q104-L106 VanDerWaalsContact C-N 3.27Å; Q104-L106 PolarHBondContact O-N 2.89Å; Q104-A107 PolarHBondContact O-N 2.97Å; Q104-E108 HydrophobicContact CG-CG 4.41Å; Q104-E108 WeakPolarHBondContact CG-OE1 3.45Å; Q104-E108 PolarHBondContact NE2-OE1 3.49Å; Q104-E108 WeakPolarHBondContact O-CB 3.41Å; Q104-E108 WeakPolarHBondContact O-CG 3.34Å; Q104-E108 PolarHBondContact O-N 3.42Å; Q104-F114 HydrophobicContact CB-CE2 3.96Å; Q104-F114 HydrophobicContact CG-CE2 4.39Å
105	S	70.5	Confident	59.3	Low	36 Å²	36	102.8 Å²	102.8	25%	0.252	54%	0.54	S	S	.	.	H	α-helix	trans	-62.9	-35.7	173.7	-176	0	0	0	0	111.5	S102 R109	S102-S105 WeakPolarHBondContact O-CA 3.43Å; S102-S105 WeakPolarHBondContact O-CB 3.18Å; S102-S105 PolarHBondContact O-N 3.49Å; S105-R109 WeakPolarHBondContact O-CB 3.37Å; S105-R109 VanDerWaalsContact O-CG 3.31Å; S105-R109 WeakPolarHBondContact O-CG 3.47Å; S105-R109 PolarHBondContact O-N 3.18Å
106	L	64.9	Low	60.9	Low	33 Å²	33	101.7 Å²	101.7	17%	0.173	52%	0.524	C	S	.	.	H	α-helix	trans	-69.3	-41.4	176.8	-154	81	0	0	0	112.2	P101 S102 V103 Q104 R110 A117 I120	P101-L106 HydrophobicContact CB-CD1 4.46Å; P101-L106 HydrophobicContact CG-CD1 4.42Å; S102-L106 PolarHBondContact O-N 3.46Å; V103-L106 WeakPolarHBondContact O-CB 3.48Å; V103-L106 PolarHBondContact O-N 3.18Å; Q104-L106 VanDerWaalsContact C-N 3.27Å; Q104-L106 PolarHBondContact O-N 2.89Å; L106-R110 PolarHBondContact O-N 3.31Å; L106-A117 HydrophobicContact CB-CB 4.38Å; L106-A117 HydrophobicContact CD2-CB 4.44Å; L106-I120 HydrophobicContact CD2-CB 4.35Å; L106-I120 HydrophobicContact CD2-CG2 3.88Å
107	A	72.6	Confident	63.1	Low	9 Å²	9	94.6 Å²	94.6	7%	0.074	49%	0.49	C	S	.	.	H	α-helix	trans	-64.2	-54.8	175.5	0	0	0	0	0	111.3	V103 Q104 R110 N111 L112 F114 A117	V103-A107 WeakPolarHBondContact O-CB 3.43Å; V103-A107 PolarHBondContact O-N 3.42Å; Q104-A107 PolarHBondContact O-N 2.97Å; A107-R110 PolarHBondContact O-N 3.39Å; A107-N111 WeakPolarHBondContact O-CA 3.45Å; A107-N111 PolarHBondContact O-N 3.35Å; A107-L112 PolarHBondContact O-N 3.35Å; A107-L112 VanDerWaalsContact O-N 3.09Å; A107-F114 HydrophobicContact CB-CD2 4.41Å; A107-A117 HydrophobicContact CB-CB 3.87Å
108	E	68.2	Low	65.3	Low	124 Å²	124	92.7 Å²	92.7	58%	0.579	47%	0.47	S	S	*	.	H	α-helix	trans	-64.7	-44.7	-176.6	-70.5	173.6	-168.5	0	0	112.4	Q104 R110	Q104-E108 HydrophobicContact CG-CG 4.41Å; Q104-E108 WeakPolarHBondContact CG-OE1 3.45Å; Q104-E108 PolarHBondContact NE2-OE1 3.49Å; Q104-E108 WeakPolarHBondContact O-CB 3.41Å; Q104-E108 WeakPolarHBondContact O-CG 3.34Å; Q104-E108 PolarHBondContact O-N 3.42Å; E108-R110 VanDerWaalsContact C-N 3.26Å; E108-R110 PolarHBondContact O-N 3.49Å
109	R	72.4	Confident	67	Low	215 Å²	215	88.6 Å²	88.6	81%	0.811	45%	0.451	S	S	*	.	H	α-helix	trans	-72.1	-14.4	-178.6	-71.7	-177.4	168.4	-161.8	-1.5	114.6	S105	S105-R109 WeakPolarHBondContact O-CB 3.37Å; S105-R109 VanDerWaalsContact O-CG 3.31Å; S105-R109 WeakPolarHBondContact O-CG 3.47Å; S105-R109 PolarHBondContact O-N 3.18Å
110	R	70.8	Confident	68.7	Low	188 Å²	188	84.9 Å²	84.9	71%	0.709	43%	0.431	S	S	*	.	H	α-helix	trans	-124.7	5.6	-177.8	-65.9	-169.4	172.1	-174.3	-0.2	114.4	L106 A107 E108 L112	L106-R110 PolarHBondContact O-N 3.31Å; A107-R110 PolarHBondContact O-N 3.39Å; E108-R110 VanDerWaalsContact C-N 3.26Å; E108-R110 PolarHBondContact O-N 3.49Å; R110-L112 HydrophobicContact CB-CD1 3.9Å; R110-L112 HydrophobicContact CB-CG 3.87Å; R110-L112 PolarHBondContact O-N 3.03Å
111	N	70.3	Confident	70	Confident	157 Å²	157	81.9 Å²	81.9	84%	0.84	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	44	-174	-71.4	-27.9	0	0	0	112.7	A107	A107-N111 WeakPolarHBondContact O-CA 3.45Å; A107-N111 PolarHBondContact O-N 3.35Å
112	L	71.9	Confident	70.7	Confident	54 Å²	54	80.8 Å²	80.8	28%	0.283	41%	0.411	S	S	.	.			trans	-95.4	150.5	174.6	-60.2	172.4	0	0	0	109.5	A107 R110 Q116 I120	A107-L112 PolarHBondContact O-N 3.35Å; A107-L112 VanDerWaalsContact O-N 3.09Å; R110-L112 HydrophobicContact CB-CD1 3.9Å; R110-L112 HydrophobicContact CB-CG 3.87Å; R110-L112 PolarHBondContact O-N 3.03Å; L112-Q116 HydrophobicContact CB-CB 4.42Å; L112-I120 HydrophobicContact CD1-CD1 3.83Å
113	S	78.4	Confident	70.4	Confident	54 Å²	54	83 Å²	83	38%	0.378	42%	0.416	S	S	.	.			trans	-67.2	154.2	171	75.6	0	0	0	0	110.4	D115 Q116 A117	S113-D115 VanDerWaalsContact C-N 3.28Å; S113-D115 PolarHBondContact O-N 3.48Å; S113-Q116 WeakPolarHBondContact O-CB 3.19Å; S113-Q116 PolarHBondContact O-N 3.42Å; S113-Q116 VanDerWaalsContact OG-CG 3.27Å; S113-Q116 WeakPolarHBondContact OG-CG 3.4Å; S113-Q116 PolarHBondContact OG-N 3.44Å; S113-Q116 PolarHBondContact OG-OE1 3.3Å; S113-A117 PolarHBondContact O-N 3.27Å
114	F	70.4	Confident	70.6	Confident	107 Å²	107	84.6 Å²	84.6	47%	0.469	43%	0.426	S	S	.	.	H	α-helix	trans	-59.2	-41.9	-177.2	-157.4	-103.6	0	0	0	111.5	V103 Q104 A107 Q116 A117 I118	V103-F114 HydrophobicContact CB-CE2 4.42Å; V103-F114 HydrophobicContact CB-CZ 4.3Å; V103-F114 HydrophobicContact CG1-CD1 4.23Å; V103-F114 HydrophobicContact CG1-CD2 3.98Å; V103-F114 HydrophobicContact CG1-CE1 3.94Å; V103-F114 HydrophobicContact CG1-CE2 3.68Å; V103-F114 HydrophobicContact CG1-CG 4.26Å; V103-F114 HydrophobicContact CG1-CZ 3.65Å; Q104-F114 HydrophobicContact CB-CE2 3.96Å; Q104-F114 HydrophobicContact CG-CE2 4.39Å; A107-F114 HydrophobicContact CB-CD2 4.41Å; F114-Q116 VanDerWaalsContact C-N 3.31Å; F114-Q116 PolarHBondContact O-N 3.29Å; F114-A117 WeakPolarHBondContact O-CB 3.48Å; F114-A117 PolarHBondContact O-N 2.75Å; F114-A117 VanDerWaalsContact O-N 3.12Å; F114-I118 HydrophobicContact CD1-CD1 3.69Å; F114-I118 HydrophobicContact CD1-CG1 4.2Å; F114-I118 HydrophobicContact CE1-CD1 3.82Å; F114-I118 HydrophobicContact CE1-CG1 4.27Å; F114-I118 WeakPolarHBondContact O-CG1 3.44Å; F114-I118 PolarHBondContact O-N 3.17Å
115	D	70.4	Confident	70.1	Confident	123 Å²	123	84.8 Å²	84.8	66%	0.658	43%	0.427	S	S	*	.	H	α-helix	trans	-62.5	-35.1	175.7	-46.4	-50.7	0	0	0	112.8	S113 A119	S113-D115 VanDerWaalsContact C-N 3.28Å; S113-D115 PolarHBondContact O-N 3.48Å; D115-A119 VanDerWaalsContact O-CB 3.28Å; D115-A119 WeakPolarHBondContact O-CB 2.96Å; D115-A119 PolarHBondContact O-N 2.87Å
116	Q	70.6	Confident	69.1	Low	105 Å²	105	90 Å²	90	49%	0.491	45%	0.452	S	S	.	.	H	α-helix	trans	-69.7	-38.6	174	-74	171.7	-19.5	0	0	111.5	L112 S113 F114 A119 I120	L112-Q116 HydrophobicContact CB-CB 4.42Å; S113-Q116 WeakPolarHBondContact O-CB 3.19Å; S113-Q116 PolarHBondContact O-N 3.42Å; S113-Q116 VanDerWaalsContact OG-CG 3.27Å; S113-Q116 WeakPolarHBondContact OG-CG 3.4Å; S113-Q116 PolarHBondContact OG-N 3.44Å; S113-Q116 PolarHBondContact OG-OE1 3.3Å; F114-Q116 VanDerWaalsContact C-N 3.31Å; F114-Q116 PolarHBondContact O-N 3.29Å; Q116-A119 PolarHBondContact O-N 3.22Å; Q116-I120 WeakPolarHBondContact O-CB 3.1Å; Q116-I120 WeakPolarHBondContact O-CD1 3.39Å; Q116-I120 WeakPolarHBondContact O-CG1 3.49Å; Q116-I120 PolarHBondContact O-N 3.45Å
117	A	78.4	Confident	68	Low	0 Å²	0	92 Å²	92	0%	0	47%	0.472	C	S	.	.	H	α-helix	trans	-65.5	-42.9	174.3	0	0	0	0	0	111.7	V103 L106 A107 S113 F114 I120 E121	V103-A117 HydrophobicContact CG1-CB 3.75Å; V103-A117 WeakPolarHBondContact O-CB 3.42Å; L106-A117 HydrophobicContact CB-CB 4.38Å; L106-A117 HydrophobicContact CD2-CB 4.44Å; A107-A117 HydrophobicContact CB-CB 3.87Å; S113-A117 PolarHBondContact O-N 3.27Å; F114-A117 WeakPolarHBondContact O-CB 3.48Å; F114-A117 PolarHBondContact O-N 2.75Å; F114-A117 VanDerWaalsContact O-N 3.12Å; A117-I120 PolarHBondContact O-N 3.03Å; A117-E121 WeakPolarHBondContact O-CB 3.28Å; A117-E121 PolarHBondContact O-N 3.17Å
118	I	73.2	Confident	66.6	Low	77 Å²	77	96.7 Å²	96.7	40%	0.395	50%	0.5	S	S	.	.	H	α-helix	trans	-59.4	-49.2	172.5	-65.3	171.4	0	0	0	110.4	V103 F114 I120 E121 A122	V103-I118 HydrophobicContact CG1-CG1 3.56Å; V103-I118 HydrophobicContact CG2-CG1 4.18Å; F114-I118 HydrophobicContact CD1-CD1 3.69Å; F114-I118 HydrophobicContact CD1-CG1 4.2Å; F114-I118 HydrophobicContact CE1-CD1 3.82Å; F114-I118 HydrophobicContact CE1-CG1 4.27Å; F114-I118 WeakPolarHBondContact O-CG1 3.44Å; F114-I118 PolarHBondContact O-N 3.17Å; I118-I120 VanDerWaalsContact C-N 3.32Å; I118-I120 PolarHBondContact O-N 3.28Å; I118-E121 PolarHBondContact O-N 3.39Å; I118-A122 WeakPolarHBondContact O-CB 3.42Å; I118-A122 PolarHBondContact O-N 3.2Å
119	A	70.1	Confident	65.2	Low	49 Å²	49	97.6 Å²	97.6	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-39.5	-179.4	0	0	0	0	0	112.2	D115 Q116 L123	D115-A119 VanDerWaalsContact O-CB 3.28Å; D115-A119 WeakPolarHBondContact O-CB 2.96Å; D115-A119 PolarHBondContact O-N 2.87Å; Q116-A119 PolarHBondContact O-N 3.22Å; A119-L123 VanDerWaalsContact O-CB 3.3Å; A119-L123 WeakPolarHBondContact O-CB 3.26Å; A119-L123 WeakPolarHBondContact O-CD1 3.5Å; A119-L123 WeakPolarHBondContact O-CG 3.49Å; A119-L123 PolarHBondContact O-N 3.46Å
120	I	72.8	Confident	63.5	Low	72 Å²	72	93 Å²	93	37%	0.369	51%	0.505	S	S	.	.	H	α-helix	trans	-66.8	-44.2	174.8	-71.6	163.4	0	0	0	110.9	L106 L112 Q116 A117 I118 L123 T124	L106-I120 HydrophobicContact CD2-CB 4.35Å; L106-I120 HydrophobicContact CD2-CG2 3.88Å; L112-I120 HydrophobicContact CD1-CD1 3.83Å; Q116-I120 WeakPolarHBondContact O-CB 3.1Å; Q116-I120 WeakPolarHBondContact O-CD1 3.39Å; Q116-I120 WeakPolarHBondContact O-CG1 3.49Å; Q116-I120 PolarHBondContact O-N 3.45Å; A117-I120 PolarHBondContact O-N 3.03Å; I118-I120 VanDerWaalsContact C-N 3.32Å; I118-I120 PolarHBondContact O-N 3.28Å; I120-L123 PolarHBondContact O-N 3.47Å; I120-T124 VanDerWaalsContact O-CB 3.31Å; I120-T124 WeakPolarHBondContact O-CB 3.45Å; I120-T124 PolarHBondContact O-N 3.25Å; I120-T124 PolarHBondContact O-OG1 3.4Å
121	E	74.1	Confident	61.6	Low	37 Å²	37	93.1 Å²	93.1	17%	0.173	51%	0.514	C	S	.	.	H	α-helix	trans	-66.2	-43.7	180	-161.3	173.6	137.6	0	0	111.3	V103 A117 I118 T124 Q125	V103-E121 WeakPolarHBondContact CA-OE2 3.45Å; V103-E121 HydrophobicContact CG2-CB 4.45Å; V103-E121 WeakPolarHBondContact CG2-OE2 3.44Å; V103-E121 PolarHBondContact N-OE2 2.83Å; A117-E121 WeakPolarHBondContact O-CB 3.28Å; A117-E121 PolarHBondContact O-N 3.17Å; I118-E121 PolarHBondContact O-N 3.39Å; E121-T124 PolarHBondContact O-N 3.25Å; E121-T124 VanDerWaalsContact O-N 3.14Å; E121-Q125 WeakPolarHBondContact O-CG 3.48Å; E121-Q125 PolarHBondContact O-N 3.41Å
122	A	65.7	Low	59.8	Low	45 Å²	45	91 Å²	91	37%	0.372	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-45.9	174.5	0	0	0	0	0	112.6	I118 T124 Q125 L126	I118-A122 WeakPolarHBondContact O-CB 3.42Å; I118-A122 PolarHBondContact O-N 3.2Å; A122-T124 VanDerWaalsContact C-N 3.27Å; A122-T124 PolarHBondContact O-N 3.27Å; A122-Q125 PolarHBondContact O-N 3.18Å; A122-L126 VanDerWaalsContact O-CG 3.31Å; A122-L126 WeakPolarHBondContact O-CG 3.41Å; A122-L126 PolarHBondContact O-N 3.26Å
123	L	62.1	Low	57.9	Low	120 Å²	120	94.5 Å²	94.5	63%	0.628	54%	0.537	S	S	*	.	H	α-helix	trans	-66.3	-29	175	-72.4	170.2	0	0	0	112.7	A119 I120 A127	A119-L123 VanDerWaalsContact O-CB 3.3Å; A119-L123 WeakPolarHBondContact O-CB 3.26Å; A119-L123 WeakPolarHBondContact O-CD1 3.5Å; A119-L123 WeakPolarHBondContact O-CG 3.49Å; A119-L123 PolarHBondContact O-N 3.46Å; I120-L123 PolarHBondContact O-N 3.47Å; L123-A127 PolarHBondContact O-N 2.91Å
124	T	67.8	Low	55.6	Low	61 Å²	61	97.9 Å²	97.9	37%	0.374	56%	0.561	S	S	.	*	H	α-helix	trans	-73.8	-40.8	175.8	-56	0	0	0	0	111	I120 E121 A122 L126 A127	I120-T124 VanDerWaalsContact O-CB 3.31Å; I120-T124 WeakPolarHBondContact O-CB 3.45Å; I120-T124 PolarHBondContact O-N 3.25Å; I120-T124 PolarHBondContact O-OG1 3.4Å; E121-T124 PolarHBondContact O-N 3.25Å; E121-T124 VanDerWaalsContact O-N 3.14Å; A122-T124 VanDerWaalsContact C-N 3.27Å; A122-T124 PolarHBondContact O-N 3.27Å; T124-L126 VanDerWaalsContact C-N 3.35Å; T124-A127 PolarHBondContact O-N 3.41Å; T124-A127 VanDerWaalsContact O-N 3.16Å
125	Q	56.2	Low	53.5	Low	115 Å²	115	96.2 Å²	96.2	54%	0.537	57%	0.574	S	S	.	*	H	α-helix	trans	-63.2	-40.6	173.5	-69.2	178.3	23.2	0	0	111.5	E121 A122 A127 V128	E121-Q125 WeakPolarHBondContact O-CG 3.48Å; E121-Q125 PolarHBondContact O-N 3.41Å; A122-Q125 PolarHBondContact O-N 3.18Å; Q125-A127 PolarHBondContact O-N 2.87Å; Q125-V128 PolarHBondContact O-N 3.4Å
126	L	50.3	Low	51.9	Low	146 Å²	146	96 Å²	96	76%	0.764	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-11.9	174.5	-70.5	169.7	0	0	0	114.4	A122 T124	A122-L126 VanDerWaalsContact O-CG 3.31Å; A122-L126 WeakPolarHBondContact O-CG 3.41Å; A122-L126 PolarHBondContact O-N 3.26Å; T124-L126 VanDerWaalsContact C-N 3.35Å
127	A	41.7	Very low	49.8	Very low	73 Å²	73	98 Å²	98	60%	0.603	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-4.2	178.4	0	0	0	0	0	114	L123 T124 Q125 I129	L123-A127 PolarHBondContact O-N 2.91Å; T124-A127 PolarHBondContact O-N 3.41Å; T124-A127 VanDerWaalsContact O-N 3.16Å; Q125-A127 PolarHBondContact O-N 2.87Å; A127-I129 PolarHBondContact O-N 3.45Å
128	V	42.6	Very low	47.3	Very low	108 Å²	108	107.6 Å²	107.6	66%	0.655	63%	0.633	S	S	*	*			trans	-86.3	91.7	-179.1	-174.9	0	0	0	0	110.5	Q125 P130	Q125-V128 PolarHBondContact O-N 3.4Å; V128-P130 WeakPolarHBondContact O-CD 3.3Å
129	I	39.3	Very low	45.3	Very low	144 Å²	144	108.2 Å²	108.2	74%	0.738	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-77.1	124	171.8	-57	175.6	0	0	0	109.3	A127 Q131	A127-I129 PolarHBondContact O-N 3.45Å; I129-Q131 PolarHBondContact O-N 3.01Å
130	P	37.1	Very low	43.2	Very low	119 Å²	119	115 Å²	115	77%	0.773	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-67	129.1	173.1	-18	31.7	0	0	0	111.3	V128	V128-P130 WeakPolarHBondContact O-CD 3.3Å
131	Q	30.9	Very low	41	Very low	190 Å²	190	115.5 Å²	115.5	89%	0.888	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-96.1	118.2	166.2	-66.9	-168.6	15.1	0	0	109.9	I129	I129-Q131 PolarHBondContact O-N 3.01Å
132	S	31.5	Very low	38.7	Very low	113 Å²	113	121.7 Å²	121.7	79%	0.79	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-81	135.7	163.2	52.2	0	0	0	0	109.9
133	P	32.9	Very low	36.7	Very low	127 Å²	127	122.7 Å²	122.7	83%	0.825	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-75.8	155.1	-168.9	31	-36.8	0	0	0	113.8
134	S	28.6	Very low	34.9	Very low	125 Å²	125	126.4 Å²	126.4	87%	0.874	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-85.8	137.1	174	50.7	0	0	0	0	112.7
135	G	27.3	Very low	33.1	Very low	71 Å²	71	132 Å²	132	73%	0.732	77%	0.768	S	S	*	*			trans	-121.5	141.7	165.6	0	0	0	0	0	110
136	P	36.7	Very low	32.4	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	78%	0.779	S	S	*	*			trans	-107.7	176.6	-169.8	37.6	-30	0	0	0	114.6
137	I	25.7	Very low	31.3	Very low	145 Å²	145	132.2 Å²	132.2	74%	0.744	78%	0.779	S	S	*	*			trans	126.2	115.2	146.7	-67.9	159.6	0	0	0	116.8
138	K	26.2	Very low	30.7	Very low	202 Å²	202	134.4 Å²	134.4	88%	0.878	79%	0.79	S	S	*	*			trans	68.8	165.1	151.8	-75.7	172.8	-176.7	-173.9	0	121.5
139	A	32.6	Very low	29.8	Very low	90 Å²	90	134.3 Å²	134.3	74%	0.744	79%	0.794	S	S	*	*			trans	-137.7	146.5	176.8	0	0	0	0	0	109.5
140	E	25	Very low	29.1	Very low	191 Å²	191	132.2 Å²	132.2	89%	0.893	79%	0.792	S	S	*	*			trans	-178.6	165.9	171.2	-102.9	155.3	-147.7	0	0	104.1
141	S	26	Very low	28.9	Very low	84 Å²	84	131.7 Å²	131.7	59%	0.587	79%	0.791	S	S	*	*			cis	161.4	125	-17.8	174.1	0	0	0	0	104.9
142	N	26	Very low	29.3	Very low	166 Å²	166	128.3 Å²	128.3	89%	0.888	79%	0.786	S	S	*	*			trans	63.4	162.5	169.4	-55.4	-26.6	0	0	0	119.4
143	G	24.4	Very low	29	Very low	67 Å²	67	125.6 Å²	125.6	69%	0.691	78%	0.775	S	S	*	*			trans	134.2	74.4	145.6	0	0	0	0	0	120.6
144	E	24.6	Very low	28.8	Very low	198 Å²	198	127.9 Å²	127.9	93%	0.925	77%	0.773	S	S	*	*			trans	58.7	152.1	132.5	-58.5	-175.9	149	0	0	124.3
145	H	29.9	Very low	28.8	Very low	179 Å²	179	129.8 Å²	129.8	83%	0.829	77%	0.767	S	S	*	*			trans	-106.8	146.5	172.3	-90.9	-74.8	0	0	0	111.9
146	P	40.4	Very low	28.8	Very low	118 Å²	118	132.4 Å²	132.4	77%	0.766	77%	0.769	S	S	*	*			trans	-128.9	-177.1	143.3	38.1	-26.9	0	0	0	112.7
147	I	27.8	Very low	28.4	Very low	146 Å²	146	133.6 Å²	133.6	75%	0.749	77%	0.769	S	S	*	*				-155.3	144.7	-92.8	-105.5	167.5	0	0	0	111
148	S	28.5	Very low	29.5	Very low	120 Å²	120	132.3 Å²	132.3	84%	0.839	77%	0.77	S	S	*	*			trans	65	152.2	176.1	-64.6	0	0	0	0	115.7
149	S	24.4	Very low	29.6	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	76%	0.76	S	S	*	*			cis	-149.4	-176.2	6.5	83.5	0	0	0	0	108.7
150	S	25.3	Very low	29.4	Very low	100 Å²	100	129.9 Å²	129.9	70%	0.699	76%	0.76	S	S	*	*			cis	-164.6	-177.2	-4.6	35.4	0	0	0	0	108.4
151	S	32	Very low	29.6	Very low	107 Å²	107	128.3 Å²	128.3	75%	0.748	75%	0.753	S	S	*	*			trans	-155.2	160.9	167	-57.7	0	0	0	0	110.9
152	P	38.6	Very low	29.7	Very low	120 Å²	120	128.3 Å²	128.3	78%	0.779	76%	0.758	S	S	*	*				-139	156.7	124.6	38.2	-26.8	0	0	0	112.5
153	G	27	Very low	29.8	Very low	55 Å²	55	125.2 Å²	125.2	57%	0.567	76%	0.756	S	S	*	*			cis	99.4	135.7	6.6	0	0	0	0	0	112.5
154	F	28.6	Very low	30.1	Very low	176 Å²	176	132 Å²	132	77%	0.772	77%	0.766	S	S	*	*			cis	-142.1	-163.8	-4.2	-61.1	-78	0	0	0	107
155	H	28.8	Very low	30.1	Very low	165 Å²	165	134.2 Å²	134.2	76%	0.764	77%	0.766	S	S	*	*			cis	-144.9	-161.9	24	-81.8	-70.3	0	0	0	107.8
156	T	26.5	Very low	30	Very low	125 Å²	125	130.3 Å²	130.3	77%	0.767	77%	0.765	S	S	*	*			cis	-139	-154.3	18.9	63.2	0	0	0	0	112
157	N	27.6	Very low	29.5	Very low	146 Å²	146	130 Å²	130	78%	0.781	77%	0.765	S	S	*	*			trans	-156.4	174	-167.4	-78.9	-49.2	0	0	0	111
158	P	50	Low	29.5	Very low	118 Å²	118	128 Å²	128	77%	0.766	77%	0.771	S	S	*	*			cis	-106.1	-149.9	-4.6	33.8	-15.9	0	0	0	110.4
159	A	27.1	Very low	29.5	Very low	81 Å²	81	130.3 Å²	130.3	67%	0.669	77%	0.772	S	S	*	*			cis	-165.7	-173.9	7.1	0	0	0	0	0	107.8
160	Q	29.9	Very low	29.5	Very low	159 Å²	159	132.8 Å²	132.8	74%	0.743	77%	0.771	S	S	*	*			cis	-174.9	153.5	-38.2	-105.6	-157.3	92.8	0	0	106.1
161	Q	28.9	Very low	29.5	Very low	159 Å²	159	139 Å²	139	74%	0.743	78%	0.781	S	S	*	*			cis	-159.2	173.7	-7.8	-150.7	-150.8	99.7	0	0	109.6
162	A	27.8	Very low	29.3	Very low	84 Å²	84	140.6 Å²	140.6	69%	0.694	78%	0.781	S	S	*	*			trans	69.7	150.5	159.1	0	0	0	0	0	121.5
163	A	28	Very low	28.8	Very low	101 Å²	101	144.7 Å²	144.7	84%	0.835	79%	0.787	S	S	*	*			trans	74.4	83.8	157.8	0	0	0	0	0	121.8
164	K	30	Very low	28.8	Very low	208 Å²	208	148.2 Å²	148.2	90%	0.904	80%	0.797	S	S	*	*			trans	0.5	117.7	142.5	-58.2	172.6	-178.8	175.4	0	118.6
165	R	25.6	Very low	28.6	Very low	245 Å²	245	145 Å²	145	93%	0.925	80%	0.796	S	S	*	*				-176.5	151.3	111.1	-104.3	175.5	176.7	170.4	-0.1	111.8
166	A	28.4	Very low	28.4	Very low	98 Å²	98	143.9 Å²	143.9	81%	0.81	80%	0.801	S	S	*	*			trans	-77.7	147.1	168.6	0	0	0	0	0	110.6
167	S	29.1	Very low	28.5	Very low	111 Å²	111	145.3 Å²	145.3	78%	0.776	80%	0.802	S	S	*	*			trans	-153.9	134.6	169.7	-72.1	0	0	0	0	109.2
168	A	28.5	Very low	28.5	Very low	104 Å²	104	143.5 Å²	143.5	86%	0.86	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-73	135.4	176	0	0	0	0	0	109.8
169	I	28.1	Very low	27.2	Very low	169 Å²	169	143.2 Å²	143.2	87%	0.867	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-85	128.1	176.3	-66.2	-178.2	0	0	0	110
170	H	24.7	Very low	27.6	Very low	157 Å²	157	145.2 Å²	145.2	73%	0.727	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.3	137.9	-174.7	-140.2	-102.2	0	0	0	111	N172	H170-N172 PolarHBondContact O-N 3.12Å
171	Y	25.4	Very low	27.7	Very low	230 Å²	230	144.7 Å²	144.7	90%	0.902	81%	0.809	S	S	*	*			trans	-74.3	112.1	161.2	-90.1	-83.4	0	0	0	109	K173	Y171-K173 PolarHBondContact O-N 2.9Å
172	N	26.9	Very low	27.9	Very low	142 Å²	142	145.5 Å²	145.5	76%	0.759	81%	0.813	S	S	*	*			trans	-81.1	104.2	176.9	-89.8	-19.8	0	0	0	111.2	H170 V174	H170-N172 PolarHBondContact O-N 3.12Å; N172-V174 PolarHBondContact O-N 3.24Å
173	K	27.5	Very low	27.9	Very low	206 Å²	206	150.6 Å²	150.6	90%	0.896	82%	0.822	S	S	*	*			trans	-87	92	172.4	-170.1	173.4	-175	174	0	109.6	Y171	Y171-K173 PolarHBondContact O-N 2.9Å
174	V	27	Very low	27.9	Very low	128 Å²	128	152.1 Å²	152.1	78%	0.776	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-75.5	130.6	179.7	-179.4	0	0	0	0	110.7	N172	N172-V174 PolarHBondContact O-N 3.24Å
175	S	24.1	Very low	27.9	Very low	109 Å²	109	147.7 Å²	147.7	76%	0.762	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-77.8	137.4	178.7	-55.7	0	0	0	0	112.1
176	V	26.2	Very low	28	Very low	141 Å²	141	142.5 Å²	142.5	86%	0.855	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-101	139.4	161.5	178.5	0	0	0	0	108.5
177	I	27.5	Very low	28	Very low	155 Å²	155	145.6 Å²	145.6	80%	0.795	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-90.6	128.2	-173.2	-60.1	169.3	0	0	0	110.1
178	S	27.5	Very low	27.8	Very low	108 Å²	108	150.9 Å²	150.9	76%	0.755	82%	0.816	S	S	*	*			trans	-144.4	107.7	164.1	60.9	0	0	0	0	109.9
179	S	24.2	Very low	27.9	Very low	112 Å²	112	151.7 Å²	151.7	78%	0.783	81%	0.813	S	S	*	*			trans	-71.6	132.8	-179.5	-60.6	0	0	0	0	111.5
180	P	33.9	Very low	28.2	Very low	124 Å²	124	149.7 Å²	149.7	81%	0.805	81%	0.811	S	S	*	*			trans	-84.1	134.2	177.8	32.6	-33	0	0	0	111.6
181	L	32.8	Very low	28.3	Very low	147 Å²	147	149.3 Å²	149.3	77%	0.77	82%	0.819	S	S	*	*			trans	-137.9	147.9	166.7	-143.2	71.1	0	0	0	110.8
182	H	32.3	Very low	28.5	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.815	81%	0.813	S	S	*	*			trans	75.2	152.9	-177.7	-54.2	-68.4	0	0	0	117.4
183	Q	29.4	Very low	28.5	Very low	191 Å²	191	147.4 Å²	147.4	89%	0.893	82%	0.819	S	S	*	*			trans	-117.2	149.6	-154.1	-66.5	171.5	-63.1	0	0	112.8
184	T	26.7	Very low	28.4	Very low	133 Å²	133	146.4 Å²	146.4	82%	0.816	82%	0.818	S	S	*	*			trans	-66.1	146.1	165.2	52.1	0	0	0	0	111.3
185	S	29.5	Very low	28.3	Very low	116 Å²	116	143.3 Å²	143.3	81%	0.811	81%	0.812	S	S	*	*			trans	-134.4	115	168	-79	0	0	0	0	110.5
186	V	28.2	Very low	28.4	Very low	136 Å²	136	145.7 Å²	145.7	82%	0.824	82%	0.816	S	S	*	*			trans	-101.2	127	177.6	176.7	0	0	0	0	108.7
187	I	27.9	Very low	28.3	Very low	162 Å²	162	145 Å²	145	83%	0.831	81%	0.812	S	S	*	*			trans	-112	131.6	177.9	-61.4	-179.6	0	0	0	109.9
188	R	26.4	Very low	28.2	Very low	222 Å²	222	142.5 Å²	142.5	84%	0.838	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-97.3	150.6	173.7	-71.5	179	175.3	162.7	-1	110.7
189	P	30.9	Very low	27.9	Very low	121 Å²	121	142 Å²	142	79%	0.786	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-77.4	145.1	-179.4	31.5	-35.6	0	0	0	112.9
190	P	33.4	Very low	27.8	Very low	127 Å²	127	141.1 Å²	141.1	83%	0.825	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-87.6	156.9	171.6	34.8	-33.9	0	0	0	112.9
191	V	27.4	Very low	27.4	Very low	149 Å²	149	138.5 Å²	138.5	90%	0.903	76%	0.762	S	S	*	*			trans	-108.4	144.1	175.8	175.1	0	0	0	0	110.1
192	A	29.6	Very low	26.9	Very low	93 Å²	93	141.2 Å²	141.2	77%	0.769	76%	0.762	S	S	*	*			trans	-77.5	158.4	-167.9	0	0	0	0	0	116.1
193	R	27.3	Very low	26.5	Very low	239 Å²	239	142.8 Å²	142.8	90%	0.902	76%	0.761	S	S	*	*			trans	-151.6	161.5	154.1	-111	175.9	-171.1	-158.5	0.7	112.7
194	Q	25.2	Very low	26.2	Very low	186 Å²	186	141.1 Å²	141.1	87%	0.869	76%	0.757	S	S	*	*			trans	-66.7	163.3	-172	-58.9	124.8	-29.3	0	0	113.5
195	G	25.2	Very low	26	Very low	62 Å²	62	139.8 Å²	139.8	64%	0.639	75%	0.753	S	S	*	*			cis	169.6	-164.4	0.8	0	0	0	0	0	112.6
196	N	25.6	Very low	25.7	Very low	160 Å²	160	138.6 Å²	138.6	86%	0.856	75%	0.745	S	S	*	*			trans	80.8	138.8	-179.2	-50.3	-20.7	0	0	0	115.7
197	V	23.5	Very low	25.5	Very low	127 Å²	127	139 Å²	139	77%	0.77	74%	0.742	S	S	*	*			cis	84.3	121.5	17.3	-177	0	0	0	0	113.1
198	I	24.8	Very low	25.4	Very low	101 Å²	101	137.7 Å²	137.7	52%	0.518	74%	0.742	S	S	.	*			cis	-162.4	161.9	-1.2	-118.9	174.3	0	0	0	109.9	C956	I198-C956 HydrophobicContact CD1-CB 3.4Å; I198-C956 VanDerWaalsContact CD1-CB 3.4Å; I198-C956 HydrophobicContact CG1-CB 3.67Å
199	Q	22.3	Very low	25.4	Very low	98 Å²	98	136.2 Å²	136.2	46%	0.458	74%	0.742	S	S	.	*			trans	69.1	162	162.8	-92.2	164.4	-130.5	0	0	119	S957 S958	Q199-S957 VanDerWaalsContact CG-C 3.45Å; Q199-S957 WeakPolarHBondContact CG-O 3.08Å; Q199-S958 VanDerWaalsContact CD-OG 3.29Å; Q199-S958 PolarHBondContact OE1-OG 2.81Å
200	C	22.1	Very low	25.5	Very low	94 Å²	94	135.9 Å²	135.9	64%	0.635	74%	0.74	S	S	*	*			cis	-148.4	-172	25.9	-142.1	0	0	0	0	115.1	S958 P959	C200-S958 PolarHBondContact SG-O 3.38Å; C200-P959 VanDerWaalsContact SG-CD 3.57Å
201	S	24.2	Very low	25	Very low	68 Å²	68	134.6 Å²	134.6	48%	0.476	73%	0.734	S	S	.	*			trans	-143.8	157.8	-179.7	72.5	0	0	0	0	114.1	S958	S201-S958 PolarHBondContact OG-O 2.88Å
202	R	24	Very low	24.9	Very low	204 Å²	204	133.9 Å²	133.9	77%	0.77	73%	0.73	S	S	*	*			trans	69.5	155.4	174.2	-70.1	-178.7	170.2	-172.3	-3.3	117.1
203	R	22.7	Very low	24.5	Very low	210 Å²	210	138.1 Å²	138.1	79%	0.792	73%	0.733	S	S	*	*			cis	-174.6	169.2	-20.3	-174.6	178.8	-159	-120.1	6.6	109.5
204	L	23.3	Very low	24.3	Very low	155 Å²	155	135.2 Å²	135.2	81%	0.812	73%	0.73	S	S	*	*			trans	75.2	156.8	177.5	-62	99.1	0	0	0	114.4
205	S	23	Very low	24.5	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	73%	0.732	S	S	*	*			cis	-110.3	154.7	1.4	32.1	0	0	0	0	111.6
206	S	22.8	Very low	24.8	Very low	91 Å²	91	138.1 Å²	138.1	64%	0.636	74%	0.74	S	S	*	*			cis	89.4	142.1	49.1	90.5	0	0	0	0	115.3
207	D	24.8	Very low	24.8	Very low	145 Å²	145	135 Å²	135	78%	0.775	73%	0.73	S	S	*	*			trans	72.4	140.5	173	-44.7	-61.2	0	0	0	116.1
208	T	24.5	Very low	24.8	Very low	135 Å²	135	135.7 Å²	135.7	83%	0.828	73%	0.73	S	S	*	*			cis	-134.8	155.4	13	-56.4	0	0	0	0	112.4
209	K	27.4	Very low	24.8	Very low	190 Å²	190	136 Å²	136	83%	0.826	74%	0.74	S	S	*	*			trans	-149.1	-174.5	176.5	-122.3	-167	178.9	-168	0	109
210	P	33.6	Very low	24.9	Very low	115 Å²	115	141.6 Å²	141.6	75%	0.747	76%	0.757	S	S	*	*			cis	-96	-140.8	15.4	27.8	-7.9	0	0	0	110.9
211	S	22.3	Very low	25	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	76%	0.759	S	S	*	*			cis	-156.4	-175.9	7.3	44.8	0	0	0	0	108.5
212	V	24.2	Very low	25	Very low	135 Å²	135	143 Å²	143	82%	0.818	77%	0.773	S	S	*	*			cis	-138.1	-167.8	5.9	-140.2	0	0	0	0	110.1
213	E	21.8	Very low	25.1	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	76%	0.759	S	S	*	*			trans	-114.8	-177.2	172.2	-61.3	179	116.6	0	0	108.9
214	E	23.7	Very low	25.3	Very low	179 Å²	179	134.7 Å²	134.7	84%	0.836	76%	0.755	S	S	*	*			cis	-154.8	177.3	40.4	-65.4	-174.8	127	0	0	113.9
215	M	28.7	Very low	25.3	Very low	184 Å²	184	131 Å²	131	91%	0.906	74%	0.741	S	S	*	*			trans	-143.3	124.6	168.3	-96.5	-75.5	163.4	0	0	111.3
216	P	31.7	Very low	25.4	Very low	125 Å²	125	134.2 Å²	134.2	81%	0.812	75%	0.745	S	S	*	*			trans	-115.2	-172.4	167.3	36.7	-26	0	0	0	113.6
217	S	25.7	Very low	25.9	Very low	93 Å²	93	134.6 Å²	134.6	65%	0.65	75%	0.747	S	S	*	*			trans	-131.1	172.5	-154	66.2	0	0	0	0	115.7
218	N	23.8	Very low	26.3	Very low	143 Å²	143	132.6 Å²	132.6	77%	0.765	74%	0.743	S	S	*	*			trans	70.9	158.6	149.6	-71.5	-14.1	0	0	0	118.4
219	C	23.8	Very low	26.3	Very low	107 Å²	107	135.3 Å²	135.3	72%	0.723	74%	0.739	S	S	*	*			cis	-168.1	-178.9	-23	-113.1	0	0	0	0	111
220	R	23.8	Very low	26.3	Very low	216 Å²	216	131.6 Å²	131.6	82%	0.815	73%	0.732	S	S	*	*			trans	77	146.1	-177.5	-55.8	-174.8	175	-151.7	0.1	114.2
221	G	25.4	Very low	26	Very low	65 Å²	65	132 Å²	132	67%	0.67	73%	0.726	S	S	*	*			cis	117.8	143.5	2.6	0	0	0	0	0	112
222	T	24.7	Very low	26.2	Very low	126 Å²	126	133.9 Å²	133.9	77%	0.773	72%	0.724	S	S	*	*			cis	-166.9	-179.5	3.2	-3.5	0	0	0	0	110.6
223	N	24.5	Very low	26.3	Very low	89 Å²	89	131.8 Å²	131.8	48%	0.476	72%	0.715	S	S	.	*			trans	97.4	120.5	-179.7	-52.2	-42.5	0	0	0	112.7	H984	N223-H984 PolarHBondContact ND2-N 3.34Å
224	Q	27.6	Very low	26.7	Very low	151 Å²	151	128.6 Å²	128.6	71%	0.706	70%	0.701	S	S	*	*			cis	77.9	101.3	28.9	-60.5	-160	18.6	0	0	117.5
225	S	24.5	Very low	26.7	Very low	76 Å²	76	124.4 Å²	124.4	53%	0.531	69%	0.69	S	S	.	*			trans	-155	101	134.2	55.2	0	0	0	0	105.8
226	Q	25	Very low	26.6	Very low	173 Å²	173	120.4 Å²	120.4	81%	0.808	68%	0.68	S	S	*	*				57	131.7	85.3	-70.7	-164.4	-6.3	0	0	114.7
227	S	33.3	Very low	26.3	Very low	99 Å²	99	122.8 Å²	122.8	69%	0.692	67%	0.674	S	S	*	*			trans	-64.2	162.3	170.8	-169.3	0	0	0	0	111.1	Y229	S227-Y229 PolarHBondContact OG-N 3.48Å; S227-Y229 VanDerWaalsContact OG-N 3.13Å
228	P	32.6	Very low	26.3	Very low	104 Å²	104	125.3 Å²	125.3	68%	0.675	68%	0.676	S	S	*	*				-135	130.9	106.4	39.6	-30.3	0	0	0	111.5
229	Y	24.5	Very low	26.3	Very low	192 Å²	192	124.9 Å²	124.9	75%	0.753	67%	0.673	S	S	*	*				84.3	160.8	102.8	-74.4	-157.5	0	0	0	112.8	S227	S227-Y229 PolarHBondContact OG-N 3.48Å; S227-Y229 VanDerWaalsContact OG-N 3.13Å
230	V	27.1	Very low	26.4	Very low	111 Å²	111	124.1 Å²	124.1	67%	0.673	67%	0.669	S	S	*	*			cis	-141.1	137.2	4.7	102.6	0	0	0	0	105.2
231	I	26.4	Very low	26.6	Very low	123 Å²	123	119.1 Å²	119.1	63%	0.631	67%	0.667	S	S	*	*				60.5	141	73.9	-74.6	169.9	0	0	0	110.5
232	H	26.8	Very low	26.9	Very low	140 Å²	140	128 Å²	128	65%	0.648	68%	0.681	S	S	*	*			cis	-133.4	-139.3	-2.1	-148.4	169.6	0	0	0	107.5	Q234	H232-Q234 VanDerWaalsContact CE1-CG 3.49Å; H232-Q234 WeakPolarHBondContact CE1-CG 3.33Å; H232-Q234 PolarHBondContact CE1-NE2 3.13Å; H232-Q234 WeakPolarHBondContact NE2-CG 3.3Å
233	S	27.9	Very low	26.9	Very low	90 Å²	90	126 Å²	126	63%	0.629	68%	0.684	S	S	*	*			cis	-161.2	152.7	-12.9	141.8	0	0	0	0	106.6
234	Q	28.3	Very low	27.2	Very low	115 Å²	115	129.8 Å²	129.8	54%	0.537	70%	0.699	S	S	.	*			cis	-153.6	151.2	-19.3	-105.5	158	-53.8	0	0	105.4	H232	H232-Q234 VanDerWaalsContact CE1-CG 3.49Å; H232-Q234 WeakPolarHBondContact CE1-CG 3.33Å; H232-Q234 PolarHBondContact CE1-NE2 3.13Å; H232-Q234 WeakPolarHBondContact NE2-CG 3.3Å
235	C	24.9	Very low	27.3	Very low	91 Å²	91	129.6 Å²	129.6	62%	0.615	70%	0.698	S	S	*	*				59.7	136.1	71.3	-144.5	0	0	0	0	112.5
236	S	25.4	Very low	28	Very low	100 Å²	100	137 Å²	137	70%	0.699	71%	0.714	S	S	*	*				170.5	166.6	87.3	37.7	0	0	0	0	109.4
237	Y	27.2	Very low	28.5	Very low	174 Å²	174	137.7 Å²	137.7	68%	0.682	72%	0.723	S	S	*	*			cis	-166.3	175.3	-10.4	-104.9	-43.9	0	0	0	106.9
238	E	24.3	Very low	28.7	Very low	147 Å²	147	135.7 Å²	135.7	69%	0.687	72%	0.718	S	S	*	*			cis	-155.6	179.3	-4.3	-122.9	-40.3	173.8	0	0	108.2
239	D	24.6	Very low	28.8	Very low	134 Å²	134	138.5 Å²	138.5	72%	0.717	72%	0.722	S	S	*	*			trans	-122.7	-179	164.3	-153.4	31.2	0	0	0	109.7
240	S	26.6	Very low	29.4	Very low	90 Å²	90	135.3 Å²	135.3	63%	0.629	72%	0.718	S	S	*	*			cis	-161.5	145.4	9.9	-161.4	0	0	0	0	112.3
241	S	27.2	Very low	30	Very low	112 Å²	112	140.5 Å²	140.5	78%	0.783	73%	0.725	S	S	*	*			trans	-149.3	93.1	166.7	72.2	0	0	0	0	117.3
242	R	30.9	Very low	30.7	Very low	252 Å²	252	141.2 Å²	141.2	95%	0.951	73%	0.726	S	S	*	*			trans	28.7	131.4	131.3	-53.8	-179.5	-176	-161.8	-0	120.7
243	G	24.4	Very low	31.4	Very low	82 Å²	82	142.5 Å²	142.5	85%	0.845	73%	0.725	S	S	*	*			trans	-165.3	150.5	158.1	0	0	0	0	0	111.6
244	H	31.4	Very low	31.9	Very low	170 Å²	170	142.2 Å²	142.2	79%	0.787	72%	0.722	S	S	*	*			trans	-119	164.2	-175	-147.5	-119.7	0	0	0	112.4
245	E	29.9	Very low	32.8	Very low	146 Å²	146	140.8 Å²	140.8	68%	0.682	72%	0.721	S	S	*	*			trans	71.9	117.8	159.7	-94.4	149.6	-125.2	0	0	123.3
246	R	39.6	Very low	33.9	Very low	231 Å²	231	140.2 Å²	140.2	87%	0.872	71%	0.711	S	S	*	*			trans	43.3	86.8	131.3	-62.6	-178.3	177.8	-144	0.8	119.3
247	L	36	Very low	34.7	Very low	188 Å²	188	142.4 Å²	142.4	98%	0.984	71%	0.708	S	S	*	*			trans	-167.3	79.6	142.2	-109	158.1	0	0	0	111.1
248	G	36.3	Very low	35.4	Very low	58 Å²	58	140.9 Å²	140.9	60%	0.598	71%	0.709	S	S	*	*			trans	-122.7	-33.4	-168.8	0	0	0	0	0	118
249	E	35.2	Very low	36.6	Very low	163 Å²	163	142.7 Å²	142.7	76%	0.762	71%	0.709	S	S	*	*	H	α-helix	trans	-81.4	-22.1	-159.2	-66.5	-173	96.1	0	0	116.3
250	D	36.4	Very low	37.7	Very low	124 Å²	124	143.5 Å²	143.5	66%	0.663	70%	0.703	S	S	*	*	H	α-helix	trans	-84	-26.4	-177.5	-87.2	-39.6	0	0	0	114.3	R253 C254	D250-R253 PolarHBondContact O-N 3.3Å; D250-R253 IonicContact OD1-NE 3.83Å; D250-C254 PolarHBondContact O-N 3.04Å
251	R	40.6	Very low	38.9	Very low	220 Å²	220	143.4 Å²	143.4	83%	0.83	70%	0.695	S	S	*	*	H	α-helix	trans	-68.9	-38.9	-179.4	-163.4	172.5	-174.8	174.4	1.2	111.6	C254 V255	R251-C254 WeakPolarHBondContact O-CB 3.37Å; R251-C254 PolarHBondContact O-N 3.32Å; R251-V255 PolarHBondContact O-N 3.4Å
252	E	41.4	Very low	40.5	Very low	139 Å²	139	146.5 Å²	146.5	65%	0.65	69%	0.69	S	S	*	*	H	α-helix	trans	-72.7	-38.8	176.6	-170.3	165.3	-146.1	0	0	112	C254 V255 I256	E252-C254 VanDerWaalsContact C-N 3.25Å; E252-C254 PolarHBondContact O-N 3.02Å; E252-V255 PolarHBondContact O-N 3.44Å; E252-I256 HydrophobicContact CG-CD1 4.06Å; E252-I256 WeakPolarHBondContact O-CG1 3.46Å; E252-I256 PolarHBondContact O-N 3.45Å
253	R	40.2	Very low	41.9	Very low	167 Å²	167	139.1 Å²	139.1	63%	0.63	67%	0.669	S	S	*	*	H	α-helix	trans	-57	-38.2	172.5	-171.8	-178.8	-62.7	-98	-3.5	112.2	D250 K257	D250-R253 PolarHBondContact O-N 3.3Å; D250-R253 IonicContact OD1-NE 3.83Å; R253-K257 PolarHBondContact O-N 2.91Å
254	C	39.1	Very low	43.8	Very low	84 Å²	84	141.5 Å²	141.5	57%	0.568	66%	0.658	S	S	*	*	H	α-helix	trans	-64.4	-49.6	175.5	-168.1	0	0	0	0	112.1	D250 R251 E252 I256 K257 M258	D250-C254 PolarHBondContact O-N 3.04Å; R251-C254 WeakPolarHBondContact O-CB 3.37Å; R251-C254 PolarHBondContact O-N 3.32Å; E252-C254 VanDerWaalsContact C-N 3.25Å; E252-C254 PolarHBondContact O-N 3.02Å; C254-I256 VanDerWaalsContact C-N 3.35Å; C254-I256 PolarHBondContact O-N 3.39Å; C254-K257 PolarHBondContact O-N 3.22Å; C254-K257 VanDerWaalsContact O-N 3.13Å; C254-M258 PolarHBondContact O-N 3.29Å
255	V	47.2	Very low	45.3	Very low	85 Å²	85	139.8 Å²	139.8	52%	0.515	65%	0.651	S	S	.	*	H	α-helix	trans	-62.5	-39.3	-179.6	175.3	0	0	0	0	112.2	R251 E252 K257 M258 R259	R251-V255 PolarHBondContact O-N 3.4Å; E252-V255 PolarHBondContact O-N 3.44Å; V255-K257 VanDerWaalsContact C-N 3.32Å; V255-K257 PolarHBondContact O-N 3.44Å; V255-M258 PolarHBondContact O-N 3.17Å; V255-R259 PolarHBondContact O-N 3.07Å; V255-R259 VanDerWaalsContact O-N 3.08Å
256	I	48.4	Very low	47.3	Very low	79 Å²	79	138.4 Å²	138.4	41%	0.405	64%	0.644	S	S	.	*	H	α-helix	trans	-66	-35.4	176.4	-67.5	169.3	0	0	0	111.4	E252 C254 R260	E252-I256 HydrophobicContact CG-CD1 4.06Å; E252-I256 WeakPolarHBondContact O-CG1 3.46Å; E252-I256 PolarHBondContact O-N 3.45Å; C254-I256 VanDerWaalsContact C-N 3.35Å; C254-I256 PolarHBondContact O-N 3.39Å; I256-R260 PolarHBondContact O-N 2.86Å
257	K	41.3	Very low	49.1	Very low	145 Å²	145	131.2 Å²	131.2	63%	0.63	63%	0.626	S	S	*	*	H	α-helix	trans	-70.5	-41.7	175.2	-161.3	176.4	-176.5	-174.7	0	111.4	R253 C254 V255 R259 R260 N261	R253-K257 PolarHBondContact O-N 2.91Å; C254-K257 PolarHBondContact O-N 3.22Å; C254-K257 VanDerWaalsContact O-N 3.13Å; V255-K257 VanDerWaalsContact C-N 3.32Å; V255-K257 PolarHBondContact O-N 3.44Å; K257-R259 VanDerWaalsContact C-N 3.3Å; K257-R259 PolarHBondContact O-N 3.14Å; K257-R260 PolarHBondContact O-N 2.92Å; K257-N261 PolarHBondContact O-N 2.89Å; K257-N261 PolarHBondContact O-OD1 2.83Å
258	M	42.2	Very low	50.5	Low	142 Å²	142	125.1 Å²	125.1	70%	0.7	60%	0.602	S	S	*	*	H	α-helix	trans	-60.8	-36.8	176.7	-154.4	72.6	175.8	0	0	112.5	C254 V255 R262	C254-M258 PolarHBondContact O-N 3.29Å; V255-M258 PolarHBondContact O-N 3.17Å; M258-R262 PolarHBondContact O-N 3.47Å
259	R	49.7	Very low	52.4	Low	185 Å²	185	125.2 Å²	125.2	70%	0.698	60%	0.597	S	S	*	*	H	α-helix	trans	-66.9	-50.4	172.9	-78.7	-168.4	175.4	-171	0.2	112.8	V255 K257 N261 R262 D263	V255-R259 PolarHBondContact O-N 3.07Å; V255-R259 VanDerWaalsContact O-N 3.08Å; K257-R259 VanDerWaalsContact C-N 3.3Å; K257-R259 PolarHBondContact O-N 3.14Å; R259-N261 VanDerWaalsContact C-N 3.31Å; R259-N261 PolarHBondContact O-N 2.92Å; R259-R262 WeakPolarHBondContact O-CA 3.39Å; R259-R262 WeakPolarHBondContact O-CB 3.4Å; R259-R262 PolarHBondContact O-N 3.43Å; R259-D263 PolarHBondContact O-N 3.12Å
260	R	48.1	Very low	54.3	Low	151 Å²	151	122.8 Å²	122.8	57%	0.57	59%	0.586	S	S	*	*	H	α-helix	trans	-59	-41.2	-179.5	-76.1	-170.6	175.9	116.9	2.8	112.8	I256 K257 R262 D263 E264	I256-R260 PolarHBondContact O-N 2.86Å; K257-R260 PolarHBondContact O-N 2.92Å; R260-R262 PolarHBondContact O-N 3Å; R260-D263 PolarHBondContact O-N 3.36Å; R260-E264 WeakPolarHBondContact O-CB 3.22Å; R260-E264 WeakPolarHBondContact O-CG 3.33Å; R260-E264 PolarHBondContact O-N 3.39Å
261	N	51.3	Low	56	Low	89 Å²	89	121.9 Å²	121.9	48%	0.476	58%	0.581	S	S	.	*	H	α-helix	trans	-58.5	-38.7	174.9	-72.5	23	0	0	0	111.8	K257 R259 E265	K257-N261 PolarHBondContact O-N 2.89Å; K257-N261 PolarHBondContact O-OD1 2.83Å; R259-N261 VanDerWaalsContact C-N 3.31Å; R259-N261 PolarHBondContact O-N 2.92Å; N261-E265 VanDerWaalsContact O-CB 3.25Å; N261-E265 WeakPolarHBondContact O-CB 3.34Å; N261-E265 PolarHBondContact O-N 2.79Å
262	R	60.9	Low	57.3	Low	177 Å²	177	114 Å²	114	67%	0.668	56%	0.562	S	S	*	*	H	α-helix	trans	-72.5	-38	178.6	-157.6	-178.3	-159.8	-176.9	6.3	112.8	M258 R259 R260 E264 E265 E266	M258-R262 PolarHBondContact O-N 3.47Å; R259-R262 WeakPolarHBondContact O-CA 3.39Å; R259-R262 WeakPolarHBondContact O-CB 3.4Å; R259-R262 PolarHBondContact O-N 3.43Å; R260-R262 PolarHBondContact O-N 3Å; R262-E264 VanDerWaalsContact C-N 3.34Å; R262-E265 PolarHBondContact O-N 2.91Å; R262-E266 PolarHBondContact O-N 3.02Å
263	D	61	Low	58.6	Low	96 Å²	96	113 Å²	113	51%	0.513	56%	0.557	S	S	.	*	H	α-helix	trans	-65.3	-39.5	173.8	-57.8	-32.7	0	0	0	110.7	R259 R260 V267	R259-D263 PolarHBondContact O-N 3.12Å; R260-D263 PolarHBondContact O-N 3.36Å; D263-V267 WeakPolarHBondContact O-CB 3.39Å; D263-V267 VanDerWaalsContact O-CG2 3.3Å; D263-V267 WeakPolarHBondContact O-CG2 3.46Å; D263-V267 PolarHBondContact O-N 3.39Å
264	E	64	Low	59.9	Low	132 Å²	132	109.4 Å²	109.4	62%	0.617	55%	0.55	S	S	*	*	H	α-helix	trans	-69.8	-34.4	174.7	-72.8	174.5	-159.5	0	0	112.2	R260 R262 V267 A268	R260-E264 WeakPolarHBondContact O-CB 3.22Å; R260-E264 WeakPolarHBondContact O-CG 3.33Å; R260-E264 PolarHBondContact O-N 3.39Å; R262-E264 VanDerWaalsContact C-N 3.34Å; E264-V267 PolarHBondContact O-N 3.46Å; E264-A268 WeakPolarHBondContact O-CB 3.44Å; E264-A268 PolarHBondContact O-N 2.85Å
265	E	63.7	Low	61	Low	135 Å²	135	108 Å²	108	63%	0.631	55%	0.545	S	S	*	.	H	α-helix	trans	-68.8	-43.2	173.6	-174.8	173	-146.6	0	0	112.3	N261 R262 V267 A268 A269	N261-E265 VanDerWaalsContact O-CB 3.25Å; N261-E265 WeakPolarHBondContact O-CB 3.34Å; N261-E265 PolarHBondContact O-N 2.79Å; R262-E265 PolarHBondContact O-N 2.91Å; E265-V267 VanDerWaalsContact C-N 3.34Å; E265-V267 PolarHBondContact O-N 3.28Å; E265-A268 PolarHBondContact O-N 3.42Å; E265-A269 WeakPolarHBondContact O-CB 3.45Å; E265-A269 PolarHBondContact O-N 2.97Å
266	E	71.1	Confident	61.8	Low	117 Å²	117	111.7 Å²	111.7	55%	0.547	55%	0.554	S	S	.	*	H	α-helix	trans	-62	-40.6	171.4	-82.3	-165	-178.4	0	0	111.9	R262 A269 Q270	R262-E266 PolarHBondContact O-N 3.02Å; E266-A269 PolarHBondContact O-N 3.34Å; E266-Q270 WeakPolarHBondContact O-CB 3.3Å; E266-Q270 VanDerWaalsContact O-CG 3.25Å; E266-Q270 WeakPolarHBondContact O-CG 3.43Å; E266-Q270 PolarHBondContact O-N 2.81Å
267	V	76.7	Confident	62.9	Low	80 Å²	80	111.2 Å²	111.2	49%	0.485	55%	0.552	S	S	.	*	H	α-helix	trans	-67.3	-38.3	175.7	168.9	0	0	0	0	111.3	D263 E264 E265 L271	D263-V267 WeakPolarHBondContact O-CB 3.39Å; D263-V267 VanDerWaalsContact O-CG2 3.3Å; D263-V267 WeakPolarHBondContact O-CG2 3.46Å; D263-V267 PolarHBondContact O-N 3.39Å; E264-V267 PolarHBondContact O-N 3.46Å; E265-V267 VanDerWaalsContact C-N 3.34Å; E265-V267 PolarHBondContact O-N 3.28Å; V267-L271 HydrophobicContact CG1-CD1 3.92Å; V267-L271 HydrophobicContact CG1-CG 4.45Å; V267-L271 WeakPolarHBondContact O-CB 3.37Å; V267-L271 VanDerWaalsContact O-CG 3.23Å; V267-L271 WeakPolarHBondContact O-CG 3.5Å; V267-L271 PolarHBondContact O-N 3.37Å
268	A	66.5	Low	64.2	Low	59 Å²	59	109.4 Å²	109.4	49%	0.488	55%	0.548	S	S	.	.	H	α-helix	trans	-64.3	-43.2	173.6	0	0	0	0	0	111.8	E264 E265 L271 A272	E264-A268 WeakPolarHBondContact O-CB 3.44Å; E264-A268 PolarHBondContact O-N 2.85Å; E265-A268 PolarHBondContact O-N 3.42Å; A268-L271 PolarHBondContact O-N 2.99Å; A268-A272 WeakPolarHBondContact O-CB 3.45Å; A268-A272 PolarHBondContact O-N 2.99Å
269	A	75.6	Confident	64.6	Low	60 Å²	60	108.7 Å²	108.7	50%	0.496	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-46.5	175.3	0	0	0	0	0	111.9	E265 E266 L271 A272 E273	E265-A269 WeakPolarHBondContact O-CB 3.45Å; E265-A269 PolarHBondContact O-N 2.97Å; E266-A269 PolarHBondContact O-N 3.34Å; A269-L271 VanDerWaalsContact C-N 3.31Å; A269-L271 PolarHBondContact O-N 3.06Å; A269-A272 PolarHBondContact O-N 3.46Å; A269-E273 WeakPolarHBondContact O-CB 3.45Å; A269-E273 PolarHBondContact O-N 2.96Å
270	Q	75.6	Confident	64.8	Low	112 Å²	112	102.2 Å²	102.2	52%	0.523	53%	0.529	S	S	.	.	H	α-helix	trans	-64.3	-33.7	176.1	-72.1	171.6	36.9	0	0	112.5	E266 L274	E266-Q270 WeakPolarHBondContact O-CB 3.3Å; E266-Q270 VanDerWaalsContact O-CG 3.25Å; E266-Q270 WeakPolarHBondContact O-CG 3.43Å; E266-Q270 PolarHBondContact O-N 2.81Å; Q270-L274 WeakPolarHBondContact O-CB 3.29Å; Q270-L274 PolarHBondContact O-N 2.84Å
271	L	71.3	Confident	65.1	Low	106 Å²	106	103.3 Å²	103.3	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-73.4	-34.8	173.9	-73.6	170.9	0	0	0	112.4	V267 A268 A269 A275	V267-L271 HydrophobicContact CG1-CD1 3.92Å; V267-L271 HydrophobicContact CG1-CG 4.45Å; V267-L271 WeakPolarHBondContact O-CB 3.37Å; V267-L271 VanDerWaalsContact O-CG 3.23Å; V267-L271 WeakPolarHBondContact O-CG 3.5Å; V267-L271 PolarHBondContact O-N 3.37Å; A268-L271 PolarHBondContact O-N 2.99Å; A269-L271 VanDerWaalsContact C-N 3.31Å; A269-L271 PolarHBondContact O-N 3.06Å; L271-A275 WeakPolarHBondContact O-CB 3.25Å; L271-A275 PolarHBondContact O-N 3.05Å
272	A	68.8	Low	65	Low	53 Å²	53	105.8 Å²	105.8	44%	0.438	54%	0.541	S	S	.	.	H	α-helix	trans	-68.2	-42.6	172.6	0	0	0	0	0	111.7	A268 A269 A275 F276	A268-A272 WeakPolarHBondContact O-CB 3.45Å; A268-A272 PolarHBondContact O-N 2.99Å; A269-A272 PolarHBondContact O-N 3.46Å; A272-A275 WeakPolarHBondContact O-CB 3.45Å; A272-A275 PolarHBondContact O-N 3.05Å; A272-F276 PolarHBondContact O-N 3Å
273	E	67.1	Low	64.2	Low	118 Å²	118	102.1 Å²	102.1	55%	0.551	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-44.8	172.7	-167	-166	177	0	0	110.8	A269 A275 F276 I277	A269-E273 WeakPolarHBondContact O-CB 3.45Å; A269-E273 PolarHBondContact O-N 2.96Å; E273-A275 VanDerWaalsContact C-N 3.31Å; E273-A275 PolarHBondContact O-N 2.96Å; E273-F276 CarbonylContact O-C 3.6Å; E273-F276 WeakPolarHBondContact O-CB 3.42Å; E273-F276 PolarHBondContact O-N 2.78Å; E273-F276 VanDerWaalsContact O-N 3.14Å; E273-I277 HydrophobicContact CG-CD1 4.01Å; E273-I277 VanDerWaalsContact O-CG1 3.31Å; E273-I277 WeakPolarHBondContact O-CG1 3.21Å; E273-I277 PolarHBondContact O-N 3.23Å
274	L	68.5	Low	63.4	Low	93 Å²	93	105.1 Å²	105.1	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-62.7	-37.9	176	-168.9	72.3	0	0	0	111.9	Q270 I277 I278	Q270-L274 WeakPolarHBondContact O-CB 3.29Å; Q270-L274 PolarHBondContact O-N 2.84Å; L274-I277 PolarHBondContact O-N 3.31Å; L274-I278 HydrophobicContact CG-CD1 4.23Å; L274-I278 WeakPolarHBondContact O-CB 3.42Å; L274-I278 WeakPolarHBondContact O-CD1 3.5Å; L274-I278 VanDerWaalsContact O-CG1 3.23Å; L274-I278 WeakPolarHBondContact O-CG1 3.44Å; L274-I278 PolarHBondContact O-N 3.37Å
275	A	62.6	Low	62.5	Low	54 Å²	54	107 Å²	107	45%	0.446	55%	0.554	S	S	.	*	H	α-helix	trans	-63.8	-44.6	172.2	0	0	0	0	0	111.2	L271 A272 E273 I277 I278 Q279	L271-A275 WeakPolarHBondContact O-CB 3.25Å; L271-A275 PolarHBondContact O-N 3.05Å; A272-A275 WeakPolarHBondContact O-CB 3.45Å; A272-A275 PolarHBondContact O-N 3.05Å; E273-A275 VanDerWaalsContact C-N 3.31Å; E273-A275 PolarHBondContact O-N 2.96Å; A275-I277 PolarHBondContact O-N 2.91Å; A275-I278 PolarHBondContact O-N 3.1Å; A275-Q279 WeakPolarHBondContact O-CB 3.49Å; A275-Q279 PolarHBondContact O-N 2.99Å
276	F	62.8	Low	61.6	Low	162 Å²	162	104.6 Å²	104.6	71%	0.711	55%	0.553	S	S	*	*	H	α-helix	trans	-60	-42	173.5	-107.2	-88	0	0	0	112.6	A272 E273 I278 Q279 A280	A272-F276 PolarHBondContact O-N 3Å; E273-F276 CarbonylContact O-C 3.6Å; E273-F276 WeakPolarHBondContact O-CB 3.42Å; E273-F276 PolarHBondContact O-N 2.78Å; E273-F276 VanDerWaalsContact O-N 3.14Å; F276-I278 VanDerWaalsContact C-N 3.31Å; F276-I278 PolarHBondContact O-N 3.2Å; F276-Q279 PolarHBondContact O-N 2.78Å; F276-A280 WeakPolarHBondContact O-CB 3.45Å; F276-A280 PolarHBondContact O-N 2.73Å
277	I	73.4	Confident	60.1	Low	70 Å²	70	105.6 Å²	105.6	36%	0.359	56%	0.562	S	S	.	*	H	α-helix	trans	-66.1	-34	176.6	-69.2	164.5	0	0	0	111.4	E273 L274 A275 R281	E273-I277 HydrophobicContact CG-CD1 4.01Å; E273-I277 VanDerWaalsContact O-CG1 3.31Å; E273-I277 WeakPolarHBondContact O-CG1 3.21Å; E273-I277 PolarHBondContact O-N 3.23Å; L274-I277 PolarHBondContact O-N 3.31Å; A275-I277 PolarHBondContact O-N 2.91Å; I277-R281 WeakPolarHBondContact O-CB 3.4Å; I277-R281 VanDerWaalsContact O-CG 3.25Å; I277-R281 WeakPolarHBondContact O-CG 3.4Å; I277-R281 PolarHBondContact O-N 3.07Å; I277-R281 VanDerWaalsContact O-N 3.09Å
278	I	68.3	Low	58.3	Low	107 Å²	107	109.3 Å²	109.3	55%	0.549	58%	0.579	S	S	.	*	H	α-helix	trans	-71.5	-44.9	174.2	-70.5	164.7	0	0	0	110.7	L274 A275 F276 R281 H282	L274-I278 HydrophobicContact CG-CD1 4.23Å; L274-I278 WeakPolarHBondContact O-CB 3.42Å; L274-I278 WeakPolarHBondContact O-CD1 3.5Å; L274-I278 VanDerWaalsContact O-CG1 3.23Å; L274-I278 WeakPolarHBondContact O-CG1 3.44Å; L274-I278 PolarHBondContact O-N 3.37Å; A275-I278 PolarHBondContact O-N 3.1Å; F276-I278 VanDerWaalsContact C-N 3.31Å; F276-I278 PolarHBondContact O-N 3.2Å; I278-R281 PolarHBondContact O-N 3.17Å; I278-H282 WeakPolarHBondContact O-CB 3.44Å; I278-H282 PolarHBondContact O-N 3.02Å
279	Q	48.9	Very low	56.6	Low	127 Å²	127	109.7 Å²	109.7	59%	0.593	59%	0.589	S	S	*	*	H	α-helix	trans	-62.2	-45.2	176.8	-158.8	89.9	-1.5	0	0	111.2	A275 F276 H282 N283	A275-Q279 WeakPolarHBondContact O-CB 3.49Å; A275-Q279 PolarHBondContact O-N 2.99Å; F276-Q279 PolarHBondContact O-N 2.78Å; Q279-H282 WeakPolarHBondContact O-CB 3.2Å; Q279-H282 PolarHBondContact O-N 2.94Å; Q279-H282 VanDerWaalsContact O-N 3.16Å; Q279-N283 PolarHBondContact O-N 3.22Å
280	A	55.2	Low	55.1	Low	48 Å²	48	112 Å²	112	40%	0.397	60%	0.599	S	S	.	*	H	α-helix	trans	-64.2	-40.3	177.5	0	0	0	0	0	111.9	F276 H282 N283 Q284	F276-A280 WeakPolarHBondContact O-CB 3.45Å; F276-A280 PolarHBondContact O-N 2.73Å; A280-H282 VanDerWaalsContact C-N 3.31Å; A280-H282 PolarHBondContact O-N 2.85Å; A280-N283 PolarHBondContact O-N 2.93Å; A280-Q284 VanDerWaalsContact O-CB 3.31Å; A280-Q284 WeakPolarHBondContact O-CB 3.31Å; A280-Q284 WeakPolarHBondContact O-CG 3.35Å; A280-Q284 PolarHBondContact O-N 2.84Å
281	R	54.9	Low	53	Low	174 Å²	174	112.9 Å²	112.9	66%	0.657	61%	0.614	S	S	*	*	H	α-helix	trans	-66.2	-32	172.7	-77.7	173.5	-179.5	-96.3	-4.5	113.1	I277 I278	I277-R281 WeakPolarHBondContact O-CB 3.4Å; I277-R281 VanDerWaalsContact O-CG 3.25Å; I277-R281 WeakPolarHBondContact O-CG 3.4Å; I277-R281 PolarHBondContact O-N 3.07Å; I277-R281 VanDerWaalsContact O-N 3.09Å; I278-R281 PolarHBondContact O-N 3.17Å
282	H	48	Very low	51.1	Low	142 Å²	142	117.7 Å²	117.7	66%	0.657	63%	0.631	S	S	*	*	H	α-helix	trans	-70.7	-38.3	175.1	-164.6	-86.1	0	0	0	111.4	I278 Q279 A280 Q285	I278-H282 WeakPolarHBondContact O-CB 3.44Å; I278-H282 PolarHBondContact O-N 3.02Å; Q279-H282 WeakPolarHBondContact O-CB 3.2Å; Q279-H282 PolarHBondContact O-N 2.94Å; Q279-H282 VanDerWaalsContact O-N 3.16Å; A280-H282 VanDerWaalsContact C-N 3.31Å; A280-H282 PolarHBondContact O-N 2.85Å; H282-Q285 PolarHBondContact O-N 3.43Å
283	N	43.7	Very low	49.1	Very low	100 Å²	100	118.7 Å²	118.7	54%	0.535	65%	0.647	S	S	.	*	H	α-helix	trans	-81	-31.2	179.1	-68.5	4.5	0	0	0	113.3	Q279 A280 Q285 S286	Q279-N283 PolarHBondContact O-N 3.22Å; A280-N283 PolarHBondContact O-N 2.93Å; N283-Q285 PolarHBondContact O-N 3.21Å; N283-S286 PolarHBondContact O-N 3.45Å; N283-S286 PolarHBondContact O-OG 2.94Å
284	Q	45.7	Very low	47.4	Very low	159 Å²	159	119.4 Å²	119.4	74%	0.743	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-5.4	170.3	-79.6	-178.3	-16	0	0	113.4	A280	A280-Q284 VanDerWaalsContact O-CB 3.31Å; A280-Q284 WeakPolarHBondContact O-CB 3.31Å; A280-Q284 WeakPolarHBondContact O-CG 3.35Å; A280-Q284 PolarHBondContact O-N 2.84Å
285	Q	43.6	Very low	45.7	Very low	170 Å²	170	120.6 Å²	120.6	79%	0.794	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	6.5	-177.5	-154.6	144.6	32.6	0	0	113.7	H282 N283	H282-Q285 PolarHBondContact O-N 3.43Å; N283-Q285 PolarHBondContact O-N 3.21Å
286	S	46	Very low	43.9	Very low	86 Å²	86	124.5 Å²	124.5	60%	0.601	69%	0.69	S	S	*	*	S	Bend	trans	-97.2	-31.5	177.3	64.7	0	0	0	0	115.8	N283	N283-S286 PolarHBondContact O-N 3.45Å; N283-S286 PolarHBondContact O-OG 2.94Å
287	D	40.1	Very low	42.3	Very low	138 Å²	138	121.3 Å²	121.3	74%	0.738	69%	0.688	S	S	*	*	S	Bend	trans	-124.3	37.3	-168.8	-80.1	-70.1	0	0	0	114.9
288	N	37.6	Very low	40.1	Very low	157 Å²	157	123 Å²	123	84%	0.84	71%	0.713	S	S	*	*			trans	-153.4	70	158.4	-108.4	-74.4	0	0	0	110.6
289	G	31	Very low	38.2	Very low	68 Å²	68	123.7 Å²	123.7	70%	0.701	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-76.7	131.8	173.1	0	0	0	0	0	111.5
290	P	43.7	Very low	37	Very low	109 Å²	109	126.5 Å²	126.5	71%	0.708	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-67.8	153.7	173.2	29.7	-35.1	0	0	0	111.2	K292	P290-K292 PolarHBondContact O-N 3.47Å
291	P	32.9	Very low	35.5	Very low	129 Å²	129	134.7 Å²	134.7	84%	0.838	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-57.9	135.4	172.1	24.7	-33.4	0	0	0	110.6	G293	P291-G293 PolarHBondContact O-N 2.89Å; P291-G293 VanDerWaalsContact O-N 3.11Å
292	K	29.8	Very low	34	Very low	207 Å²	207	132.7 Å²	132.7	90%	0.9	75%	0.751	S	S	*	*			trans	-72	103.6	-167.1	-67.2	175.7	-179.1	172.6	0	112.4	P290	P290-K292 PolarHBondContact O-N 3.47Å
293	G	28.4	Very low	32.9	Very low	75 Å²	75	135.8 Å²	135.8	77%	0.773	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-74.2	122.7	156.4	0	0	0	0	0	110.5	P291	P291-G293 PolarHBondContact O-N 2.89Å; P291-G293 VanDerWaalsContact O-N 3.11Å
294	T	30.7	Very low	32	Very low	132 Å²	132	139.8 Å²	139.8	81%	0.81	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-73.7	157.1	175.8	18.9	0	0	0	0	112.2
295	P	32.9	Very low	31.1	Very low	119 Å²	119	136.8 Å²	136.8	77%	0.773	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-84.7	141.4	-162.4	32.6	-35.7	0	0	0	113.9
296	V	24.9	Very low	30.2	Very low	136 Å²	136	138 Å²	138	82%	0.824	77%	0.773	S	S	*	*			trans	-125.6	109.5	161.8	-178.9	0	0	0	0	110.8
297	S	29	Very low	29.3	Very low	94 Å²	94	142.4 Å²	142.4	66%	0.657	78%	0.784	S	S	*	*			trans	2.2	128.4	146.9	-51	0	0	0	0	118.8	I299	S297-I299 PolarHBondContact O-N 2.91Å
298	A	26.7	Very low	28.6	Very low	106 Å²	106	141.3 Å²	141.3	88%	0.876	79%	0.788	S	S	*	*			trans	-67.4	113.8	160.5	0	0	0	0	0	110.8
299	I	28.2	Very low	28.4	Very low	121 Å²	121	139.4 Å²	139.4	62%	0.621	78%	0.784	S	S	*	*			trans	-104.5	92	170.1	-60.8	-174.5	0	0	0	110.7	S297 Y301	S297-I299 PolarHBondContact O-N 2.91Å; I299-Y301 HydrophobicContact CG2-CD2 4.13Å; I299-Y301 HydrophobicContact CG2-CE2 3.89Å; I299-Y301 WeakPolarHBondContact O-CD2 3.1Å; I299-Y301 PolarHBondContact O-N 3.39Å
300	K	24.6	Very low	28	Very low	186 Å²	186	141.6 Å²	141.6	81%	0.809	79%	0.787	S	S	*	*			trans	-35.9	95.5	148.1	176.3	-170.6	-177.2	177.5	0	112.4	N302	K300-N302 PolarHBondContact O-N 2.94Å; K300-N302 VanDerWaalsContact O-N 3.17Å
301	Y	23.1	Very low	27.2	Very low	220 Å²	220	144.1 Å²	144.1	86%	0.863	79%	0.789	S	S	*	*			trans	-79.3	91.9	162.5	-85.1	-85.2	0	0	0	109.9	I299	I299-Y301 HydrophobicContact CG2-CD2 4.13Å; I299-Y301 HydrophobicContact CG2-CE2 3.89Å; I299-Y301 WeakPolarHBondContact O-CD2 3.1Å; I299-Y301 PolarHBondContact O-N 3.39Å
302	N	23.8	Very low	27.1	Very low	133 Å²	133	146.8 Å²	146.8	71%	0.711	79%	0.788	S	S	*	*			trans	-91.9	138.9	158.2	-167.6	12.2	0	0	0	109.2	K300	K300-N302 PolarHBondContact O-N 2.94Å; K300-N302 VanDerWaalsContact O-N 3.17Å
303	Y	25.2	Very low	26.9	Very low	207 Å²	207	146.4 Å²	146.4	81%	0.812	79%	0.786	S	S	*	*			trans	-66.1	127.8	179.6	-157	-105.4	0	0	0	110.9
304	K	24.6	Very low	27.6	Very low	183 Å²	183	148.7 Å²	148.7	80%	0.796	79%	0.787	S	S	*	*			trans	166.6	136.1	134.2	-92.7	157.8	-173.3	179.5	0	115.3
305	S	27.3	Very low	27.9	Very low	96 Å²	96	148.1 Å²	148.1	67%	0.671	79%	0.786	S	S	*	*			trans	50	112.3	134.2	-148.1	0	0	0	0	119.3
306	Q	24.1	Very low	27.7	Very low	196 Å²	196	150.2 Å²	150.2	92%	0.916	79%	0.789	S	S	*	*			trans	-67.5	162.2	138.4	-76.5	-166.4	-4.1	0	0	110.1
307	Q	27.5	Very low	27.9	Very low	178 Å²	178	152.9 Å²	152.9	83%	0.832	79%	0.79	S	S	*	*			trans	-143.4	156.1	-174.4	-61.4	177.9	-22.3	0	0	110.2
308	S	24	Very low	27.8	Very low	116 Å²	116	158.4 Å²	158.4	81%	0.811	80%	0.802	S	S	*	*			trans	-169.2	161.6	140.3	50.5	0	0	0	0	109.9
309	P	33.9	Very low	27.7	Very low	117 Å²	117	160.1 Å²	160.1	76%	0.76	80%	0.802	S	S	*	*			cis	-124.1	142.4	2.6	36.5	-21.2	0	0	0	116.6
310	C	22.3	Very low	27.7	Very low	113 Å²	113	163.2 Å²	163.2	76%	0.764	81%	0.811	S	S	*	*			trans	49.3	124.9	131.7	-161.9	0	0	0	0	121.9
311	Q	28	Very low	27.7	Very low	163 Å²	163	160.6 Å²	160.6	76%	0.762	81%	0.811	S	S	*	*				-157	120.8	113.5	-80.3	-131.9	37.7	0	0	113.3
312	K	29.3	Very low	27.8	Very low	184 Å²	184	156.4 Å²	156.4	80%	0.8	81%	0.808	S	S	*	*			trans	48.7	152.2	144.6	-62.8	175.8	-178.3	171.3	0	123.3
313	K	26.6	Very low	28.6	Very low	200 Å²	200	155.8 Å²	155.8	87%	0.87	81%	0.812	S	S	*	*			trans	-87.8	177.6	-179.4	-46.4	173.2	-176.2	176.4	0	111.5
314	P	43.2	Very low	28.6	Very low	122 Å²	122	151.2 Å²	151.2	79%	0.792	81%	0.81	S	S	*	*			cis	-114.7	-114.5	-3.9	34.5	-12.3	0	0	0	111.9
315	P	36.7	Very low	28.7	Very low	121 Å²	121	151.8 Å²	151.8	79%	0.786	81%	0.812	S	S	*	*			cis	-111.8	-123.4	-0.1	41.6	-25.6	0	0	0	114.9
316	L	28	Very low	29.2	Very low	162 Å²	162	152.8 Å²	152.8	85%	0.848	82%	0.817	S	S	*	*			trans	-140.9	174.3	-163.2	-128.6	84.2	0	0	0	116.9
317	K	30.4	Very low	29.3	Very low	193 Å²	193	153.7 Å²	153.7	84%	0.839	81%	0.812	S	S	*	*			trans	-41.1	162.9	-178.1	-64.4	174.6	176.8	176.5	0	119.5
318	K	26.6	Very low	29.3	Very low	209 Å²	209	154.1 Å²	154.1	91%	0.909	81%	0.811	S	S	*	*			trans	-54.6	136.4	170.9	-65.1	178.6	179.3	177.2	0	113.7
319	T	24.4	Very low	29.3	Very low	143 Å²	143	158.6 Å²	158.6	88%	0.877	82%	0.816	S	S	*	*			trans	-123.8	172.9	142.3	-41.6	0	0	0	0	108.6
320	K	27.3	Very low	28.8	Very low	185 Å²	185	161.7 Å²	161.7	80%	0.804	82%	0.817	S	S	*	*			trans	-73	166.1	-167.2	-161.6	176.1	179.7	-179.5	0	113.7
321	T	25.4	Very low	28.9	Very low	132 Å²	132	159.7 Å²	159.7	81%	0.81	81%	0.805	S	S	*	*			trans	91.7	126.4	163.6	70.1	0	0	0	0	120.6
322	T	24.6	Very low	28.8	Very low	131 Å²	131	160 Å²	160	80%	0.804	81%	0.811	S	S	*	*			trans	-86.1	171	150.4	44.9	0	0	0	0	109.8
323	P	40.7	Very low	28.5	Very low	121 Å²	121	154.8 Å²	154.8	79%	0.786	81%	0.81	S	S	*	*			cis	-117.9	-168.8	4.6	38.2	-19.6	0	0	0	111.6
324	S	24.9	Very low	28.6	Very low	110 Å²	110	153.3 Å²	153.3	77%	0.769	81%	0.811	S	S	*	*			cis	-170	174.3	36.2	56.6	0	0	0	0	113.7
325	K	27.4	Very low	27.8	Very low	195 Å²	195	155.4 Å²	155.4	85%	0.848	81%	0.81	S	S	*	*			trans	-92.8	150.5	164.5	-74.1	177.2	177.4	172.6	0	108.3
326	P	37.6	Very low	27.2	Very low	118 Å²	118	158.3 Å²	158.3	77%	0.766	81%	0.813	S	S	*	*				-159.6	135.3	75.1	39.2	-16.3	0	0	0	120.5
327	R	26	Very low	27.1	Very low	214 Å²	214	154 Å²	154	81%	0.808	81%	0.808	S	S	*	*				59.8	125.2	116.2	-154.6	178.9	-160	-176.6	6.7	122
328	K	27.3	Very low	27	Very low	187 Å²	187	150 Å²	150	81%	0.813	81%	0.811	S	S	*	*			trans	78	105.3	150.7	-89.9	-177.8	173.8	-171.7	0	121
329	K	25	Very low	27	Very low	211 Å²	211	145.6 Å²	145.6	92%	0.917	81%	0.806	S	S	*	*				-177	173	122.2	-98.5	173.1	-177.9	-179.1	0	107.3
330	K	23.7	Very low	27.1	Very low	181 Å²	181	150.1 Å²	150.1	79%	0.787	81%	0.807	S	S	*	*			cis	166.5	109.9	-47.7	-172.1	-148.4	175.8	-165.4	0	105.3
331	S	23.5	Very low	27.2	Very low	72 Å²	72	152.7 Å²	152.7	50%	0.503	81%	0.812	S	S	.	*			trans	42.2	111.9	159.4	63.1	0	0	0	0	121.1
332	D	25.5	Very low	27.2	Very low	168 Å²	168	152.7 Å²	152.7	90%	0.898	81%	0.812	S	S	*	*				62.6	146.5	121.5	-42.9	-42.7	0	0	0	123.3
333	G	24	Very low	27.2	Very low	75 Å²	75	149.6 Å²	149.6	77%	0.773	81%	0.806	S	S	*	*			trans	116.9	100.1	-176.8	0	0	0	0	0	110.8
334	L	28.3	Very low	26.4	Very low	169 Å²	169	153.2 Å²	153.2	89%	0.885	81%	0.813	S	S	*	*			cis	88.5	147.6	39	-165.4	64.8	0	0	0	113.5
335	Q	26.2	Very low	26.4	Very low	167 Å²	167	152 Å²	152	78%	0.78	82%	0.817	S	S	*	*			trans	81.2	154.8	-175.9	-51.1	-175.7	-7.1	0	0	113.5
336	E	25	Very low	26.3	Very low	182 Å²	182	146.2 Å²	146.2	85%	0.85	81%	0.813	S	S	*	*			cis	-151.1	164.2	10.8	-152.3	165.2	-164.4	0	0	108.2
337	G	26	Very low	25.8	Very low	72 Å²	72	149.4 Å²	149.4	74%	0.742	82%	0.818	S	S	*	*			cis	154.2	171	-7.3	0	0	0	0	0	110.7
338	A	26.6	Very low	25.8	Very low	109 Å²	109	145.1 Å²	145.1	90%	0.901	82%	0.816	S	S	*	*			trans	-159.9	130.8	169.6	0	0	0	0	0	111.4
339	S	26.8	Very low	26.5	Very low	116 Å²	116	141.2 Å²	141.2	81%	0.811	81%	0.81	S	S	*	*			trans	-171.8	151.2	179	175.7	0	0	0	0	111.5
340	R	27.9	Very low	26.6	Very low	237 Å²	237	139 Å²	139	89%	0.894	80%	0.802	S	S	*	*			trans	178.6	162.7	142.9	-103.5	166.1	-173.2	-148.1	0	114.7
341	R	29	Very low	26.7	Very low	239 Å²	239	141 Å²	141	90%	0.902	81%	0.805	S	S	*	*			trans	79.7	121.3	178	-54.6	-171.7	-170.8	-153.6	3.3	114
342	T	24.5	Very low	26.9	Very low	132 Å²	132	142.6 Å²	142.6	81%	0.81	82%	0.816	S	S	*	*			cis	-151	129.3	-3.2	-50.9	0	0	0	0	106
343	G	24.7	Very low	27	Very low	67 Å²	67	146.6 Å²	146.6	69%	0.691	82%	0.819	S	S	*	*				90.1	129.7	66.3	0	0	0	0	0	110.2
344	Q	25.3	Very low	27.1	Very low	197 Å²	197	146.8 Å²	146.8	92%	0.921	82%	0.821	S	S	*	*			cis	-153.5	164.7	6.2	-67.1	-179.8	-24.7	0	0	112.1
345	G	23.7	Very low	27.2	Very low	84 Å²	84	147 Å²	147	87%	0.866	82%	0.817	S	S	*	*			trans	85.6	143.5	161.2	0	0	0	0	0	117.5
346	G	26.5	Very low	27.4	Very low	74 Å²	74	146.4 Å²	146.4	76%	0.763	82%	0.819	S	S	*	*			cis	-176.2	151.3	-8.3	0	0	0	0	0	114.2
347	E	26.8	Very low	27.4	Very low	185 Å²	185	141.3 Å²	141.3	86%	0.864	82%	0.815	S	S	*	*			trans	60.9	107.9	151.4	-53.3	-166.6	127.3	0	0	123.8
348	T	25	Very low	27.6	Very low	124 Å²	124	146 Å²	146	76%	0.761	82%	0.822	S	S	*	*				21.5	166	117.8	42.4	0	0	0	0	123.8
349	P	43.1	Very low	28.6	Very low	105 Å²	105	145.5 Å²	145.5	68%	0.682	81%	0.81	S	S	*	*			cis	-146	-177.4	-24.4	38.3	-17.4	0	0	0	117.5
350	H	26.2	Very low	28.6	Very low	164 Å²	164	149.1 Å²	149.1	76%	0.759	81%	0.814	S	S	*	*			trans	68.7	132.6	140.7	-97.5	-45.3	0	0	0	126.2
351	R	26.7	Very low	28.5	Very low	222 Å²	222	141.4 Å²	141.4	84%	0.838	81%	0.808	S	S	*	*			trans	65.2	157.8	155.4	-58.8	-180	168.2	175.4	-2.9	115.2
352	S	26.9	Very low	28.7	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	81%	0.808	S	S	*	*			cis	-152	160.4	22.2	-55.2	0	0	0	0	114.4
353	R	28.1	Very low	29.1	Very low	252 Å²	252	138.7 Å²	138.7	95%	0.951	81%	0.805	S	S	*	*			trans	16.6	125	132.5	-171.6	-166.3	-158.3	-177.8	6.4	119.1
354	G	26.8	Very low	29.1	Very low	79 Å²	79	140.6 Å²	140.6	81%	0.814	81%	0.808	S	S	*	*			trans	175	143.6	161.2	0	0	0	0	0	114.7
355	Q	30.7	Very low	29.3	Very low	174 Å²	174	142.1 Å²	142.1	81%	0.813	81%	0.805	S	S	*	*			trans	-106.1	156.1	-179.6	-100.9	-177.5	-16.5	0	0	112.2
356	N	30.1	Very low	29.7	Very low	153 Å²	153	146 Å²	146	82%	0.818	80%	0.801	S	S	*	*			trans	68.5	144.7	153.8	-56.8	-15.2	0	0	0	119.5
357	G	24.6	Very low	30.2	Very low	75 Å²	75	148.4 Å²	148.4	77%	0.773	80%	0.803	S	S	*	*			trans	136.9	91.4	167.8	0	0	0	0	0	115.7
358	L	28.8	Very low	30.5	Very low	170 Å²	170	149.1 Å²	149.1	89%	0.89	80%	0.803	S	S	*	*			trans	-87.7	170	149	-107.9	84.8	0	0	0	108.3
359	P	48.8	Very low	30.8	Very low	99 Å²	99	149.9 Å²	149.9	64%	0.643	80%	0.802	S	S	*	*			cis	-141.8	179.5	21.7	42	-23	0	0	0	117.8
360	H	26.6	Very low	30.2	Very low	193 Å²	193	150.2 Å²	150.2	89%	0.894	80%	0.798	S	S	*	*			trans	58.3	143.8	147.1	-75.9	-21.1	0	0	0	123.6
361	G	24.8	Very low	30.3	Very low	75 Å²	75	150.9 Å²	150.9	77%	0.773	80%	0.8	S	S	*	*			trans	152.7	132.7	162.8	0	0	0	0	0	114.7
362	K	34.3	Very low	30.3	Very low	207 Å²	207	150.3 Å²	150.3	90%	0.9	80%	0.803	S	S	*	*			trans	-134.6	154.9	168	-64.8	-178.4	-179.8	176	0	107.4
363	S	31.7	Very low	30.7	Very low	106 Å²	106	153.3 Å²	153.3	74%	0.741	81%	0.81	S	S	*	*				176	173.4	61	57	0	0	0	0	114.3
364	S	25.2	Very low	31	Very low	107 Å²	107	146.6 Å²	146.6	75%	0.748	80%	0.799	S	S	*	*			trans	79.8	164.1	164.2	88.3	0	0	0	0	117.7
365	R	31	Very low	31.4	Very low	229 Å²	229	151.2 Å²	151.2	86%	0.864	81%	0.805	S	S	*	*			cis	-156.6	146.4	-1.1	-142.1	167	-172.9	168.1	1.3	113.5
366	Q	30.5	Very low	31.5	Very low	167 Å²	167	147.6 Å²	147.6	78%	0.78	80%	0.804	S	S	*	*			trans	14.7	139.1	150	-70.5	-74.1	-35.5	0	0	123.9
367	P	37.5	Very low	31.9	Very low	124 Å²	124	149.5 Å²	149.5	81%	0.805	81%	0.808	S	S	*	*				-136.9	-166	123.7	40.3	-27.9	0	0	0	115.7
368	K	32.3	Very low	32.9	Very low	200 Å²	200	152.6 Å²	152.6	87%	0.87	81%	0.806	S	S	*	*			trans	-100.1	164.8	-150.3	-55.6	176.1	-179.3	176.8	0	118.5
369	N	31.3	Very low	33.9	Very low	139 Å²	139	149.4 Å²	149.4	74%	0.743	79%	0.789	S	S	*	*			trans	-31	159	158.9	-58.6	14.1	0	0	0	116.3
370	N	32.3	Very low	33.5	Very low	112 Å²	112	150.4 Å²	150.4	60%	0.599	79%	0.788	S	S	*	*			cis	-172.5	-172.2	-10.1	-96.9	-2.3	0	0	0	106.3
371	F	27.2	Very low	34.7	Very low	179 Å²	179	149.4 Å²	149.4	79%	0.785	78%	0.782	S	S	*	*			cis	-141.8	131.1	4.4	-76.1	-87.3	0	0	0	110.4
372	F	27.8	Very low	35.6	Very low	209 Å²	209	151.5 Å²	151.5	92%	0.917	77%	0.769	S	S	*	*			trans	178.1	120.9	149.8	-107.3	-70.9	0	0	0	105.4
373	L	34.1	Very low	36.1	Very low	170 Å²	170	149.8 Å²	149.8	89%	0.89	76%	0.758	S	S	*	*			trans	-106.8	124.5	-171.8	-75.4	175.2	0	0	0	112.7
374	P	34.2	Very low	36.8	Very low	112 Å²	112	150.1 Å²	150.1	73%	0.727	75%	0.752	S	S	*	*			trans	-81.4	169.5	171.4	35.1	-35.2	0	0	0	111.8	A376	P374-A376 PolarHBondContact O-N 2.78Å
375	L	35.2	Very low	37.9	Very low	176 Å²	176	147.7 Å²	147.7	92%	0.921	74%	0.738	S	S	*	*			trans	-57.9	130.8	176.2	-68	98	0	0	0	111.6	Q377	L375-Q377 PolarHBondContact O-N 3.07Å
376	A	33.8	Very low	38.9	Very low	97 Å²	97	141.7 Å²	141.7	80%	0.802	72%	0.72	S	S	*	*			trans	-75.4	104.1	-177.8	0	0	0	0	0	111.7	P374 I378	P374-A376 PolarHBondContact O-N 2.78Å; A376-I378 PolarHBondContact O-N 2.95Å
377	Q	37.9	Very low	39.7	Very low	194 Å²	194	136.8 Å²	136.8	91%	0.907	71%	0.707	S	S	*	*			trans	-77.5	115.9	171.1	-161.8	173.4	13.1	0	0	109.5	L375 D379	L375-Q377 PolarHBondContact O-N 3.07Å; Q377-D379 PolarHBondContact O-N 3.13Å
378	I	46.6	Very low	40	Very low	140 Å²	140	137.4 Å²	137.4	72%	0.718	70%	0.7	S	S	*	*			trans	-75.4	111.6	-173.2	-58.5	175.3	0	0	0	110.5	A376 L380	A376-I378 PolarHBondContact O-N 2.95Å; I378-L380 PolarHBondContact O-N 2.78Å; I378-L380 VanDerWaalsContact O-N 3.07Å
379	D	48.8	Very low	40.5	Very low	102 Å²	102	132.9 Å²	132.9	55%	0.545	68%	0.681	S	S	.	*			trans	-76.2	94	169.7	-176.7	2.4	0	0	0	110.8	Q377 K381 K382	Q377-D379 PolarHBondContact O-N 3.13Å; D379-K381 PolarHBondContact O-N 2.67Å; D379-K381 VanDerWaalsContact O-N 3.09Å; D379-K381 WeakPolarHBondContact OD1-CB 3.4Å; D379-K381 PolarHBondContact OD1-N 2.78Å; D379-K382 PolarHBondContact O-N 3.28Å; D379-K382 VanDerWaalsContact O-N 3.09Å
380	L	40.7	Very low	41.4	Very low	120 Å²	120	128 Å²	128	63%	0.628	66%	0.664	S	S	*	*	H	α-helix	trans	-56.1	-24.2	-179.5	-164.2	67	0	0	0	113.7	I378 L384	I378-L380 PolarHBondContact O-N 2.78Å; I378-L380 VanDerWaalsContact O-N 3.07Å; L380-L384 WeakPolarHBondContact O-CG 3.44Å; L380-L384 PolarHBondContact O-N 2.87Å
381	K	52.1	Low	42	Very low	172 Å²	172	132.2 Å²	132.2	75%	0.748	67%	0.672	S	S	*	*	H	α-helix	trans	-71.9	-33.3	178.2	-72.4	-175.9	175.1	178.8	0	112.8	D379 A385	D379-K381 PolarHBondContact O-N 2.67Å; D379-K381 VanDerWaalsContact O-N 3.09Å; D379-K381 WeakPolarHBondContact OD1-CB 3.4Å; D379-K381 PolarHBondContact OD1-N 2.78Å; K381-A385 PolarHBondContact O-N 3.4Å
382	K	44	Very low	42.8	Very low	119 Å²	119	131.6 Å²	131.6	52%	0.517	66%	0.664	S	S	.	*	H	α-helix	trans	-72.3	-41.1	179.8	-167	170.9	179.6	-68	0	111.1	D379 L384 A385 E386	D379-K382 PolarHBondContact O-N 3.28Å; D379-K382 VanDerWaalsContact O-N 3.09Å; K382-L384 PolarHBondContact O-N 2.87Å; K382-A385 PolarHBondContact O-N 3.35Å; K382-E386 IonicContact NZ-OE1 3.59Å; K382-E386 PolarHBondContact NZ-OE1 3.35Å; K382-E386 IonicContact NZ-OE2 3.75Å; K382-E386 PolarHBondContact O-N 3.46Å
383	Y	44.9	Very low	43.5	Very low	171 Å²	171	128 Å²	128	67%	0.671	65%	0.65	S	S	*	*	H	α-helix	trans	-63.7	-39.2	177.7	-143.8	-96.8	0	0	0	112.7	E386 A387	Y383-E386 PolarHBondContact O-N 2.66Å; Y383-A387 WeakPolarHBondContact O-CB 3.38Å; Y383-A387 PolarHBondContact O-N 3.3Å
384	L	45.2	Very low	43.9	Very low	114 Å²	114	126 Å²	126	60%	0.597	64%	0.64	S	S	*	*	H	α-helix	trans	-66.1	-34.9	175.1	-74.6	169.4	0	0	0	112.9	L380 K382 Q388	L380-L384 WeakPolarHBondContact O-CG 3.44Å; L380-L384 PolarHBondContact O-N 2.87Å; K382-L384 PolarHBondContact O-N 2.87Å; L384-Q388 WeakPolarHBondContact O-CB 3.11Å; L384-Q388 PolarHBondContact O-N 2.94Å
385	A	49.4	Very low	44.4	Very low	56 Å²	56	125.9 Å²	125.9	46%	0.463	63%	0.632	S	S	.	*	H	α-helix	trans	-69.6	-45.5	174.9	0	0	0	0	0	111.8	K381 K382 A387 Q388 E389	K381-A385 PolarHBondContact O-N 3.4Å; K382-A385 PolarHBondContact O-N 3.35Å; A385-A387 PolarHBondContact O-N 2.89Å; A385-Q388 PolarHBondContact O-N 2.84Å; A385-Q388 VanDerWaalsContact O-N 3.11Å; A385-E389 PolarHBondContact O-N 3.16Å
386	E	50.3	Low	44.5	Very low	103 Å²	103	124.4 Å²	124.4	48%	0.481	62%	0.62	S	S	.	*	H	α-helix	trans	-64.6	-38.5	179.3	-73.8	167.1	169.6	0	0	111.9	K382 Y383 Q388 E389 G390	K382-E386 IonicContact NZ-OE1 3.59Å; K382-E386 PolarHBondContact NZ-OE1 3.35Å; K382-E386 IonicContact NZ-OE2 3.75Å; K382-E386 PolarHBondContact O-N 3.46Å; Y383-E386 PolarHBondContact O-N 2.66Å; E386-Q388 VanDerWaalsContact C-N 3.32Å; E386-Q388 PolarHBondContact O-N 2.91Å; E386-E389 PolarHBondContact O-N 2.69Å; E386-G390 PolarHBondContact O-N 3.41Å
387	A	49.1	Very low	44.8	Very low	63 Å²	63	126.9 Å²	126.9	52%	0.521	62%	0.615	S	S	.	*	H	α-helix	trans	-64.1	-33.7	171.7	0	0	0	0	0	113.3	Y383 A385 R391	Y383-A387 WeakPolarHBondContact O-CB 3.38Å; Y383-A387 PolarHBondContact O-N 3.3Å; A385-A387 PolarHBondContact O-N 2.89Å; A387-R391 PolarHBondContact O-N 3.01Å
388	Q	43.6	Very low	44.7	Very low	138 Å²	138	121.3 Å²	121.3	65%	0.645	60%	0.597	S	S	*	*	H	α-helix	trans	-77.3	-31.5	178.9	-162.3	168.3	15.9	0	0	112.4	L384 A385 E386 R392	L384-Q388 WeakPolarHBondContact O-CB 3.11Å; L384-Q388 PolarHBondContact O-N 2.94Å; A385-Q388 PolarHBondContact O-N 2.84Å; A385-Q388 VanDerWaalsContact O-N 3.11Å; E386-Q388 VanDerWaalsContact C-N 3.32Å; E386-Q388 PolarHBondContact O-N 2.91Å; Q388-R392 PolarHBondContact O-N 3.22Å
389	E	43	Very low	44.3	Very low	104 Å²	104	120.8 Å²	120.8	49%	0.486	60%	0.596	S	S	.	*	H	α-helix	trans	-72.8	-41.9	174.3	-156.9	62.2	-124.9	0	0	111.8	A385 E386 R391 R392 Q393	A385-E389 PolarHBondContact O-N 3.16Å; E386-E389 PolarHBondContact O-N 2.69Å; E389-R391 PolarHBondContact O-N 3.28Å; E389-R392 WeakPolarHBondContact O-CA 2.89Å; E389-R392 WeakPolarHBondContact O-CB 3.13Å; E389-R392 PolarHBondContact O-N 3.16Å; E389-Q393 PolarHBondContact O-N 3.33Å; E389-Q393 VanDerWaalsContact O-N 3.1Å
390	G	48.8	Very low	43.8	Very low	37 Å²	37	122 Å²	122	38%	0.381	60%	0.601	S	S	.	*	H	α-helix	trans	-57.5	-35.9	172.5	0	0	0	0	0	112.7	E386 R392 Q393 L394	E386-G390 PolarHBondContact O-N 3.41Å; G390-R392 VanDerWaalsContact C-N 3.28Å; G390-R392 PolarHBondContact O-N 3.14Å; G390-Q393 PolarHBondContact O-N 3.37Å; G390-L394 PolarHBondContact O-N 3.01Å
391	R	45.8	Very low	43.8	Very low	201 Å²	201	124.4 Å²	124.4	76%	0.758	61%	0.609	S	S	*	*	H	α-helix	trans	-69.8	-21.2	174.5	-154.3	176.7	-168.9	-159	2.3	113.6	A387 E389 I395	A387-R391 PolarHBondContact O-N 3.01Å; E389-R391 PolarHBondContact O-N 3.28Å; R391-I395 WeakPolarHBondContact O-CD1 3.32Å; R391-I395 WeakPolarHBondContact O-CG1 3.35Å
392	R	42.8	Very low	42.8	Very low	165 Å²	165	123.3 Å²	123.3	62%	0.623	61%	0.611	S	S	*	*	H	α-helix	trans	-81.4	-39.1	172.8	-72.5	179.8	165	-139.2	-7.8	112.3	Q388 E389 G390 L394 I395 H396	Q388-R392 PolarHBondContact O-N 3.22Å; E389-R392 WeakPolarHBondContact O-CA 2.89Å; E389-R392 WeakPolarHBondContact O-CB 3.13Å; E389-R392 PolarHBondContact O-N 3.16Å; G390-R392 VanDerWaalsContact C-N 3.28Å; G390-R392 PolarHBondContact O-N 3.14Å; R392-L394 PolarHBondContact O-N 2.74Å; R392-I395 PolarHBondContact O-N 3.34Å; R392-H396 PolarHBondContact O-N 2.88Å
393	Q	43.6	Very low	42.3	Very low	133 Å²	133	123.7 Å²	123.7	62%	0.621	62%	0.624	S	S	*	*	H	α-helix	trans	-65.3	-38	178.8	-66.1	-172.6	5.6	0	0	112.5	E389 G390 I395 H396 Q397	E389-Q393 PolarHBondContact O-N 3.33Å; E389-Q393 VanDerWaalsContact O-N 3.1Å; G390-Q393 PolarHBondContact O-N 3.37Å; Q393-I395 VanDerWaalsContact C-N 3.34Å; Q393-I395 PolarHBondContact O-N 2.9Å; Q393-H396 PolarHBondContact O-N 3.24Å; Q393-H396 VanDerWaalsContact O-N 3.16Å; Q393-Q397 PolarHBondContact O-N 2.81Å
394	L	43.2	Very low	41.7	Very low	130 Å²	130	120.4 Å²	120.4	68%	0.681	63%	0.626	S	S	*	*	H	α-helix	trans	-58.9	-43.6	175.6	-126.3	76.1	0	0	0	112.6	G390 R392 H396 Q397 S398	G390-L394 PolarHBondContact O-N 3.01Å; R392-L394 PolarHBondContact O-N 2.74Å; L394-H396 PolarHBondContact O-N 2.88Å; L394-Q397 PolarHBondContact O-N 2.89Å; L394-S398 PolarHBondContact O-N 3.44Å; L394-S398 PolarHBondContact O-OG 2.71Å
395	I	44.3	Very low	40.9	Very low	109 Å²	109	123.3 Å²	123.3	56%	0.559	64%	0.641	S	S	*	*	H	α-helix	trans	-64.3	-31.3	179.3	-65.8	169.7	0	0	0	111.2	R391 R392 Q393 S398	R391-I395 WeakPolarHBondContact O-CD1 3.32Å; R391-I395 WeakPolarHBondContact O-CG1 3.35Å; R392-I395 PolarHBondContact O-N 3.34Å; Q393-I395 VanDerWaalsContact C-N 3.34Å; Q393-I395 PolarHBondContact O-N 2.9Å; I395-S398 WeakPolarHBondContact CA-OG 3.41Å; I395-S398 PolarHBondContact O-OG 3.04Å
396	H	37.5	Very low	39.8	Very low	144 Å²	144	126.4 Å²	126.4	67%	0.667	66%	0.659	S	S	*	*	H	α-helix	trans	-78	-25.3	-177.7	-137.4	-47.9	0	0	0	113.8	R392 Q393 L394	R392-H396 PolarHBondContact O-N 2.88Å; Q393-H396 PolarHBondContact O-N 3.24Å; Q393-H396 VanDerWaalsContact O-N 3.16Å; L394-H396 PolarHBondContact O-N 2.88Å
397	Q	39.2	Very low	38.8	Very low	150 Å²	150	130.9 Å²	130.9	70%	0.701	68%	0.68	S	S	*	*	H	α-helix	trans	-81	-36.4	173.4	-71.8	-174.8	-16	0	0	112.3	Q393 L394 N399 I400	Q393-Q397 PolarHBondContact O-N 2.81Å; L394-Q397 PolarHBondContact O-N 2.89Å; Q397-N399 PolarHBondContact O-N 2.99Å; Q397-N399 VanDerWaalsContact O-N 3.12Å; Q397-I400 PolarHBondContact O-N 2.79Å
398	S	36.5	Very low	38	Very low	76 Å²	76	135.3 Å²	135.3	53%	0.531	70%	0.695	S	S	.	*	H	α-helix	trans	-63.2	-17	177.4	46.4	0	0	0	0	114.5	L394 I395	L394-S398 PolarHBondContact O-N 3.44Å; L394-S398 PolarHBondContact O-OG 2.71Å; I395-S398 WeakPolarHBondContact CA-OG 3.41Å; I395-S398 PolarHBondContact O-OG 3.04Å
399	N	38	Very low	38.3	Very low	130 Å²	130	133.5 Å²	133.5	70%	0.695	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	11	-174.1	-126.7	12.8	0	0	0	114.7	Q397	Q397-N399 PolarHBondContact O-N 2.99Å; Q397-N399 VanDerWaalsContact O-N 3.12Å
400	I	38.8	Very low	37.9	Very low	128 Å²	128	135.2 Å²	135.2	66%	0.656	71%	0.708	S	S	*	*	S	Bend	trans	-104.6	-13	178.7	-66.1	177.1	0	0	0	112.2	Q397	Q397-I400 PolarHBondContact O-N 2.79Å
401	H	38.8	Very low	37.2	Very low	169 Å²	169	139.1 Å²	139.1	78%	0.782	72%	0.72	S	S	*	*	S	Bend	trans	-105.7	-0.6	-170.4	-101.8	-60.9	0	0	0	117.1
402	N	32.4	Very low	36.4	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	72%	0.721	S	S	*	*	S	Bend	trans	-117.8	46.3	-177.6	-83.2	-17.4	0	0	0	113.3
403	T	32.4	Very low	35.8	Very low	126 Å²	126	137 Å²	137	77%	0.773	73%	0.727	S	S	*	*			trans	-142.6	55	179.2	11.4	0	0	0	0	113.4
404	S	32.3	Very low	35	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	73%	0.728	S	S	*	*			trans	-149.5	158.1	158.5	66.8	0	0	0	0	112
405	L	29.6	Very low	34.2	Very low	175 Å²	175	134.9 Å²	134.9	92%	0.916	73%	0.729	S	S	*	*			trans	63.9	81.1	170.8	-63.4	165.7	0	0	0	117.1
406	S	25.1	Very low	33.6	Very low	120 Å²	120	135.2 Å²	135.2	84%	0.839	73%	0.732	S	S	*	*			trans	-121	113	151.1	173.6	0	0	0	0	109
407	Q	29.2	Very low	33.3	Very low	198 Å²	198	135.9 Å²	135.9	93%	0.925	74%	0.735	S	S	*	*			trans	-147.5	140	159.9	-72.6	-161.4	-12.7	0	0	110.1
408	N	34	Very low	32.8	Very low	155 Å²	155	135.2 Å²	135.2	83%	0.829	74%	0.742	S	S	*	*			trans	-117.3	165.9	176.4	-122	-8.5	0	0	0	106.8
409	P	49.3	Very low	32.4	Very low	101 Å²	101	135.4 Å²	135.4	66%	0.656	76%	0.756	S	S	*	*				-162.6	173.3	63.8	44	-22.6	0	0	0	119.9
410	N	34	Very low	31.8	Very low	139 Å²	139	134.6 Å²	134.6	74%	0.743	77%	0.767	S	S	*	*			trans	63.9	154.4	146.7	-67.1	1.9	0	0	0	119.8
411	N	34.3	Very low	31.3	Very low	119 Å²	119	132.3 Å²	132.3	64%	0.636	78%	0.775	S	S	*	*			cis	-147.2	178.8	-3.1	-103.9	-14.6	0	0	0	107.5
412	L	28.7	Very low	30.5	Very low	151 Å²	151	132.8 Å²	132.8	79%	0.791	78%	0.778	S	S	*	*			cis	-162.4	-179	37.6	-141.3	130.9	0	0	0	112
413	F	30	Very low	30.1	Very low	170 Å²	170	131.3 Å²	131.3	75%	0.746	77%	0.77	S	S	*	*			trans	-88.7	-173.8	-172.9	-67.2	-103.5	0	0	0	113.8
414	T	28	Very low	29.7	Very low	105 Å²	105	133 Å²	133	64%	0.644	77%	0.769	S	S	*	*			cis	-170.6	148.5	27.1	-19.7	0	0	0	0	114.9
415	T	25.9	Very low	29.2	Very low	115 Å²	115	136.3 Å²	136.3	71%	0.706	77%	0.772	S	S	*	*			trans	54.5	157.2	144.3	48	0	0	0	0	124
416	N	31.3	Very low	28.8	Very low	116 Å²	116	138.6 Å²	138.6	62%	0.62	77%	0.769	S	S	*	*			cis	178.2	145.3	-38.4	-105.9	2	0	0	0	112.3
417	H	32.4	Very low	28.8	Very low	157 Å²	157	138.6 Å²	138.6	73%	0.727	77%	0.769	S	S	*	*			trans	61.4	160	147.2	-58.9	-30	0	0	0	119.5
418	T	28.5	Very low	28.5	Very low	136 Å²	136	136.4 Å²	136.4	83%	0.834	76%	0.763	S	S	*	*			cis	-163.6	159.1	-14.5	19.1	0	0	0	0	108.6
419	G	27.3	Very low	28.4	Very low	81 Å²	81	133.7 Å²	133.7	84%	0.835	75%	0.754	S	S	*	*			trans	164.5	134.3	160.7	0	0	0	0	0	114.8
420	A	26.6	Very low	27.5	Very low	113 Å²	113	136.7 Å²	136.7	93%	0.934	77%	0.765	S	S	*	*			trans	-129.3	162.2	172.2	0	0	0	0	0	109.7
421	G	26.6	Very low	27.1	Very low	79 Å²	79	133.6 Å²	133.6	81%	0.814	77%	0.766	S	S	*	*			trans	173.7	141.7	174.9	0	0	0	0	0	113
422	E	23.7	Very low	27.1	Very low	180 Å²	180	136.5 Å²	136.5	84%	0.841	78%	0.78	S	S	*	*			trans	-111.3	152.9	-177.4	-61.4	172.6	99.6	0	0	111.8
423	N	23.5	Very low	27.3	Very low	119 Å²	119	134.6 Å²	134.6	64%	0.636	78%	0.777	S	S	*	*			trans	60.1	135.5	141.8	-78.1	-36.3	0	0	0	123.7
424	H	23.4	Very low	26.9	Very low	162 Å²	162	134.1 Å²	134.1	75%	0.75	78%	0.781	S	S	*	*			trans	65	113.2	141.6	-58.6	-32.6	0	0	0	121.1
425	Q	21.6	Very low	27.5	Very low	171 Å²	171	133.8 Å²	133.8	80%	0.799	78%	0.781	S	S	*	*				150.2	113	90.8	-165.5	150.6	1.5	0	0	115.1
426	W	21.1	Very low	27.5	Very low	223 Å²	223	135.8 Å²	135.8	85%	0.845	78%	0.782	S	S	*	*			trans	24.2	129.2	145.2	-69.3	76.2	0	0	0	122.5
427	S	25.4	Very low	27.4	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	78%	0.782	S	S	*	*			trans	-151.5	151.5	143	-81.1	0	0	0	0	111.8
428	L	23.8	Very low	27.1	Very low	151 Å²	151	133.4 Å²	133.4	79%	0.791	77%	0.771	S	S	*	*			trans	-89.5	-179.6	-178.2	-76.5	104.9	0	0	0	111.5
429	P	31.8	Very low	27	Very low	99 Å²	99	130.5 Å²	130.5	64%	0.643	76%	0.756	S	S	*	*			cis	-135.3	-178.8	4.9	37.7	-17.5	0	0	0	117.3
430	N	30.5	Very low	27	Very low	164 Å²	164	132.8 Å²	132.8	88%	0.877	75%	0.748	S	S	*	*			trans	67.7	95.5	156.1	-62	-16.5	0	0	0	120.2
431	G	24.5	Very low	26.9	Very low	74 Å²	74	129.6 Å²	129.6	76%	0.763	73%	0.727	S	S	*	*			trans	162.1	129.1	157	0	0	0	0	0	115.6
432	L	34.9	Very low	26.7	Very low	179 Å²	179	134.3 Å²	134.3	94%	0.937	73%	0.725	S	S	*	*			trans	32.9	110.3	158.9	-61.8	171.1	0	0	0	119.4
433	P	32.2	Very low	26.8	Very low	112 Å²	112	131 Å²	131	73%	0.727	72%	0.717	S	S	*	*			trans	-112.4	132.3	-166.4	38.8	-31.8	0	0	0	119.2
434	L	23	Very low	26.8	Very low	159 Å²	159	129.4 Å²	129.4	83%	0.832	72%	0.72	S	S	*	*				61.6	163.9	129.3	-82.3	80.7	0	0	0	122.4
435	P	40	Very low	27	Very low	98 Å²	98	124.9 Å²	124.9	64%	0.636	72%	0.717	S	S	*	*			cis	-148.8	174.6	-35.2	41.7	-23.7	0	0	0	118.6
436	H	25.3	Very low	28.2	Very low	157 Å²	157	123.4 Å²	123.4	73%	0.727	72%	0.723	S	S	*	*			trans	80.3	125.1	136.2	-86.7	-48.3	0	0	0	127.1
437	N	29.2	Very low	28.7	Very low	119 Å²	119	117.2 Å²	117.2	64%	0.636	72%	0.719	S	S	*	*				60.8	159.2	128	-77.3	31.7	0	0	0	124.2
438	Q	27.2	Very low	28.9	Very low	105 Å²	105	120.6 Å²	120.6	49%	0.491	72%	0.721	S	S	.	*			cis	166.3	143.2	-17.9	-171.6	-177.2	47.5	0	0	108.4	A1004 S1005 G1006 E1007	Q438-A1004 CarbonylContact C-O 3.55Å; Q438-A1004 VanDerWaalsContact O-O 3.06Å; Q438-S1005 CarbonylContact C-O 3.51Å; Q438-S1005 VanDerWaalsContact CA-O 3.3Å; Q438-S1005 WeakPolarHBondContact CA-O 3.3Å; Q438-G1006 WeakPolarHBondContact CG-O 3.16Å; Q438-E1007 WeakPolarHBondContact CG-O 3.23Å; Q438-E1007 PolarHBondContact NE2-O 2.97Å
439	C	26.1	Very low	29.1	Very low	75 Å²	75	117.3 Å²	117.3	51%	0.507	71%	0.711	S	S	.	*			trans	70.7	100.6	167	-85.2	0	0	0	0	123.6	A1004 S1005 G1006	C439-A1004 VanDerWaalsContact C-C 3.46Å; C439-A1004 CarbonylContact C-O 3.56Å; C439-A1004 PolarHBondContact N-O 3.29Å; C439-A1004 CarbonylContact O-C 3.51Å; C439-S1005 VanDerWaalsContact CA-C 3.5Å; C439-S1005 PolarHBondContact N-O 3.11Å; C439-G1006 PolarHBondContact N-O 3.19Å
440	N	27.5	Very low	28.8	Very low	128 Å²	128	120.8 Å²	120.8	68%	0.684	72%	0.719	S	S	*	*			trans	56.7	166.8	151.1	-76.8	-23	0	0	0	122.1	A1004 S1005	N440-A1004 CarbonylContact O-C 3.52Å; N440-A1004 VanDerWaalsContact O-C 3.25Å; N440-A1004 WeakPolarHBondContact O-CA 3.35Å; N440-A1004 PolarHBondContact O-N 3.47Å; N440-S1005 VanDerWaalsContact N-CA 3.3Å; N440-S1005 VanDerWaalsContact N-N 3.11Å; N440-S1005 PolarHBondContact O-N 3.46Å
441	G	23.1	Very low	29.3	Very low	46 Å²	46	119.1 Å²	119.1	47%	0.474	71%	0.714	S	S	.	*			trans	112.9	109.2	146.9	0	0	0	0	0	120.4
442	F	23.9	Very low	29.3	Very low	178 Å²	178	123.8 Å²	123.8	78%	0.781	72%	0.721	S	S	*	*			trans	39.7	113.5	139.1	-83.4	-100	0	0	0	123.2
443	V	25.1	Very low	29.1	Very low	110 Å²	110	120.1 Å²	120.1	67%	0.667	71%	0.71	S	S	*	*				72.2	137.1	121.2	169.6	0	0	0	0	121.9
444	A	24.5	Very low	29	Very low	86 Å²	86	123.1 Å²	123.1	71%	0.711	71%	0.714	S	S	*	*			trans	79	143.1	162.1	0	0	0	0	0	119.4
445	G	26.5	Very low	29.1	Very low	67 Å²	67	121.6 Å²	121.6	69%	0.691	71%	0.711	S	S	*	*			trans	-99.4	-138.9	164	0	0	0	0	0	110.6
446	P	46.9	Very low	28.4	Very low	140 Å²	140	121.3 Å²	121.3	91%	0.909	72%	0.717	S	S	*	*			cis	-117.6	-150.1	15.3	42.4	-29.1	0	0	0	113
447	A	32	Very low	30.3	Very low	93 Å²	93	119.3 Å²	119.3	77%	0.769	72%	0.718	S	S	*	*			trans	-121	163.5	-166.6	0	0	0	0	0	114.2
448	E	29.7	Very low	31.4	Very low	192 Å²	192	119 Å²	119	90%	0.897	72%	0.722	S	S	*	*			trans	-167.1	154.4	150.8	-101.2	-179.4	-147.1	0	0	106.8
449	S	27.6	Very low	31.5	Very low	83 Å²	83	118.9 Å²	118.9	58%	0.58	74%	0.739	S	S	*	*			cis	-165.1	178.2	-3.7	46.2	0	0	0	0	111.8
450	H	25.2	Very low	31.6	Very low	172 Å²	172	118.9 Å²	118.9	80%	0.796	75%	0.753	S	S	*	*			trans	70.9	89.8	160.9	-64.8	-65.6	0	0	0	123.9
451	V	40.5	Very low	31.5	Very low	129 Å²	129	120.5 Å²	120.5	78%	0.782	76%	0.756	S	S	*	*				26.8	117.8	120.7	-172.3	0	0	0	0	120.8
452	L	25.3	Very low	31.7	Very low	172 Å²	172	124.4 Å²	124.4	90%	0.901	77%	0.765	S	S	*	*			trans	-156.5	-168.9	132.2	-139.7	74.2	0	0	0	112.6
453	S	29.5	Very low	31.9	Very low	102 Å²	102	122.8 Å²	122.8	71%	0.713	76%	0.76	S	S	*	*			trans	-146.5	-176.9	-135.4	-174.2	0	0	0	0	114.7
454	Q	30.7	Very low	32	Very low	175 Å²	175	126 Å²	126	82%	0.818	77%	0.767	S	S	*	*			trans	80.4	158.5	174	-43.4	-175.3	13.9	0	0	115.2
455	V	24.5	Very low	32	Very low	127 Å²	127	125 Å²	125	77%	0.77	77%	0.766	S	S	*	*			cis	-147.2	137.7	26.9	174.2	0	0	0	0	114.9
456	A	27.2	Very low	31.8	Very low	91 Å²	91	129.1 Å²	129.1	75%	0.752	78%	0.778	S	S	*	*			trans	22.6	167.1	145.1	0	0	0	0	0	128.2
457	P	64.5	Low	30.9	Very low	115 Å²	115	131.2 Å²	131.2	75%	0.747	78%	0.775	S	S	*	*			trans	-135.2	-152.7	-172.5	48.3	-29.7	0	0	0	115.3
458	P	51.5	Low	31.9	Very low	112 Å²	112	131.5 Å²	131.5	73%	0.727	77%	0.769	S	S	*	*			trans	-116.6	174	143.1	40.2	-30.6	0	0	0	111.9
459	A	30.5	Very low	31.7	Very low	103 Å²	103	130.1 Å²	130.1	85%	0.851	77%	0.766	S	S	*	*			cis	79.9	142.5	21.5	0	0	0	0	0	116.2
460	G	28	Very low	31.7	Very low	76 Å²	76	130.7 Å²	130.7	78%	0.784	78%	0.776	S	S	*	*			cis	157.6	164.2	-5.4	0	0	0	0	0	109.8
461	E	24.9	Very low	31.8	Very low	161 Å²	161	127.9 Å²	127.9	75%	0.752	78%	0.775	S	S	*	*			cis	-171.3	176.2	-12.7	-141	-58.7	83.7	0	0	108.6
462	L	27.9	Very low	32.1	Very low	129 Å²	129	127.2 Å²	127.2	68%	0.675	77%	0.774	S	S	*	*			trans	78.5	154.2	165.5	-57.8	169.7	0	0	0	119
463	Q	27.4	Very low	32.3	Very low	143 Å²	143	123 Å²	123	67%	0.668	76%	0.764	S	S	*	*			cis	-164.6	166.4	-37.7	-125.7	-169.6	72.5	0	0	112.1
464	H	27.3	Very low	32.4	Very low	178 Å²	178	127.6 Å²	127.6	82%	0.824	77%	0.771	S	S	*	*			trans	73.6	142.7	165.4	-62.7	-17.5	0	0	0	122.7
465	G	23.7	Very low	33.2	Very low	66 Å²	66	125 Å²	125	68%	0.68	77%	0.769	S	S	*	*			trans	134.7	72	140.5	0	0	0	0	0	123.9
466	T	22.9	Very low	33.5	Very low	153 Å²	153	123.2 Å²	123.2	94%	0.939	77%	0.767	S	S	*	*			trans	65.3	159.9	152.4	37.2	0	0	0	0	123.2
467	H	27.7	Very low	33.4	Very low	184 Å²	184	128.3 Å²	128.3	85%	0.852	77%	0.773	S	S	*	*			trans	-89.7	178.6	-177.3	-96.8	-92	0	0	0	113.5
468	P	53.2	Low	31.5	Very low	99 Å²	99	128.4 Å²	128.4	64%	0.643	77%	0.772	S	S	*	*			cis	-134.6	-169.7	-4.3	28.8	-4.4	0	0	0	115.1
469	I	25.9	Very low	30.2	Very low	163 Å²	163	128 Å²	128	84%	0.836	77%	0.772	S	S	*	*			trans	67	109.4	166.9	-40.4	180	0	0	0	114.2
470	A	27.2	Very low	30	Very low	94 Å²	94	130.5 Å²	130.5	78%	0.777	77%	0.771	S	S	*	*			cis	-137.2	174	34.8	0	0	0	0	0	113.8
471	S	27.3	Very low	29.8	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	77%	0.766	S	S	*	*			trans	-138.6	178.5	-177.3	-53.3	0	0	0	0	110.6
472	P	46.3	Very low	29.9	Very low	115 Å²	115	132.3 Å²	132.3	75%	0.747	77%	0.771	S	S	*	*				-113.9	-178.7	-77.4	32.6	-15.2	0	0	0	110.5
473	A	30.9	Very low	29.8	Very low	84 Å²	84	129.9 Å²	129.9	69%	0.694	78%	0.778	S	S	*	*			cis	59.2	153.3	45.3	0	0	0	0	0	112.6
474	K	30.4	Very low	29.8	Very low	199 Å²	199	132.1 Å²	132.1	87%	0.865	79%	0.785	S	S	*	*			cis	-156.6	-175.8	14	-123	179.3	179.9	-178.6	0	109.4
475	P	48.3	Very low	29.8	Very low	121 Å²	121	134.1 Å²	134.1	79%	0.786	79%	0.786	S	S	*	*			trans	-101	-163.6	-173.4	42.7	-38	0	0	0	113.9
476	A	31.4	Very low	29.9	Very low	88 Å²	88	136.2 Å²	136.2	73%	0.727	79%	0.785	S	S	*	*			trans	-75.9	157.1	-179.5	0	0	0	0	0	115.5
477	F	24.9	Very low	30.3	Very low	198 Å²	198	136.5 Å²	136.5	87%	0.868	78%	0.78	S	S	*	*			trans	-164.3	156.4	141.3	-112.7	-69.2	0	0	0	112.7
478	T	24.5	Very low	30.4	Very low	117 Å²	117	131.8 Å²	131.8	72%	0.718	77%	0.768	S	S	*	*			trans	63.7	126.2	157.6	50.2	0	0	0	0	123.2
479	S	23.6	Very low	29.6	Very low	105 Å²	105	135 Å²	135	73%	0.734	78%	0.78	S	S	*	*			trans	71.2	115.5	133.5	67.6	0	0	0	0	123.8
480	N	26.3	Very low	29.9	Very low	154 Å²	154	130 Å²	130	82%	0.824	77%	0.769	S	S	*	*			trans	67.3	135.6	131	-96.5	5.2	0	0	0	124.2
481	V	24.7	Very low	30.1	Very low	113 Å²	113	135.8 Å²	135.8	69%	0.685	78%	0.776	S	S	*	*			trans	79	119	144	174.6	0	0	0	0	119.9
482	N	27.1	Very low	30.3	Very low	162 Å²	162	135.8 Å²	135.8	87%	0.866	78%	0.776	S	S	*	*			trans	49.9	130	152.5	-61.5	-4.3	0	0	0	122.1
483	G	25.1	Very low	29.5	Very low	78 Å²	78	134 Å²	134	80%	0.804	78%	0.779	S	S	*	*			trans	169.2	135.9	159.1	0	0	0	0	0	114
484	F	27.2	Very low	30.5	Very low	190 Å²	190	135.9 Å²	135.9	83%	0.833	78%	0.784	S	S	*	*			trans	-123.1	146.1	179.7	-98.1	-85.4	0	0	0	111.5
485	R	26.8	Very low	31	Very low	220 Å²	220	131.8 Å²	131.8	83%	0.83	78%	0.778	S	S	*	*			trans	67.2	161.4	152.8	-70.2	171.7	-176	-102.5	2.4	118.4
486	V	26.7	Very low	30	Very low	111 Å²	111	132.7 Å²	132.7	67%	0.673	78%	0.776	S	S	*	*			cis	-169.9	150.8	-36.3	84.6	0	0	0	0	110.3
487	L	30.9	Very low	30	Very low	159 Å²	159	133.3 Å²	133.3	83%	0.832	78%	0.775	S	S	*	*			trans	63.7	160.5	164.2	-67.9	173.6	0	0	0	118.3
488	S	30.1	Very low	30.7	Very low	85 Å²	85	129.3 Å²	129.3	59%	0.594	77%	0.769	S	S	*	*			cis	-171.6	153.1	-12.7	46.9	0	0	0	0	114.1
489	N	36	Very low	31.6	Very low	167 Å²	167	129.1 Å²	129.1	89%	0.893	77%	0.77	S	S	*	*			trans	63.4	155.4	153.6	-60.6	-2	0	0	0	120.4
490	G	32.9	Very low	32.5	Very low	58 Å²	58	130 Å²	130	60%	0.598	77%	0.772	S	S	*	*			cis	176	-171.1	-3.4	0	0	0	0	0	114.2
491	F	30.9	Very low	32.8	Very low	215 Å²	215	127.7 Å²	127.7	94%	0.943	77%	0.769	S	S	*	*			trans	74.1	149.4	176.3	-59.1	-87.8	0	0	0	118.2
492	S	31.6	Very low	33.3	Very low	113 Å²	113	130 Å²	130	79%	0.79	77%	0.772	S	S	*	*			cis	-174.9	146.8	-18.4	52.8	0	0	0	0	113.4
493	G	28.2	Very low	33.3	Very low	77 Å²	77	129.4 Å²	129.4	79%	0.794	76%	0.764	S	S	*	*			trans	139.4	127.4	161.5	0	0	0	0	0	117.9
494	P	52.5	Low	33.4	Very low	124 Å²	124	132.1 Å²	132.1	81%	0.805	76%	0.76	S	S	*	*			trans	-120.2	176.2	-175.1	47.7	-37.2	0	0	0	114.1
495	P	41	Very low	33.4	Very low	113 Å²	113	132.8 Å²	132.8	73%	0.734	76%	0.758	S	S	*	*				-139	148	69.4	36.2	-17.9	0	0	0	117.9
496	D	27.3	Very low	33.3	Very low	139 Å²	139	131.5 Å²	131.5	74%	0.743	76%	0.755	S	S	*	*			trans	42.2	120.2	147.9	-51.2	-40.5	0	0	0	122.9
497	S	31	Very low	33.3	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	75%	0.753	S	S	*	*			cis	91.5	157.1	22.7	97.7	0	0	0	0	115.2
498	P	39.2	Very low	32.9	Very low	114 Å²	114	133.7 Å²	133.7	74%	0.74	76%	0.756	S	S	*	*			cis	-136.4	-141	18.8	42	-17.8	0	0	0	115.1
499	P	45	Very low	32.9	Very low	114 Å²	114	136.4 Å²	136.4	74%	0.74	76%	0.759	S	S	*	*				-127.2	-147.3	-120.8	43.2	-19.1	0	0	0	111.2
500	P	41.3	Very low	32.6	Very low	122 Å²	122	134.7 Å²	134.7	79%	0.792	76%	0.755	S	S	*	*			cis	-130.7	-165.1	-15	42.7	-25.4	0	0	0	113.8
501	S	32.9	Very low	32.4	Very low	107 Å²	107	137.5 Å²	137.5	75%	0.748	77%	0.766	S	S	*	*			trans	-144.8	145.2	159.4	67.3	0	0	0	0	112.5
502	Q	34.6	Very low	32.7	Very low	161 Å²	161	131 Å²	131	75%	0.752	76%	0.759	S	S	*	*			trans	65.5	139.1	159.4	-65.9	-157.6	23.4	0	0	123.6
503	Q	27.7	Very low	32.6	Very low	150 Å²	150	130.8 Å²	130.8	70%	0.701	76%	0.758	S	S	*	*			trans	73	109.8	146	-70.5	-179.8	46.3	0	0	123.1
504	N	27.9	Very low	32.8	Very low	134 Å²	134	133.3 Å²	133.3	72%	0.717	76%	0.757	S	S	*	*				38.4	122.9	126.3	-45.8	-17.5	0	0	0	121.2
505	Y	26.9	Very low	31.7	Very low	204 Å²	204	134.2 Å²	134.2	80%	0.8	76%	0.761	S	S	*	*				-175.8	154.3	104.6	-111.9	-121.4	0	0	0	112.4
506	Y	24.9	Very low	31.1	Very low	193 Å²	193	134 Å²	134	76%	0.757	76%	0.757	S	S	*	*			trans	-43.6	171.5	172.4	-47.3	-98.7	0	0	0	116.5
507	K	26.6	Very low	30.9	Very low	147 Å²	147	134.8 Å²	134.8	64%	0.639	76%	0.76	S	S	*	*			cis	-172.4	145.1	-12.1	148.7	-179.1	177.4	174.2	0	107.5	E509	K507-E509 WeakPolarHBondContact CE-OE1 3.39Å; K507-E509 IonicContact NZ-OE1 2.63Å; K507-E509 PolarHBondContact NZ-OE1 3.37Å
508	L	22.8	Very low	30.7	Very low	170 Å²	170	134.2 Å²	134.2	89%	0.89	76%	0.756	S	S	*	*			trans	-156.7	160.6	143	-144.8	68.9	0	0	0	112.5
509	E	28.9	Very low	30.3	Very low	141 Å²	141	135.1 Å²	135.1	66%	0.659	76%	0.76	S	S	*	*			trans	-117.6	147.2	-176.3	-63.4	159.7	-165.9	0	0	110.5	K507	K507-E509 WeakPolarHBondContact CE-OE1 3.39Å; K507-E509 IonicContact NZ-OE1 2.63Å; K507-E509 PolarHBondContact NZ-OE1 3.37Å
510	T	31.1	Very low	29.3	Very low	132 Å²	132	134.5 Å²	134.5	81%	0.81	77%	0.765	S	S	*	*			trans	-149.3	125.4	153.8	42.4	0	0	0	0	110.8
511	S	28.3	Very low	28.6	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	76%	0.763	S	S	*	*			trans	27	137	152.4	57.3	0	0	0	0	121.8
512	G	36.9	Very low	28.2	Very low	77 Å²	77	137 Å²	137	79%	0.794	77%	0.767	S	S	*	*			trans	-66.8	-172.1	164.3	0	0	0	0	0	114.4
513	S	29.7	Very low	27.7	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	77%	0.766	S	S	*	*			cis	-150.5	132.4	18.3	56.3	0	0	0	0	114
514	V	32.5	Very low	27.7	Very low	130 Å²	130	129.5 Å²	129.5	79%	0.788	77%	0.766	S	S	*	*			trans	51.5	111.3	162	-172.3	0	0	0	0	117.9	V516	V514-V516 HydrophobicContact CG1-CG2 4.4Å
515	T	28.7	Very low	27.6	Very low	143 Å²	143	132.1 Å²	132.1	88%	0.877	77%	0.773	S	S	*	*			trans	-151.1	152.2	151.5	-59.8	0	0	0	0	109.1
516	V	28.1	Very low	28.5	Very low	107 Å²	107	127.6 Å²	127.6	65%	0.648	77%	0.769	S	S	*	*			trans	-149.3	174.9	-163.3	-167.2	0	0	0	0	110.2	V514	V514-V516 HydrophobicContact CG1-CG2 4.4Å
517	L	23.6	Very low	28.5	Very low	156 Å²	156	125.5 Å²	125.5	82%	0.817	78%	0.776	S	S	*	*			trans	88.8	148.3	161.6	-51.7	169.5	0	0	0	116.8
518	S	28.3	Very low	28.3	Very low	89 Å²	89	125.1 Å²	125.1	62%	0.622	78%	0.776	S	S	*	*			cis	-166.3	153.5	-11.8	-116.2	0	0	0	0	116.8
519	T	29	Very low	28.5	Very low	133 Å²	133	122.5 Å²	122.5	82%	0.816	77%	0.772	S	S	*	*			trans	27	144.4	141.5	62.6	0	0	0	0	125.8
520	A	23.9	Very low	28.4	Very low	102 Å²	102	121.7 Å²	121.7	84%	0.843	78%	0.777	S	S	*	*			trans	-151.3	165	142.4	0	0	0	0	0	111.5
521	T	26.9	Very low	28.3	Very low	123 Å²	123	121.3 Å²	121.3	76%	0.755	78%	0.777	S	S	*	*			trans	-140.7	165.7	-170.7	49.6	0	0	0	0	114.9
522	D	25.1	Very low	28.4	Very low	158 Å²	158	121.9 Å²	121.9	85%	0.845	78%	0.776	S	S	*	*				134.7	147.8	129.9	-89.5	-66.3	0	0	0	121.1
523	G	25.1	Very low	28.5	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	78%	0.781	S	S	*	*			trans	86.1	116.6	170.5	0	0	0	0	0	116.6
524	A	25.7	Very low	28.8	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	78%	0.78	S	S	*	*			cis	84	130.4	29	0	0	0	0	0	115.4
525	H	27.7	Very low	28.9	Very low	188 Å²	188	127.9 Å²	127.9	87%	0.87	77%	0.773	S	S	*	*			cis	-160.8	175.7	-7.5	-105.1	-29.3	0	0	0	112.3
526	P	45	Very low	29.4	Very low	110 Å²	110	126.6 Å²	126.6	71%	0.714	76%	0.764	S	S	*	*			trans	-125.3	177.1	-155	45.4	-34.9	0	0	0	117.6
527	V	25.7	Very low	29.9	Very low	149 Å²	149	127 Å²	127	90%	0.903	76%	0.763	S	S	*	*			trans	-154.4	149.9	160.4	-175.3	0	0	0	0	108.8
528	E	21.9	Very low	30.6	Very low	139 Å²	139	123.3 Å²	123.3	65%	0.65	75%	0.75	S	S	*	*			cis	-159.7	152.1	-49	-163.1	-100.3	105	0	0	108.1	T530	E528-T530 PolarHBondContact OE1-N 3.25Å
529	S	26.1	Very low	31.1	Very low	115 Å²	115	127.5 Å²	127.5	80%	0.804	76%	0.757	S	S	*	*			trans	-165.8	138.5	161.5	-79.9	0	0	0	0	110.8
530	T	26.6	Very low	31.9	Very low	124 Å²	124	127.2 Å²	127.2	76%	0.761	75%	0.75	S	S	*	*			trans	-88.6	140	-165	33.3	0	0	0	0	115.3	E528	E528-T530 PolarHBondContact OE1-N 3.25Å
531	P	30.3	Very low	32.8	Very low	123 Å²	123	128.7 Å²	128.7	80%	0.799	74%	0.74	S	S	*	*			trans	-97.8	144.7	-178.1	36.3	-34.6	0	0	0	114.7
532	T	30.2	Very low	33.8	Very low	130 Å²	130	126.5 Å²	126.5	80%	0.798	73%	0.73	S	S	*	*			trans	-102.9	108.4	-176.9	-51.5	0	0	0	0	113.7	N534	T532-N534 PolarHBondContact O-N 3.13Å
533	R	37.9	Very low	34.5	Very low	240 Å²	240	122.7 Å²	122.7	91%	0.906	71%	0.713	S	S	*	*	S	Bend	trans	53.4	47.2	148	-150.8	-168.4	179.3	175.3	0.8	120
534	N	37.2	Very low	35.5	Very low	142 Å²	142	123.8 Å²	123.8	76%	0.759	70%	0.701	S	S	*	*			trans	-103	7.3	166.2	-84.2	-12.2	0	0	0	115.3	T532 V536	T532-N534 PolarHBondContact O-N 3.13Å; N534-V536 PolarHBondContact O-N 3.45Å; N534-V536 VanDerWaalsContact O-N 3.12Å
535	G	33.2	Very low	36.6	Very low	61 Å²	61	123.2 Å²	123.2	63%	0.629	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-5	-163.8	0	0	0	0	0	119.3
536	V	40.3	Very low	37.4	Very low	115 Å²	115	122.6 Å²	122.6	70%	0.697	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-18.7	-175.9	-79.6	0	0	0	0	115.2	N534	N534-V536 PolarHBondContact O-N 3.45Å; N534-V536 VanDerWaalsContact O-N 3.12Å
537	N	38.3	Very low	37.6	Very low	117 Å²	117	119.8 Å²	119.8	63%	0.626	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-45.2	179.5	-67.3	-0.3	0	0	0	111.3	F539 L540 E541	N537-F539 PolarHBondContact O-N 3.2Å; N537-F539 VanDerWaalsContact O-N 3.17Å; N537-L540 PolarHBondContact O-N 3.16Å; N537-E541 PolarHBondContact O-N 3.01Å
538	S	39.1	Very low	38.9	Very low	78 Å²	78	118.4 Å²	118.4	55%	0.545	65%	0.653	S	S	.	*	H	α-helix	trans	-57.6	-32.2	-178.8	177	0	0	0	0	113.6	L540 E541 S542	S538-L540 PolarHBondContact O-N 3.22Å; S538-E541 PolarHBondContact O-N 2.76Å; S538-S542 PolarHBondContact O-N 2.87Å
539	F	38.7	Very low	40.7	Very low	176 Å²	176	116.7 Å²	116.7	77%	0.772	65%	0.652	S	S	*	*	H	α-helix	trans	-71	-14.9	179.7	-127.8	-85.3	0	0	0	114.1	N537	N537-F539 PolarHBondContact O-N 3.2Å; N537-F539 VanDerWaalsContact O-N 3.17Å
540	L	44.8	Very low	41.5	Very low	128 Å²	128	115.4 Å²	115.4	67%	0.67	64%	0.641	S	S	*	*	H	α-helix	trans	-101.5	-20.8	176.9	-65.1	177.6	0	0	0	113.3	N537 S538	N537-L540 PolarHBondContact O-N 3.16Å; S538-L540 PolarHBondContact O-N 3.22Å
541	E	43.9	Very low	42.5	Very low	132 Å²	132	113.2 Å²	113.2	62%	0.617	62%	0.624	S	S	*	*	H	α-helix	trans	-74.5	-38.6	175.2	-68.6	178	118.4	0	0	112.2	N537 S538 M544 S545	N537-E541 PolarHBondContact O-N 3.01Å; S538-E541 PolarHBondContact O-N 2.76Å; E541-M544 PolarHBondContact O-N 2.73Å; E541-S545 PolarHBondContact O-N 3.27Å
542	S	46.2	Very low	43.6	Very low	78 Å²	78	110.7 Å²	110.7	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-54.2	-49.1	-175.5	-178.6	0	0	0	0	113.6	S538 M544 S545 F546	S538-S542 PolarHBondContact O-N 2.87Å; S542-M544 PolarHBondContact O-N 2.84Å; S542-S545 PolarHBondContact O-N 3.48Å; S542-S545 PolarHBondContact O-OG 2.96Å; S542-F546 WeakPolarHBondContact O-CD2 3.26Å
543	P	41.1	Very low	44.5	Very low	77 Å²	77	110.2 Å²	110.2	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-68.8	-30.4	176.4	-17.8	32.6	0	0	0	113.7	S545 F546	P543-S545 VanDerWaalsContact C-N 3.29Å; P543-S545 PolarHBondContact O-N 2.84Å; P543-F546 PolarHBondContact O-N 2.92Å
544	M	45.1	Very low	44.9	Very low	93 Å²	93	105.9 Å²	105.9	46%	0.458	59%	0.587	S	S	.	*	H	α-helix	trans	-72.3	-21.5	-178.5	-71.1	-130.9	-69.6	0	0	112.8	E541 S542 F546 L547 K552	E541-M544 PolarHBondContact O-N 2.73Å; S542-M544 PolarHBondContact O-N 2.84Å; M544-F546 PolarHBondContact O-N 2.86Å; M544-L547 PolarHBondContact O-N 3.45Å; M544-K552 WeakPolarHBondContact O-CE 3.48Å; M544-K552 PolarHBondContact O-NZ 3.37Å
545	S	48.8	Very low	45.2	Very low	73 Å²	73	104.4 Å²	104.4	51%	0.51	58%	0.579	S	S	.	*	H	α-helix	trans	-54.8	-42	173.3	67.5	0	0	0	0	112.1	E541 S542 P543 L547 K552	E541-S545 PolarHBondContact O-N 3.27Å; S542-S545 PolarHBondContact O-N 3.48Å; S542-S545 PolarHBondContact O-OG 2.96Å; P543-S545 VanDerWaalsContact C-N 3.29Å; P543-S545 PolarHBondContact O-N 2.84Å; S545-L547 PolarHBondContact O-N 2.99Å; S545-K552 PolarHBondContact O-NZ 3.34Å
546	F	44.6	Very low	45.2	Very low	174 Å²	174	105 Å²	105	76%	0.763	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	4.4	-175.3	-59.1	-77.6	0	0	0	116.2	S542 P543 M544	S542-F546 WeakPolarHBondContact O-CD2 3.26Å; P543-F546 PolarHBondContact O-N 2.92Å; M544-F546 PolarHBondContact O-N 2.86Å
547	L	48.9	Very low	44.8	Very low	52 Å²	52	105.5 Å²	105.5	27%	0.272	58%	0.577	S	S	.	*	S	Bend	trans	-98.4	129.1	179.4	-62.4	180	0	0	0	111.7	M544 S545 I551 K552 L555	M544-L547 PolarHBondContact O-N 3.45Å; S545-L547 PolarHBondContact O-N 2.99Å; L547-I551 HydrophobicContact CD1-CG2 4.49Å; L547-I551 HydrophobicContact CD2-CG2 4.39Å; L547-K552 HydrophobicContact CB-CG 4.11Å; L547-K552 WeakPolarHBondContact O-CD 3.43Å; L547-K552 WeakPolarHBondContact O-CE 3.44Å; L547-K552 PolarHBondContact O-NZ 2.75Å; L547-L555 HydrophobicContact CD1-CD1 3.6Å
548	D	53.1	Low	44.6	Very low	120 Å²	120	106.1 Å²	106.1	64%	0.642	59%	0.587	S	S	*	*			trans	-62.1	153.8	175.9	-75.1	-47.4	0	0	0	112.7	P550 I551 K552	D548-P550 VanDerWaalsContact C-N 3.34Å; D548-I551 PolarHBondContact O-N 2.81Å; D548-K552 PolarHBondContact O-N 2.77Å; D548-K552 VanDerWaalsContact O-N 3.16Å
549	T	60.3	Low	44.3	Very low	102 Å²	102	107.9 Å²	107.9	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-49.3	-41.2	-175	-16.2	0	0	0	0	114.5	I551 N553	T549-I551 VanDerWaalsContact C-N 3.33Å; T549-I551 PolarHBondContact O-N 2.87Å; T549-N553 PolarHBondContact O-N 3.19Å; T549-N553 PolarHBondContact O-ND2 2.97Å
550	P	43.2	Very low	44.2	Very low	88 Å²	88	108.7 Å²	108.7	57%	0.571	60%	0.603	S	S	*	*	H	α-helix	trans	-64.5	-33.4	176.3	-22.8	35.3	0	0	0	113.8	D548 N553	D548-P550 VanDerWaalsContact C-N 3.34Å; P550-N553 PolarHBondContact O-N 2.71Å
551	I	48	Very low	43.8	Very low	78 Å²	78	111.9 Å²	111.9	40%	0.4	61%	0.611	S	S	.	*	H	α-helix	trans	-79.6	-37.5	-175.5	-56.3	177.5	0	0	0	110.6	L547 D548 T549 N553 L554 L555	L547-I551 HydrophobicContact CD1-CG2 4.49Å; L547-I551 HydrophobicContact CD2-CG2 4.39Å; D548-I551 PolarHBondContact O-N 2.81Å; T549-I551 VanDerWaalsContact C-N 3.33Å; T549-I551 PolarHBondContact O-N 2.87Å; I551-N553 PolarHBondContact O-N 3.22Å; I551-L554 PolarHBondContact O-N 3.01Å; I551-L555 HydrophobicContact CG2-CD1 4.28Å; I551-L555 PolarHBondContact O-N 2.99Å
552	K	52	Low	43.7	Very low	70 Å²	70	113.3 Å²	113.3	30%	0.304	62%	0.622	S	S	.	*	H	α-helix	trans	-53.2	-38.6	169.4	-76.8	169.6	164.1	135.6	0	112.5	M544 S545 L547 D548 L554 S556	M544-K552 WeakPolarHBondContact O-CE 3.48Å; M544-K552 PolarHBondContact O-NZ 3.37Å; S545-K552 PolarHBondContact O-NZ 3.34Å; L547-K552 HydrophobicContact CB-CG 4.11Å; L547-K552 WeakPolarHBondContact O-CD 3.43Å; L547-K552 WeakPolarHBondContact O-CE 3.44Å; L547-K552 PolarHBondContact O-NZ 2.75Å; D548-K552 PolarHBondContact O-N 2.77Å; D548-K552 VanDerWaalsContact O-N 3.16Å; K552-L554 VanDerWaalsContact C-N 3.35Å; K552-L554 PolarHBondContact O-N 3.06Å; K552-S556 WeakPolarHBondContact O-CB 3.45Å; K552-S556 PolarHBondContact O-N 3.43Å; K552-S556 PolarHBondContact O-OG 3.5Å
553	N	49.4	Very low	43.4	Very low	121 Å²	121	112.6 Å²	112.6	65%	0.647	62%	0.621	S	S	*	*	H	α-helix	trans	-73.9	-20.1	178.5	-68.1	-22.8	0	0	0	113.9	T549 P550 I551	T549-N553 PolarHBondContact O-N 3.19Å; T549-N553 PolarHBondContact O-ND2 2.97Å; P550-N553 PolarHBondContact O-N 2.71Å; I551-N553 PolarHBondContact O-N 3.22Å
554	L	47.3	Very low	43.9	Very low	149 Å²	149	116.3 Å²	116.3	78%	0.78	64%	0.637	S	S	*	*	H	α-helix	trans	-88.9	-33.4	177.9	-75.8	166.5	0	0	0	113.1	I551 K552	I551-L554 PolarHBondContact O-N 3.01Å; K552-L554 VanDerWaalsContact C-N 3.35Å; K552-L554 PolarHBondContact O-N 3.06Å
555	L	44	Very low	44.7	Very low	111 Å²	111	114.1 Å²	114.1	58%	0.581	63%	0.626	S	S	*	*	H	α-helix	trans	-79.3	-20.2	176.1	-67.6	170.7	0	0	0	113.1	L547 I551 T557	L547-L555 HydrophobicContact CD1-CD1 3.6Å; I551-L555 HydrophobicContact CG2-CD1 4.28Å; I551-L555 PolarHBondContact O-N 2.99Å; L555-T557 PolarHBondContact O-N 3Å
556	S	32.7	Very low	45.5	Very low	74 Å²	74	113.8 Å²	113.8	52%	0.517	62%	0.623	S	S	.	*	S	Bend	trans	-70.7	81.8	172.8	-64.8	0	0	0	0	111.5	K552 P558	K552-S556 WeakPolarHBondContact O-CB 3.45Å; K552-S556 PolarHBondContact O-N 3.43Å; K552-S556 PolarHBondContact O-OG 3.5Å; S556-P558 WeakPolarHBondContact O-CD 3.44Å
557	T	31.3	Very low	46.7	Very low	124 Å²	124	111.3 Å²	111.3	76%	0.761	63%	0.627	S	S	*	*			trans	-56	123.3	175.8	54.2	0	0	0	0	110.4	L555 S559	L555-T557 PolarHBondContact O-N 3Å; T557-S559 PolarHBondContact O-N 2.86Å
558	P	33	Very low	48.4	Very low	131 Å²	131	109.9 Å²	109.9	85%	0.851	62%	0.621	S	S	*	*			trans	-73.6	91.1	-166.5	27.3	-35.4	0	0	0	112	S556 K560	S556-P558 WeakPolarHBondContact O-CD 3.44Å; P558-K560 PolarHBondContact O-N 2.95Å
559	S	33.9	Very low	50.1	Low	114 Å²	114	113.1 Å²	113.1	80%	0.797	63%	0.632	S	S	*	*			trans	-65	94.7	171.2	-170.7	0	0	0	0	110.1	T557 K561	T557-S559 PolarHBondContact O-N 2.86Å; S559-K561 PolarHBondContact O-N 2.89Å
560	K	36.9	Very low	51.5	Low	194 Å²	194	109.2 Å²	109.2	84%	0.843	61%	0.609	S	S	*	*	S	Bend	trans	27.9	81.1	168	-67.8	176.7	-179.1	166	0	115.4	P558 L562	P558-K560 PolarHBondContact O-N 2.95Å; K560-L562 PolarHBondContact O-N 3.23Å
561	K	36.2	Very low	53.7	Low	195 Å²	195	107.3 Å²	107.3	85%	0.848	60%	0.595	S	S	*	*			trans	21.2	93.5	163.3	-69.4	-165.3	174	-163.4	0	114.6	S559 A563	S559-K561 PolarHBondContact O-N 2.89Å; K561-A563 PolarHBondContact O-N 2.84Å
562	L	41.1	Very low	55.3	Low	162 Å²	162	111.8 Å²	111.8	85%	0.848	62%	0.62	S	S	*	*			trans	-59	93.7	150.9	-81.4	161.4	0	0	0	107	K560	K560-L562 PolarHBondContact O-N 3.23Å
563	A	39.8	Very low	56.7	Low	62 Å²	62	115.8 Å²	115.8	51%	0.512	64%	0.64	S	S	.	*			trans	-95.1	118.7	-174.9	0	0	0	0	0	109.6	K561 L565	K561-A563 PolarHBondContact O-N 2.84Å; A563-L565 VanDerWaalsContact C-N 3.34Å; A563-L565 PolarHBondContact O-N 3.4Å; A563-L565 VanDerWaalsContact O-N 3.14Å
564	D	52.5	Low	58.3	Low	156 Å²	156	111.3 Å²	111.3	83%	0.834	62%	0.616	S	S	*	*			trans	49.3	47	156.4	-43.1	-34.7	0	0	0	115.1	P566	D564-P566 WeakPolarHBondContact O-CD 3.32Å
565	L	62.3	Low	60.1	Low	46 Å²	46	107.9 Å²	107.9	24%	0.241	60%	0.598	C	S	.	*	P	Polyproline II helix	trans	-72.8	116.4	154	-67.8	175.5	0	0	0	106.8	A563 S567 V574 E576 Y582	A563-L565 VanDerWaalsContact C-N 3.34Å; A563-L565 PolarHBondContact O-N 3.4Å; A563-L565 VanDerWaalsContact O-N 3.14Å; L565-S567 PolarHBondContact O-N 2.65Å; L565-V574 HydrophobicContact CD1-CB 4.27Å; L565-V574 HydrophobicContact CD1-CG1 4.06Å; L565-E576 HydrophobicContact CD1-CG 4.17Å; L565-E576 HydrophobicContact CD2-CG 4.33Å; L565-Y582 HydrophobicContact CD2-CD1 4.16Å; L565-Y582 HydrophobicContact CD2-CG 4.39Å
566	P	65.9	Low	62.2	Low	67 Å²	67	105.3 Å²	105.3	44%	0.435	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-64.5	126.7	179.3	26.9	-33.4	0	0	0	109.2	D564 Y582	D564-P566 WeakPolarHBondContact O-CD 3.32Å; P566-Y582 VanDerWaalsContact CD-CE1 3.47Å; P566-Y582 HydrophobicContact CG-CD1 4.31Å; P566-Y582 HydrophobicContact CG-CE1 3.39Å
567	S	68	Low	64.8	Low	121 Å²	121	109.4 Å²	109.4	85%	0.846	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-66.2	141.5	173.6	44.8	0	0	0	0	110.3	L565	L565-S567 PolarHBondContact O-N 2.65Å
568	C	85.6	Confident	67.4	Low	22 Å²	22	109.4 Å²	109.4	15%	0.149	58%	0.583	C	S	.	*			trans	-134.4	142.3	174.8	54.7	0	0	0	0	108.1	C570 H654 C656	C568-C570 PolarHBondContact O-N 3.33Å; C568-H654 PolarHBondContact SG-CE1 3.31Å; C568-H654 PolarHBondContact SG-ND1 2.75Å; C568-H654 VanDerWaalsContact SG-ND1 3.42Å; C568-C656 HydrophobicContact CB-CB 4.45Å
569	H	88.7	Confident	70.1	Confident	188 Å²	188	103.8 Å²	103.8	87%	0.87	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	10.5	-176.9	-57.3	-65.6	0	0	0	114.7	Y655	H569-Y655 PolarHBondContact O-OH 3.36Å
570	C	90.4	Very high	73	Confident	21 Å²	21	98.4 Å²	98.4	14%	0.142	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-35.6	-179.4	-55.7	0	0	0	0	114	C568 H654 Y655 C656	C568-C570 PolarHBondContact O-N 3.33Å; C570-H654 HydrophobicContact CB-CB 4.42Å; C570-Y655 HydrophobicContact CB-CD1 3.89Å; C570-Y655 HydrophobicContact CB-CE1 3.65Å; C570-Y655 PolarHBondContact SG-N 3.26Å; C570-C656 PolarHBondContact SG-N 2.94Å
571	V	88.5	Confident	75.7	Confident	48 Å²	48	89.5 Å²	89.5	29%	0.291	47%	0.47	S	S	.	.			trans	-148.1	147.7	-177.3	-58.9	0	0	0	0	109.5	Q573 V574 H654	V571-Q573 VanDerWaalsContact C-N 3.32Å; V571-Q573 PolarHBondContact O-N 3.35Å; V571-V574 HydrophobicContact CG2-CG2 4.38Å; V571-H654 VanDerWaalsContact CG2-CE1 3.41Å; V571-H654 WeakPolarHBondContact CG2-CE1 3.39Å
572	D	81.9	Confident	78.5	Confident	171 Å²	171	81.4 Å²	81.4	91%	0.914	43%	0.434	S	S	*	.	S	Bend	trans	-64	-34.7	-175.3	-59.3	-48.7	0	0	0	113.3
573	Q	81.6	Confident	81.1	Confident	155 Å²	155	74 Å²	74	72%	0.724	40%	0.395	S	S	*	.	S	Bend	trans	-144.1	136.8	178.7	-61.2	-172.1	19.9	0	0	112	V571 I575	V571-Q573 VanDerWaalsContact C-N 3.32Å; V571-Q573 PolarHBondContact O-N 3.35Å; Q573-I575 PolarHBondContact O-N 2.87Å
574	V	82.3	Confident	83.9	Confident	26 Å²	26	73.9 Å²	73.9	16%	0.158	39%	0.388	C	S	.	.			trans	-86.8	99.9	177.6	173.4	0	0	0	0	109.9	L565 V571 E576	L565-V574 HydrophobicContact CD1-CB 4.27Å; L565-V574 HydrophobicContact CD1-CG1 4.06Å; V571-V574 HydrophobicContact CG2-CG2 4.38Å; V574-E576 PolarHBondContact O-N 2.68Å
575	I	86.1	Confident	86	Confident	78 Å²	78	66.8 Å²	66.8	40%	0.4	35%	0.35	S	S	.	.			trans	-93.8	91.4	-178.3	-55.1	179.2	0	0	0	109.9	Q573 K577 E578 E579	Q573-I575 PolarHBondContact O-N 2.87Å; I575-K577 HydrophobicContact CG2-CB 4.12Å; I575-K577 PolarHBondContact O-N 2.91Å; I575-E578 HydrophobicContact CB-CB 4.46Å; I575-E578 HydrophobicContact CG2-CB 4.12Å; I575-E578 HydrophobicContact CG2-CG 4.03Å; I575-E578 PolarHBondContact O-N 3.45Å; I575-E579 PolarHBondContact O-N 3.24Å
576	E	87.5	Confident	87.8	Confident	57 Å²	57	64.6 Å²	64.6	27%	0.266	34%	0.338	S	S	.	.	H	α-helix	trans	-57.1	-21.9	-179.7	-69.7	-159	114.9	0	0	114.6	L565 V574 E578 G580 P581 Y582 R1102	L565-E576 HydrophobicContact CD1-CG 4.17Å; L565-E576 HydrophobicContact CD2-CG 4.33Å; V574-E576 PolarHBondContact O-N 2.68Å; E576-E578 PolarHBondContact O-N 2.86Å; E576-G580 WeakPolarHBondContact CA-O 3.45Å; E576-G580 CarbonylContact O-C 3.53Å; E576-G580 VanDerWaalsContact O-C 3.27Å; E576-G580 WeakPolarHBondContact O-CA 3.47Å; E576-G580 PolarHBondContact O-N 3.32Å; E576-G580 VanDerWaalsContact O-N 3.16Å; E576-P581 WeakPolarHBondContact OE1-CA 3.43Å; E576-Y582 PolarHBondContact OE1-N 3.12Å; E576-R1102 IonicContact OE1-CZ 3.1Å; E576-R1102 IonicContact OE1-NE 3.58Å; E576-R1102 IonicContact OE1-NH2 2.76Å; E576-R1102 PolarHBondContact OE1-NH2 3.4Å; E576-R1102 IonicContact OE2-NH2 3.38Å; E576-R1102 PolarHBondContact OE2-NH2 3.47Å
577	K	87	Confident	89.3	Confident	160 Å²	160	61.5 Å²	61.5	70%	0.696	32%	0.318	S	S	*	.	H	α-helix	trans	-67.3	-26.8	175.4	-176.2	-169.7	164	-130.5	0	112	I575	I575-K577 HydrophobicContact CG2-CB 4.12Å; I575-K577 PolarHBondContact O-N 2.91Å
578	E	86.1	Confident	90.7	Very high	123 Å²	123	57 Å²	57	58%	0.575	29%	0.288	S	S	*	.	H	α-helix	trans	-112.6	-47.4	-170.6	-70.3	171	-167.7	0	0	111.5	I575 E576 Y617	I575-E578 HydrophobicContact CB-CB 4.46Å; I575-E578 HydrophobicContact CG2-CB 4.12Å; I575-E578 HydrophobicContact CG2-CG 4.03Å; I575-E578 PolarHBondContact O-N 3.45Å; E576-E578 PolarHBondContact O-N 2.86Å; E578-Y617 WeakPolarHBondContact O-CD1 3.44Å
579	E	89.8	Confident	91.3	Very high	14 Å²	14	56.2 Å²	56.2	7%	0.065	28%	0.284	C	S	.	.	H	α-helix	trans	-75.5	-27.9	173.1	64.5	149.6	-80.4	0	0	112.9	I575 R649 R651 H654	I575-E579 PolarHBondContact O-N 3.24Å; E579-R649 VanDerWaalsContact C-NH1 3.28Å; E579-R649 WeakPolarHBondContact O-CD 3.47Å; E579-R649 PolarHBondContact O-NH1 3.35Å; E579-R649 IonicContact OE1-CZ 2.9Å; E579-R649 IonicContact OE1-NH1 2.77Å; E579-R649 PolarHBondContact OE1-NH1 2.99Å; E579-R649 IonicContact OE1-NH2 3.52Å; E579-R649 PolarHBondContact OE1-NH2 3.45Å; E579-R651 IonicContact OE1-CZ 3.58Å; E579-R651 IonicContact OE1-NE 3.39Å; E579-R651 PolarHBondContact OE1-NE 3.19Å; E579-R651 IonicContact OE1-NH2 2.92Å; E579-R651 IonicContact OE2-CZ 3.51Å; E579-R651 IonicContact OE2-NE 3.71Å; E579-R651 PolarHBondContact OE2-NE 2.93Å; E579-R651 IonicContact OE2-NH2 3.76Å; E579-R651 PolarHBondContact OE2-NH2 3.04Å; E579-H654 IonicContact OE2-CD2 3.67Å; E579-H654 IonicContact OE2-CE1 2.89Å; E579-H654 IonicContact OE2-NE2 2.66Å; E579-H654 PolarHBondContact OE2-NE2 3.47Å
580	G	94	Very high	91.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.26	C	S	.	.			trans	105	171.2	-168.6	0	0	0	0	0	112.5	E576 R649	E576-G580 WeakPolarHBondContact CA-O 3.45Å; E576-G580 CarbonylContact O-C 3.53Å; E576-G580 VanDerWaalsContact O-C 3.27Å; E576-G580 WeakPolarHBondContact O-CA 3.47Å; E576-G580 PolarHBondContact O-N 3.32Å; E576-G580 VanDerWaalsContact O-N 3.16Å; G580-R649 PolarHBondContact O-NH2 2.89Å
581	P	94.6	Very high	92.1	Very high	7 Å²	7	52.6 Å²	52.6	5%	0.045	27%	0.273	C	S	.	.			trans	-67.4	136.6	-173.9	28.7	-35.5	0	0	0	112.3	E576 Y583 R649 R1102 E1103	E576-P581 WeakPolarHBondContact OE1-CA 3.43Å; P581-Y583 HydrophobicContact CB-CE1 4.5Å; P581-Y583 HydrophobicContact CG-CE1 4.34Å; P581-R649 PolarHBondContact O-NH2 3.1Å; P581-R1102 HydrophobicContact CB-CB 4.04Å; P581-R1102 HydrophobicContact CG-CB 4.49Å; P581-E1103 VanDerWaalsContact CG-OE1 3.23Å; P581-E1103 WeakPolarHBondContact CG-OE1 3.5Å
582	Y	95.1	Very high	92.6	Very high	25 Å²	25	51 Å²	51	10%	0.098	26%	0.263	C	S	.	.			trans	-96.2	126.4	179.5	-178.7	-92.6	0	0	0	111.7	L565 P566 E576 T584 T658 L661	L565-Y582 HydrophobicContact CD2-CD1 4.16Å; L565-Y582 HydrophobicContact CD2-CG 4.39Å; P566-Y582 VanDerWaalsContact CD-CE1 3.47Å; P566-Y582 HydrophobicContact CG-CD1 4.31Å; P566-Y582 HydrophobicContact CG-CE1 3.39Å; E576-Y582 PolarHBondContact OE1-N 3.12Å; Y582-T584 HydrophobicContact CE1-CG2 4.29Å; Y582-T584 HydrophobicContact CE2-CG2 4.44Å; Y582-T584 WeakPolarHBondContact OH-CG2 3.25Å; Y582-T658 WeakPolarHBondContact OH-CB 3.45Å; Y582-T658 PolarHBondContact OH-OG1 3.04Å; Y582-L661 HydrophobicContact CD2-CD1 3.89Å; Y582-L661 HydrophobicContact CE2-CD1 4.33Å; Y582-L661 HydrophobicContact CE2-CD2 4.19Å
583	Y	96.3	Very high	93.3	Very high	8 Å²	8	46 Å²	46	3%	0.031	25%	0.246	C	C	.	.			trans	-166.5	152.6	168.6	58.1	-90.7	0	0	0	110.7	P581 H585 L586 I663 C1099 R1102 E1103	P581-Y583 HydrophobicContact CB-CE1 4.5Å; P581-Y583 HydrophobicContact CG-CE1 4.34Å; Y583-H585 AromaticContact CD2-CE1 3.46Å; Y583-H585 VanDerWaalsContact CD2-CE1 3.46Å; Y583-H585 WeakPolarHBondContact CD2-CE1 3.49Å; Y583-H585 AromaticContact CD2-ND1 3.96Å; Y583-H585 AromaticContact CD2-NE2 3.71Å; Y583-H585 AromaticContact CG-CE1 3.65Å; Y583-L586 HydrophobicContact CE2-CD1 3.94Å; Y583-L586 HydrophobicContact CE2-CG 4.1Å; Y583-I663 WeakPolarHBondContact OH-CA 3.46Å; Y583-I663 PolarHBondContact OH-O 3.36Å; Y583-C1099 HydrophobicContact CD1-CB 4.41Å; Y583-C1099 HydrophobicContact CD2-CB 4.12Å; Y583-C1099 HydrophobicContact CE1-CB 3.88Å; Y583-C1099 HydrophobicContact CE2-CB 3.57Å; Y583-C1099 HydrophobicContact CG-CB 4.5Å; Y583-C1099 VanDerWaalsContact CZ-CB 3.42Å; Y583-R1102 HydrophobicContact CD1-CB 3.88Å; Y583-R1102 HydrophobicContact CD1-CG 4.03Å; Y583-R1102 HydrophobicContact CE1-CB 3.86Å; Y583-R1102 HydrophobicContact CE1-CG 4.48Å; Y583-E1103 HydrophobicContact CE1-CG 4.25Å; Y583-E1103 VanDerWaalsContact OH-CG 3.27Å; Y583-E1103 WeakPolarHBondContact OH-CG 3.47Å; Y583-E1103 PolarHBondContact OH-OE1 2.87Å
584	T	97.3	Very high	94.1	Very high	59 Å²	59	40.1 Å²	40.1	36%	0.362	22%	0.223	S	C	.	.			trans	-119.4	-5.6	-174.9	54.5	0	0	0	0	114.4	Y582 L586 G587 A588 T658 L661	Y582-T584 HydrophobicContact CE1-CG2 4.29Å; Y582-T584 HydrophobicContact CE2-CG2 4.44Å; Y582-T584 WeakPolarHBondContact OH-CG2 3.25Å; T584-L586 VanDerWaalsContact C-N 3.29Å; T584-L586 PolarHBondContact O-N 2.89Å; T584-G587 CarbonylContact O-C 3.57Å; T584-G587 WeakPolarHBondContact O-CA 3.44Å; T584-G587 PolarHBondContact O-N 3.38Å; T584-A588 HydrophobicContact CG2-CB 3.91Å; T584-T658 HydrophobicContact CG2-CG2 3.79Å; T584-L661 HydrophobicContact CG2-CD2 4.13Å
585	H	98.1	Very high	94.9	Very high	7 Å²	7	38.9 Å²	38.9	3%	0.032	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-17.9	-169.3	55.1	-98.3	0	0	0	115.1	Y583 V778 A779 N825 G826 C1099	Y583-H585 AromaticContact CD2-CE1 3.46Å; Y583-H585 VanDerWaalsContact CD2-CE1 3.46Å; Y583-H585 WeakPolarHBondContact CD2-CE1 3.49Å; Y583-H585 AromaticContact CD2-ND1 3.96Å; Y583-H585 AromaticContact CD2-NE2 3.71Å; Y583-H585 AromaticContact CG-CE1 3.65Å; H585-V778 HydrophobicContact CB-CB 4.38Å; H585-V778 HydrophobicContact CB-CG1 3.95Å; H585-A779 HydrophobicContact CB-CB 4.19Å; H585-A779 PolarHBondContact O-N 2.85Å; H585-A779 VanDerWaalsContact O-N 3.16Å; H585-N825 WeakPolarHBondContact CB-O 3.41Å; H585-N825 VanDerWaalsContact CG-O 3.25Å; H585-G826 PolarHBondContact NE2-O 2.87Å; H585-C1099 PolarHBondContact CE1-SG 2.66Å; H585-C1099 PolarHBondContact NE2-SG 2.91Å
586	L	98.4	Very high	95.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-20.2	167.4	-63.8	-173.5	0	0	0	112.6	Y583 T584 R602 V662 I663 A776 A779 I1097	Y583-L586 HydrophobicContact CE2-CD1 3.94Å; Y583-L586 HydrophobicContact CE2-CG 4.1Å; T584-L586 VanDerWaalsContact C-N 3.29Å; T584-L586 PolarHBondContact O-N 2.89Å; L586-R602 PolarHBondContact O-NH1 3.05Å; L586-V662 HydrophobicContact CB-CB 4.08Å; L586-V662 HydrophobicContact CB-CG1 3.97Å; L586-V662 WeakPolarHBondContact CB-O 3.43Å; L586-I663 VanDerWaalsContact CD1-O 3.25Å; L586-I663 WeakPolarHBondContact CD1-O 3.34Å; L586-A776 HydrophobicContact CD2-CB 3.97Å; L586-A779 HydrophobicContact CD2-CB 4.27Å; L586-I1097 HydrophobicContact CD2-CG2 3.92Å
587	G	98.1	Very high	96	Very high	2 Å²	2	39 Å²	39	2%	0.021	21%	0.213	C	C	.	.			trans	133.5	147.4	-171.6	0	0	0	0	0	111.8	T584 V662	T584-G587 CarbonylContact O-C 3.57Å; T584-G587 WeakPolarHBondContact O-CA 3.44Å; T584-G587 PolarHBondContact O-N 3.38Å; G587-V662 PolarHBondContact O-N 2.92Å
588	A	98.1	Very high	96.5	Very high	25 Å²	25	33.1 Å²	33.1	21%	0.207	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	162.9	175.6	0	0	0	0	0	109.6	T584 T658 V660 L661	T584-A588 HydrophobicContact CG2-CB 3.91Å; A588-T658 HydrophobicContact CB-CG2 4.19Å; A588-V660 CarbonylContact C-O 3.5Å; A588-V660 WeakPolarHBondContact CA-O 3.44Å; A588-L661 HydrophobicContact CB-CD2 3.72Å
589	G	97.9	Very high	97.1	Very high	6 Å²	6	27.2 Å²	27.2	6%	0.062	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	169.5	173.7	0	0	0	0	0	112.5	N591 D657 A659 V660	G589-N591 VanDerWaalsContact C-N 3.28Å; G589-N591 PolarHBondContact O-N 2.95Å; G589-D657 CarbonylContact C-O 3.01Å; G589-D657 WeakPolarHBondContact CA-O 3.33Å; G589-D657 PolarHBondContact N-O 3.07Å; G589-A659 PolarHBondContact O-N 3.33Å; G589-V660 PolarHBondContact N-O 3.38Å; G589-V660 WeakPolarHBondContact O-CB 3.44Å; G589-V660 PolarHBondContact O-N 3.41Å
590	P	97.8	Very high	97.5	Very high	56 Å²	56	27.5 Å²	27.5	36%	0.364	16%	0.163	S	C	.	.	S	Bend	trans	-70.2	-21.8	-179.8	26.4	-34.6	0	0	0	113.8	A594 C656	P590-A594 HydrophobicContact CG-CB 4.16Å; P590-C656 WeakPolarHBondContact CA-O 3.37Å
591	N	97.8	Very high	97.7	Very high	78 Å²	78	32 Å²	32	42%	0.417	19%	0.187	S	C	.	.	S	Bend	trans	-155.5	171.9	178.7	61.9	62	0	0	0	111.3	G589 A593 A594 V595	G589-N591 VanDerWaalsContact C-N 3.28Å; G589-N591 PolarHBondContact O-N 2.95Å; N591-A593 VanDerWaalsContact C-N 3.33Å; N591-A593 PolarHBondContact O-N 2.84Å; N591-A593 WeakPolarHBondContact OD1-CB 3.35Å; N591-A593 PolarHBondContact OD1-N 3.22Å; N591-A594 PolarHBondContact O-N 3.03Å; N591-A594 PolarHBondContact OD1-N 3.03Å; N591-V595 PolarHBondContact O-N 2.92Å
592	V	98.3	Very high	97.9	Very high	13 Å²	13	33.9 Å²	33.9	8%	0.079	19%	0.193	C	C	.	.	H	α-helix	trans	-63.2	-36.2	-178	-178.7	0	0	0	0	112.3	V595 R596 V612 V614 V648 Q650 V660 E863	V592-V595 PolarHBondContact O-N 3.42Å; V592-R596 PolarHBondContact O-N 2.84Å; V592-V612 HydrophobicContact CG1-CB 4.46Å; V592-V612 HydrophobicContact CG1-CG1 3.96Å; V592-V614 HydrophobicContact CG1-CG2 4.37Å; V592-V614 HydrophobicContact CG2-CG2 3.94Å; V592-V648 HydrophobicContact CG1-CG2 4.5Å; V592-V648 HydrophobicContact CG2-CG2 4.41Å; V592-Q650 HydrophobicContact CG2-CG 4.22Å; V592-Q650 VanDerWaalsContact CG2-NE2 3.29Å; V592-V660 HydrophobicContact CG2-CG1 4.4Å; V592-E863 HydrophobicContact CG1-CB 3.94Å
593	A	97.9	Very high	98	Very high	67 Å²	67	35 Å²	35	55%	0.554	20%	0.197	S	C	*	.	H	α-helix	trans	-67.1	-40.7	179.9	0	0	0	0	0	112.2	N591 V595 R596 E597	N591-A593 VanDerWaalsContact C-N 3.33Å; N591-A593 PolarHBondContact O-N 2.84Å; N591-A593 WeakPolarHBondContact OD1-CB 3.35Å; N591-A593 PolarHBondContact OD1-N 3.22Å; A593-V595 VanDerWaalsContact C-N 3.31Å; A593-V595 PolarHBondContact O-N 2.86Å; A593-R596 WeakPolarHBondContact O-CB 3.27Å; A593-R596 PolarHBondContact O-N 2.81Å; A593-E597 PolarHBondContact O-N 2.91Å
594	A	98.3	Very high	98.1	Very high	31 Å²	31	37.8 Å²	37.8	26%	0.256	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-37.2	173.1	0	0	0	0	0	112	P590 N591 M598	P590-A594 HydrophobicContact CG-CB 4.16Å; N591-A594 PolarHBondContact O-N 3.03Å; N591-A594 PolarHBondContact OD1-N 3.03Å; A594-M598 WeakPolarHBondContact O-CB 3.39Å; A594-M598 PolarHBondContact O-N 3.34Å
595	V	98.4	Very high	98	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.1	-38.8	174	176.1	0	0	0	0	111.7	N591 V592 A593 M598 M599 V648 V660 V662	N591-V595 PolarHBondContact O-N 2.92Å; V592-V595 PolarHBondContact O-N 3.42Å; A593-V595 VanDerWaalsContact C-N 3.31Å; A593-V595 PolarHBondContact O-N 2.86Å; V595-M598 HydrophobicContact CG1-CE 3.96Å; V595-M598 PolarHBondContact O-N 2.95Å; V595-M599 WeakPolarHBondContact O-CG 3.27Å; V595-M599 PolarHBondContact O-N 3.34Å; V595-V648 HydrophobicContact CG1-CG1 3.66Å; V595-V660 HydrophobicContact CG2-CB 4.13Å; V595-V660 HydrophobicContact CG2-CG1 4.03Å; V595-V662 HydrophobicContact CG1-CG2 3.54Å
596	R	98.4	Very high	97.9	Very high	29 Å²	29	42 Å²	42	11%	0.109	25%	0.248	C	C	.	.	H	α-helix	trans	-57.1	-54.2	170	165	173	-88.1	-83.7	3.6	110.5	V592 A593 M598 M599 E600 G607 V610 V612 E863	V592-R596 PolarHBondContact O-N 2.84Å; A593-R596 WeakPolarHBondContact O-CB 3.27Å; A593-R596 PolarHBondContact O-N 2.81Å; R596-M598 VanDerWaalsContact C-N 3.32Å; R596-M598 PolarHBondContact O-N 3.34Å; R596-M599 PolarHBondContact O-N 2.9Å; R596-E600 HydrophobicContact CG-CG 4.11Å; R596-E600 IonicContact CZ-OE1 3.24Å; R596-E600 IonicContact NH1-OE1 2.91Å; R596-E600 PolarHBondContact NH1-OE1 3.19Å; R596-E600 WeakPolarHBondContact O-CG 3.37Å; R596-E600 PolarHBondContact O-N 3.34Å; R596-G607 PolarHBondContact NH1-O 3.01Å; R596-V610 PolarHBondContact NH1-O 3.05Å; R596-V610 PolarHBondContact NH2-O 2.82Å; R596-V612 HydrophobicContact CB-CG2 4Å; R596-E863 IonicContact CZ-OE1 3.6Å; R596-E863 IonicContact CZ-OE2 2.68Å; R596-E863 IonicContact NE-OE2 3.49Å; R596-E863 PolarHBondContact NE-OE2 3.35Å; R596-E863 IonicContact NH2-OE1 3.18Å; R596-E863 PolarHBondContact NH2-OE1 2.9Å; R596-E863 IonicContact NH2-OE2 2.89Å; R596-E863 PolarHBondContact NH2-OE2 3.01Å
597	E	98.3	Very high	97.7	Very high	108 Å²	108	43.6 Å²	43.6	51%	0.505	26%	0.264	S	S	.	.	H	α-helix	trans	-57.5	-45.2	-179.7	175.2	171.5	-157.8	0	0	111.7	A593 M599 E600 N601	A593-E597 PolarHBondContact O-N 2.91Å; E597-M599 VanDerWaalsContact C-N 3.32Å; E597-M599 PolarHBondContact O-N 2.94Å; E597-E600 PolarHBondContact O-N 2.92Å; E597-N601 WeakPolarHBondContact CG-ND2 3.23Å; E597-N601 VanDerWaalsContact O-CB 3.3Å; E597-N601 WeakPolarHBondContact O-CB 3.25Å; E597-N601 PolarHBondContact O-N 3.39Å; E597-N601 PolarHBondContact O-ND2 3.33Å
598	M	98.4	Very high	97.6	Very high	37 Å²	37	49 Å²	49	18%	0.182	29%	0.293	C	S	.	.	H	α-helix	trans	-56.9	-43.7	174.6	175.5	-169.2	70.2	0	0	111.9	A594 V595 R596 R602 V662	A594-M598 WeakPolarHBondContact O-CB 3.39Å; A594-M598 PolarHBondContact O-N 3.34Å; V595-M598 HydrophobicContact CG1-CE 3.96Å; V595-M598 PolarHBondContact O-N 2.95Å; R596-M598 VanDerWaalsContact C-N 3.32Å; R596-M598 PolarHBondContact O-N 3.34Å; M598-R602 WeakPolarHBondContact O-CB 3.43Å; M598-R602 VanDerWaalsContact O-CG 3.22Å; M598-R602 WeakPolarHBondContact O-CG 3.38Å; M598-R602 PolarHBondContact O-N 3.49Å; M598-R602 PolarHBondContact SD-NH2 3.25Å; M598-V662 HydrophobicContact CE-CG2 3.77Å
599	M	98.5	Very high	97.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-74.4	-35.3	179.7	-66.9	-50.1	-57.8	0	0	113	V595 R596 E597 Y603 V610 L644 C646 I665 L775	V595-M599 WeakPolarHBondContact O-CG 3.27Å; V595-M599 PolarHBondContact O-N 3.34Å; R596-M599 PolarHBondContact O-N 2.9Å; E597-M599 VanDerWaalsContact C-N 3.32Å; E597-M599 PolarHBondContact O-N 2.94Å; M599-Y603 VanDerWaalsContact O-CB 3.26Å; M599-Y603 WeakPolarHBondContact O-CB 3.3Å; M599-Y603 PolarHBondContact O-N 2.97Å; M599-V610 HydrophobicContact CB-CG1 4.29Å; M599-L644 HydrophobicContact CB-CD2 4.39Å; M599-L644 HydrophobicContact CE-CD2 3.8Å; M599-C646 HydrophobicContact CG-CB 4.41Å; M599-I665 HydrophobicContact CE-CD1 3.82Å; M599-I665 HydrophobicContact CE-CG1 4.04Å; M599-I665 HydrophobicContact CE-CG2 3.96Å; M599-I665 HydrophobicContact SD-CD1 4.44Å; M599-L775 HydrophobicContact CE-CD2 4.33Å
600	E	98.4	Very high	97.6	Very high	19 Å²	19	48.3 Å²	48.3	9%	0.089	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-48.3	170.8	-74.2	-172.8	171	0	0	111.6	R596 E597 Y603 G604 A605 K606 G607 V610	R596-E600 HydrophobicContact CG-CG 4.11Å; R596-E600 IonicContact CZ-OE1 3.24Å; R596-E600 IonicContact NH1-OE1 2.91Å; R596-E600 PolarHBondContact NH1-OE1 3.19Å; R596-E600 WeakPolarHBondContact O-CG 3.37Å; R596-E600 PolarHBondContact O-N 3.34Å; E597-E600 PolarHBondContact O-N 2.92Å; E600-Y603 PolarHBondContact O-N 3.02Å; E600-G604 PolarHBondContact O-N 2.77Å; E600-A605 WeakPolarHBondContact CA-O 3.26Å; E600-A605 WeakPolarHBondContact CB-O 3.28Å; E600-A605 PolarHBondContact O-N 2.86Å; E600-K606 HydrophobicContact CB-CG 4.19Å; E600-K606 HydrophobicContact CG-CB 4.44Å; E600-K606 HydrophobicContact CG-CG 4.41Å; E600-K606 WeakPolarHBondContact OE2-CB 3.48Å; E600-K606 WeakPolarHBondContact OE2-CD 3.3Å; E600-K606 VanDerWaalsContact OE2-CG 3.3Å; E600-K606 WeakPolarHBondContact OE2-CG 3.21Å; E600-K606 IonicContact OE2-NZ 3.68Å; E600-G607 PolarHBondContact OE1-N 3.12Å; E600-V610 HydrophobicContact CG-CB 4.09Å; E600-V610 HydrophobicContact CG-CG1 4.46Å; E600-V610 HydrophobicContact CG-CG2 3.95Å
601	N	98.3	Very high	97.6	Very high	96 Å²	96	46.3 Å²	46.3	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-66.8	-37.1	179.3	-68	-15.8	0	0	0	111.5	E597 K606	E597-N601 WeakPolarHBondContact CG-ND2 3.23Å; E597-N601 VanDerWaalsContact O-CB 3.3Å; E597-N601 WeakPolarHBondContact O-CB 3.25Å; E597-N601 PolarHBondContact O-N 3.39Å; E597-N601 PolarHBondContact O-ND2 3.33Å; N601-K606 PolarHBondContact OD1-NZ 3.24Å
602	R	98.1	Very high	97.7	Very high	45 Å²	45	42.6 Å²	42.6	17%	0.17	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-42	171.4	-77.5	177.9	-169	-175.7	7.9	112.7	L586 M598 K774 L775	L586-R602 PolarHBondContact O-NH1 3.05Å; M598-R602 WeakPolarHBondContact O-CB 3.43Å; M598-R602 VanDerWaalsContact O-CG 3.22Å; M598-R602 WeakPolarHBondContact O-CG 3.38Å; M598-R602 PolarHBondContact O-N 3.49Å; M598-R602 PolarHBondContact SD-NH2 3.25Å; R602-K774 WeakPolarHBondContact O-CE 3.11Å; R602-K774 WeakPolarHBondContact O-CG 3.4Å; R602-L775 WeakPolarHBondContact CD-O 3.3Å; R602-L775 PolarHBondContact NH1-O 3Å
603	Y	97.4	Very high	97.7	Very high	48 Å²	48	42 Å²	42	19%	0.188	25%	0.248	C	C	.	.	H	α-helix	trans	-77.7	-32.6	-177.4	-171.7	-108	0	0	0	112.9	M599 E600 A605 V610 K643 L644 K774 L775	M599-Y603 VanDerWaalsContact O-CB 3.26Å; M599-Y603 WeakPolarHBondContact O-CB 3.3Å; M599-Y603 PolarHBondContact O-N 2.97Å; E600-Y603 PolarHBondContact O-N 3.02Å; Y603-A605 HydrophobicContact CD1-CB 3.86Å; Y603-A605 HydrophobicContact CE1-CB 4.08Å; Y603-V610 HydrophobicContact CD1-CG2 4.46Å; Y603-K643 HydrophobicContact CE1-CB 3.7Å; Y603-K643 HydrophobicContact CE1-CG 4.14Å; Y603-K643 VanDerWaalsContact OH-CB 3.31Å; Y603-K643 WeakPolarHBondContact OH-CB 3.44Å; Y603-L644 HydrophobicContact CD2-CB 4.45Å; Y603-L644 HydrophobicContact CD2-CD1 4.4Å; Y603-L644 HydrophobicContact CD2-CD2 4.35Å; Y603-L644 HydrophobicContact CG-CB 4.49Å; Y603-L644 HydrophobicContact CG-CD2 4.28Å; Y603-K774 WeakPolarHBondContact O-CE 3.08Å; Y603-K774 PolarHBondContact O-NZ 3.32Å; Y603-L775 HydrophobicContact CD2-CD2 4.16Å
604	G	97.1	Very high	97.7	Very high	67 Å²	67	39.1 Å²	39.1	69%	0.691	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.3	20.2	-176.2	0	0	0	0	0	114.2	E600	E600-G604 PolarHBondContact O-N 2.77Å
605	A	95.9	Very high	97.7	Very high	33 Å²	33	37.7 Å²	37.7	27%	0.273	21%	0.212	S	C	.	.			trans	-147.3	154.5	172.5	0	0	0	0	0	110.7	E600 Y603 A609	E600-A605 WeakPolarHBondContact CA-O 3.26Å; E600-A605 WeakPolarHBondContact CB-O 3.28Å; E600-A605 PolarHBondContact O-N 2.86Å; Y603-A605 HydrophobicContact CD1-CB 3.86Å; Y603-A605 HydrophobicContact CE1-CB 4.08Å; A605-A609 HydrophobicContact CB-CB 3.74Å
606	K	95.8	Very high	97.6	Very high	122 Å²	122	40.4 Å²	40.4	53%	0.53	23%	0.228	S	C	.	.			trans	-120.7	168.8	-172.6	-56.3	-156.7	167.6	-121.1	0	112.9	E600 N601	E600-K606 HydrophobicContact CB-CG 4.19Å; E600-K606 HydrophobicContact CG-CB 4.44Å; E600-K606 HydrophobicContact CG-CG 4.41Å; E600-K606 WeakPolarHBondContact OE2-CB 3.48Å; E600-K606 WeakPolarHBondContact OE2-CD 3.3Å; E600-K606 VanDerWaalsContact OE2-CG 3.3Å; E600-K606 WeakPolarHBondContact OE2-CG 3.21Å; E600-K606 IonicContact OE2-NZ 3.68Å; N601-K606 PolarHBondContact OD1-NZ 3.24Å
607	G	95.1	Very high	97.6	Very high	33 Å²	33	40.7 Å²	40.7	34%	0.34	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	66.8	-135.4	174.7	0	0	0	0	0	112.1	R596 E600 A609 V610	R596-G607 PolarHBondContact NH1-O 3.01Å; E600-G607 PolarHBondContact OE1-N 3.12Å; G607-A609 PolarHBondContact O-N 3.4Å; G607-V610 PolarHBondContact O-N 3.32Å
608	N	95.6	Very high	97.5	Very high	116 Å²	116	37.1 Å²	37.1	62%	0.62	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-54.2	-22.8	-176.1	-64.2	6.5	0	0	0	114.8	V610 E641 E642	N608-V610 PolarHBondContact O-N 2.82Å; N608-E641 HydrophobicContact CB-CB 4.38Å; N608-E641 WeakPolarHBondContact CB-OE2 3.49Å; N608-E641 PolarHBondContact ND2-OE2 2.87Å; N608-E642 WeakPolarHBondContact O-CA 3.39Å
609	A	97.8	Very high	97.4	Very high	16 Å²	16	37 Å²	37	13%	0.132	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-64.6	-27.3	178.1	0	0	0	0	0	113.2	A605 G607 E641 K643 L644	A605-A609 HydrophobicContact CB-CB 3.74Å; G607-A609 PolarHBondContact O-N 3.4Å; A609-E641 WeakPolarHBondContact CA-O 3.48Å; A609-K643 HydrophobicContact CB-CG 4.5Å; A609-K643 PolarHBondContact O-N 2.75Å; A609-L644 PolarHBondContact O-N 3.39Å
610	V	98.2	Very high	97.3	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.5	176.1	179.7	0	0	0	0	108.6	R596 M599 E600 Y603 G607 N608 L644	R596-V610 PolarHBondContact NH1-O 3.05Å; R596-V610 PolarHBondContact NH2-O 2.82Å; M599-V610 HydrophobicContact CB-CG1 4.29Å; E600-V610 HydrophobicContact CG-CB 4.09Å; E600-V610 HydrophobicContact CG-CG1 4.46Å; E600-V610 HydrophobicContact CG-CG2 3.95Å; Y603-V610 HydrophobicContact CD1-CG2 4.46Å; G607-V610 PolarHBondContact O-N 3.32Å; N608-V610 PolarHBondContact O-N 2.82Å; V610-L644 CarbonylContact C-O 3.27Å; V610-L644 WeakPolarHBondContact CA-O 3.44Å; V610-L644 HydrophobicContact CG1-CD2 4.45Å; V610-L644 HydrophobicContact CG2-CB 4.33Å; V610-L644 HydrophobicContact CG2-CD2 4.38Å
611	R	98	Very high	97.2	Very high	13 Å²	13	42.6 Å²	42.6	5%	0.049	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	129.6	175.2	174.7	-179.5	172.8	-171.9	-3.8	109.2	E613 R636 E642 L644 L645 C646 A878	R611-E613 IonicContact CZ-OE1 2.69Å; R611-E613 VanDerWaalsContact CZ-OE1 3.22Å; R611-E613 IonicContact NE-OE1 2.6Å; R611-E613 PolarHBondContact NE-OE1 2.88Å; R611-E613 IonicContact NH2-OE1 3.97Å; R611-E613 PolarHBondContact NH2-OE1 2.87Å; R611-R636 PolarHBondContact NH1-O 3.39Å; R611-E642 HydrophobicContact CB-CG 4.07Å; R611-E642 VanDerWaalsContact CD-CD 3.41Å; R611-E642 WeakPolarHBondContact CD-OE1 3.21Å; R611-E642 WeakPolarHBondContact CD-OE2 3.35Å; R611-E642 IonicContact CZ-OE2 2.8Å; R611-E642 IonicContact NH1-OE1 3.98Å; R611-E642 IonicContact NH1-OE2 3.82Å; R611-E642 PolarHBondContact NH1-OE2 3.1Å; R611-L644 PolarHBondContact N-O 2.95Å; R611-L645 HydrophobicContact CB-CD1 4.46Å; R611-L645 HydrophobicContact CG-CD1 4.06Å; R611-L645 CarbonylContact O-C 3.56Å; R611-L645 WeakPolarHBondContact O-CA 3.31Å; R611-C646 PolarHBondContact O-N 3.17Å; R611-A878 PolarHBondContact NH2-O 2.97Å
612	V	98.5	Very high	97.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137	171.9	-170.7	0	0	0	0	109.3	V592 R596 C646 V648 E863	V592-V612 HydrophobicContact CG1-CB 4.46Å; V592-V612 HydrophobicContact CG1-CG1 3.96Å; R596-V612 HydrophobicContact CB-CG2 4Å; V612-C646 WeakPolarHBondContact CA-O 3.4Å; V612-C646 HydrophobicContact CG2-CB 4.41Å; V612-V648 HydrophobicContact CG1-CB 4.26Å; V612-V648 HydrophobicContact CG1-CG1 3.64Å; V612-V648 HydrophobicContact CG1-CG2 3.57Å; V612-E863 HydrophobicContact CB-CB 3.88Å; V612-E863 HydrophobicContact CB-CG 4.48Å; V612-E863 VanDerWaalsContact CB-OE2 3.3Å; V612-E863 WeakPolarHBondContact CB-OE2 3.31Å; V612-E863 WeakPolarHBondContact CG2-OE2 3.42Å; V612-E863 PolarHBondContact N-OE1 2.81Å; V612-E863 PolarHBondContact N-OE2 2.66Å; V612-E863 WeakPolarHBondContact O-CB 3.48Å
613	E	98.4	Very high	96.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124	172.9	-68.4	-68.8	179.5	0	0	109.6	R611 I635 L645 C646 L647 V648 K873	R611-E613 IonicContact CZ-OE1 2.69Å; R611-E613 VanDerWaalsContact CZ-OE1 3.22Å; R611-E613 IonicContact NE-OE1 2.6Å; R611-E613 PolarHBondContact NE-OE1 2.88Å; R611-E613 IonicContact NH2-OE1 3.97Å; R611-E613 PolarHBondContact NH2-OE1 2.87Å; E613-I635 HydrophobicContact CB-CD1 4.3Å; E613-I635 HydrophobicContact CG-CD1 4.22Å; E613-I635 HydrophobicContact CG-CG2 4.5Å; E613-L645 HydrophobicContact CB-CD1 4.4Å; E613-L645 HydrophobicContact CG-CD1 3.72Å; E613-C646 PolarHBondContact N-O 2.95Å; E613-L647 HydrophobicContact CB-CD2 3.79Å; E613-L647 HydrophobicContact CG-CD2 4.41Å; E613-L647 WeakPolarHBondContact O-CA 3.37Å; E613-V648 PolarHBondContact O-N 2.78Å; E613-K873 WeakPolarHBondContact OE1-CD 3.41Å; E613-K873 IonicContact OE1-NZ 3.56Å; E613-K873 PolarHBondContact OE1-NZ 2.74Å; E613-K873 IonicContact OE2-NZ 3.18Å; E613-K873 PolarHBondContact OE2-NZ 2.9Å
614	V	98.3	Very high	96.7	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.8	176.1	-176.9	0	0	0	0	108.9	V592 V648 Q650 S859	V592-V614 HydrophobicContact CG1-CG2 4.37Å; V592-V614 HydrophobicContact CG2-CG2 3.94Å; V614-V648 HydrophobicContact CG2-CG2 4.03Å; V614-Q650 HydrophobicContact CG1-CG 4.05Å; V614-S859 VanDerWaalsContact O-CB 3.29Å; V614-S859 WeakPolarHBondContact O-CB 3.36Å; V614-S859 PolarHBondContact O-N 2.78Å
615	V	98.3	Very high	96.3	Very high	2 Å²	2	36 Å²	36	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.8	175.7	-64.4	0	0	0	0	110.8	V648 I663 Y856 K857 I858 V1086	V615-V648 WeakPolarHBondContact CG2-O 3.46Å; V615-V648 PolarHBondContact N-O 2.8Å; V615-I663 HydrophobicContact CG2-CD1 3.6Å; V615-I663 HydrophobicContact CG2-CG1 4.41Å; V615-Y856 HydrophobicContact CB-CD1 4Å; V615-Y856 HydrophobicContact CG2-CD1 3.67Å; V615-Y856 HydrophobicContact CG2-CE1 4.07Å; V615-Y856 HydrophobicContact CG2-CG 4.45Å; V615-K857 WeakPolarHBondContact CA-O 3.35Å; V615-I858 HydrophobicContact CG1-CD1 4.38Å; V615-V1086 HydrophobicContact CG1-CG1 4.17Å; V615-V1086 HydrophobicContact CG1-CG2 4.16Å
616	V	97.8	Very high	96	Very high	56 Å²	56	36.2 Å²	36.2	34%	0.339	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	121.3	-179	-177.9	0	0	0	0	108	Y856 K857	V616-Y856 CarbonylContact O-C 3.51Å; V616-Y856 VanDerWaalsContact O-CA 3.3Å; V616-Y856 WeakPolarHBondContact O-CA 3.49Å; V616-K857 HydrophobicContact CB-CG 3.97Å; V616-K857 PolarHBondContact N-O 2.84Å; V616-K857 PolarHBondContact O-N 2.99Å
617	Y	97.9	Very high	95.9	Very high	35 Å²	35	31.4 Å²	31.4	14%	0.137	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	132.8	171	179.4	-91.3	0	0	0	109.4	E578 L855 Y856	E578-Y617 WeakPolarHBondContact O-CD1 3.44Å; Y617-L855 HydrophobicContact CD2-CB 4.09Å; Y617-L855 HydrophobicContact CE2-CB 3.71Å; Y617-L855 HydrophobicContact CE2-CD1 3.8Å; Y617-L855 HydrophobicContact CE2-CG 4.39Å; Y617-Y856 HydrophobicContact CD2-CD2 4.5Å; Y617-Y856 HydrophobicContact CD2-CE1 4.07Å; Y617-Y856 AromaticContact CD2-CE2 3.99Å; Y617-Y856 HydrophobicContact CD2-CE2 3.99Å; Y617-Y856 AromaticContact CD2-CZ 3.75Å; Y617-Y856 HydrophobicContact CG-CE1 4.42Å
618	T	96.7	Very high	95.8	Very high	33 Å²	33	30.1 Å²	30.1	20%	0.202	17%	0.173	C	C	.	.			trans	-121.5	-13.8	-177.8	68.8	0	0	0	0	113.5	K620 L855 K857 D1082	T618-K620 PolarHBondContact O-N 3.15Å; T618-K620 PolarHBondContact OG1-N 2.89Å; T618-L855 PolarHBondContact N-O 2.77Å; T618-L855 PolarHBondContact OG1-O 3.03Å; T618-K857 HydrophobicContact CG2-CB 4.33Å; T618-K857 HydrophobicContact CG2-CD 3.99Å; T618-K857 HydrophobicContact CG2-CG 3.79Å; T618-D1082 WeakPolarHBondContact CB-O 3.31Å; T618-D1082 HydrophobicContact CG2-CB 4.34Å; T618-D1082 VanDerWaalsContact CG2-O 3.3Å; T618-D1082 WeakPolarHBondContact CG2-O 3.21Å; T618-D1082 PolarHBondContact OG1-O 3.24Å
619	G	95.6	Very high	95.8	Very high	36 Å²	36	25.1 Å²	25.1	37%	0.371	15%	0.147	S	C	.	.	S	Bend	trans	67.3	-6.9	-173.8	0	0	0	0	0	115.3
620	K	96.5	Very high	95.7	Very high	78 Å²	78	25 Å²	25	34%	0.339	14%	0.144	S	C	.	.			trans	-91	116.9	176.7	-62.2	-174	-172.1	177.1	0	110.1	T618 D1080 D1082 I1083 G1084	T618-K620 PolarHBondContact O-N 3.15Å; T618-K620 PolarHBondContact OG1-N 2.89Å; K620-D1080 IonicContact NZ-OD1 3.43Å; K620-D1080 PolarHBondContact NZ-OD1 2.95Å; K620-D1080 IonicContact NZ-OD2 2.92Å; K620-D1080 PolarHBondContact NZ-OD2 3.22Å; K620-D1082 HydrophobicContact CD-CB 3.73Å; K620-D1082 IonicContact NZ-OD2 3.82Å; K620-I1083 HydrophobicContact CB-CG1 4.08Å; K620-I1083 HydrophobicContact CD-CG1 4.03Å; K620-G1084 PolarHBondContact O-N 3.37Å
621	E	96.8	Very high	95.6	Very high	58 Å²	58	25.2 Å²	25.2	27%	0.271	15%	0.146	S	C	.	.			trans	-77.7	119.6	-177.2	-172.3	-171.3	-179.8	0	0	112.9	K623 A816 P854 L855 L1104	E621-K623 HydrophobicContact CG-CD 4.23Å; E621-K623 HydrophobicContact CG-CG 4.45Å; E621-K623 PolarHBondContact O-N 3.03Å; E621-K623 IonicContact OE1-NZ 2.78Å; E621-K623 VanDerWaalsContact OE2-CE 3.25Å; E621-K623 WeakPolarHBondContact OE2-CE 3.32Å; E621-K623 IonicContact OE2-NZ 3.16Å; E621-K623 PolarHBondContact OE2-NZ 2.76Å; E621-A816 WeakPolarHBondContact OE1-CB 3.37Å; E621-P854 WeakPolarHBondContact CA-O 3.45Å; E621-P854 HydrophobicContact CG-CB 3.96Å; E621-L855 HydrophobicContact CB-CD2 3.91Å; E621-L855 HydrophobicContact CG-CD2 4.5Å; E621-L1104 HydrophobicContact CG-CD2 4.14Å
622	G	95.4	Very high	95.5	Very high	1 Å²	1	25 Å²	25	1%	0.01	15%	0.145	C	C	.	.			trans	-72.2	110.7	167.9	0	0	0	0	0	112.7	P854 N1077 G1084	G622-P854 PolarHBondContact N-O 2.9Å; G622-N1077 WeakPolarHBondContact CA-OD1 3.31Å; G622-G1084 VanDerWaalsContact CA-O 3.22Å; G622-G1084 WeakPolarHBondContact CA-O 3.47Å
623	K	94.3	Very high	95.5	Very high	55 Å²	55	26.8 Å²	26.8	24%	0.239	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-151.1	148.8	177.4	57.5	-176	169.2	-165.6	0	111.9	E621 C628 E702 N1077	E621-K623 HydrophobicContact CG-CD 4.23Å; E621-K623 HydrophobicContact CG-CG 4.45Å; E621-K623 PolarHBondContact O-N 3.03Å; E621-K623 IonicContact OE1-NZ 2.78Å; E621-K623 VanDerWaalsContact OE2-CE 3.25Å; E621-K623 WeakPolarHBondContact OE2-CE 3.32Å; E621-K623 IonicContact OE2-NZ 3.16Å; E621-K623 PolarHBondContact OE2-NZ 2.76Å; K623-C628 WeakPolarHBondContact CA-O 3.31Å; K623-E702 IonicContact NZ-OE2 2.73Å; K623-N1077 PolarHBondContact N-OD1 2.86Å; K623-N1077 PolarHBondContact O-ND2 3.09Å; K623-N1077 PolarHBondContact O-OD1 2.89Å
624	S	92.2	Very high	95.5	Very high	10 Å²	10	26.9 Å²	26.9	7%	0.07	15%	0.152	C	C	.	.			trans	-64.5	165.8	175.4	90.3	0	0	0	0	111.2	Q626 G627 C628 S1072 D1073	S624-Q626 PolarHBondContact O-N 2.8Å; S624-Q626 PolarHBondContact OG-N 3.33Å; S624-G627 PolarHBondContact O-N 3.1Å; S624-C628 PolarHBondContact N-O 3.01Å; S624-S1072 WeakPolarHBondContact CB-OG 3.28Å; S624-S1072 PolarHBondContact OG-OG 2.95Å; S624-D1073 WeakPolarHBondContact CB-O 3.41Å
625	S	89.5	Confident	95.5	Very high	51 Å²	51	26.5 Å²	26.5	36%	0.357	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-7.7	177.1	52.5	0	0	0	0	115	D1073	S625-D1073 WeakPolarHBondContact CB-OD2 3.25Å; S625-D1073 PolarHBondContact N-O 2.87Å; S625-D1073 PolarHBondContact OG-N 3.09Å; S625-D1073 PolarHBondContact OG-O 3.09Å; S625-D1073 PolarHBondContact OG-OD2 3.03Å
626	Q	89.8	Confident	95.5	Very high	38 Å²	38	28 Å²	28	18%	0.178	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	7.5	172.3	-57.4	-56.7	-39.2	0	0	113.3	S624 N701 L891	S624-Q626 PolarHBondContact O-N 2.8Å; S624-Q626 PolarHBondContact OG-N 3.33Å; Q626-N701 WeakPolarHBondContact O-CB 3.31Å; Q626-N701 PolarHBondContact O-ND2 3.31Å; Q626-L891 HydrophobicContact CG-CD2 4.47Å; Q626-L891 VanDerWaalsContact OE1-CD1 3.29Å
627	G	92.6	Very high	95.4	Very high	20 Å²	20	26.5 Å²	26.5	21%	0.206	14%	0.144	C	C	.	.	S	Bend	trans	73.7	22.8	-178	0	0	0	0	0	114.5	S624	S624-G627 PolarHBondContact O-N 3.1Å
628	C	94.6	Very high	95.2	Very high	7 Å²	7	25.5 Å²	25.5	5%	0.047	14%	0.144	C	C	.	.			trans	-97.2	150.1	-177.7	-58	0	0	0	0	111.8	K623 S624	K623-C628 WeakPolarHBondContact CA-O 3.31Å; S624-C628 PolarHBondContact N-O 3.01Å
629	P	95.8	Very high	95.1	Very high	11 Å²	11	25.4 Å²	25.4	7%	0.071	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-59.6	137.6	179	-26.2	36.1	0	0	0	113.8	A1106	P629-A1106 HydrophobicContact CB-CB 3.92Å; P629-A1106 HydrophobicContact CG-CB 3.88Å
630	I	94.8	Very high	95	Very high	13 Å²	13	29.9 Å²	29.9	7%	0.067	16%	0.156	C	C	.	.			trans	-128.7	167.8	170.8	64.6	170.8	0	0	0	109.9	V852 N1077	I630-V852 WeakPolarHBondContact O-CG1 3.43Å; I630-N1077 HydrophobicContact CD1-CB 3.52Å; I630-N1077 WeakPolarHBondContact CD1-OD1 3.46Å
631	A	96	Very high	95	Very high	6 Å²	6	31.6 Å²	31.6	5%	0.05	17%	0.166	C	C	.	.			trans	-121.7	146.1	164.1	0	0	0	0	0	109.1	V634 L850 L882 A1087	A631-V634 HydrophobicContact CB-CG2 4.38Å; A631-L850 HydrophobicContact CB-CD1 3.94Å; A631-L882 HydrophobicContact CB-CD1 3.87Å; A631-L882 VanDerWaalsContact O-CD1 3.31Å; A631-L882 WeakPolarHBondContact O-CD1 3.34Å; A631-A1087 HydrophobicContact CB-CB 3.69Å
632	K	96.6	Very high	95.1	Very high	9 Å²	9	29.3 Å²	29.3	4%	0.039	16%	0.155	C	C	.	.	S	Bend	trans	-107.1	-31.3	169.7	-73.3	178.8	65.1	173.9	0	111.6	L882 N1077 F1078 D1080 I1083 G1084 G1085	K632-L882 WeakPolarHBondContact O-CB 3.34Å; K632-L882 PolarHBondContact O-N 3.13Å; K632-N1077 WeakPolarHBondContact CD-O 3.18Å; K632-N1077 WeakPolarHBondContact CE-O 3.5Å; K632-N1077 PolarHBondContact NZ-O 3.33Å; K632-F1078 HydrophobicContact CB-CE1 4.15Å; K632-F1078 HydrophobicContact CG-CD1 4.22Å; K632-F1078 HydrophobicContact CG-CE1 3.79Å; K632-F1078 HydrophobicContact CG-CE2 4.4Å; K632-F1078 HydrophobicContact CG-CZ 3.9Å; K632-D1080 PolarHBondContact NZ-O 3.08Å; K632-I1083 HydrophobicContact CD-CG2 4.35Å; K632-I1083 VanDerWaalsContact CD-O 3.26Å; K632-I1083 WeakPolarHBondContact CD-O 3.49Å; K632-I1083 WeakPolarHBondContact CE-O 3.4Å; K632-I1083 PolarHBondContact NZ-O 2.79Å; K632-G1084 WeakPolarHBondContact CD-O 3.18Å; K632-G1085 PolarHBondContact N-O 2.91Å
633	W	97.9	Very high	95.2	Very high	37 Å²	37	31.7 Å²	31.7	14%	0.14	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.5	177.4	-57.8	-87.7	0	0	0	109.8	K857 I858 L879 H880 G1085 V1086 A1087	W633-K857 HydrophobicContact CE3-CB 4.45Å; W633-K857 HydrophobicContact CH2-CB 3.46Å; W633-K857 VanDerWaalsContact CH2-CB 3.46Å; W633-K857 HydrophobicContact CZ2-CB 4.23Å; W633-K857 HydrophobicContact CZ3-CB 3.6Å; W633-I858 HydrophobicContact CB-CD1 4.22Å; W633-I858 HydrophobicContact CB-CG1 3.51Å; W633-I858 HydrophobicContact CD2-CB 4.37Å; W633-I858 HydrophobicContact CD2-CG1 3.85Å; W633-I858 HydrophobicContact CE3-CG1 4.43Å; W633-I858 HydrophobicContact CG-CB 4.22Å; W633-I858 HydrophobicContact CG-CG1 3.4Å; W633-L879 HydrophobicContact CB-CD1 4.19Å; W633-H880 CarbonylContact C-O 3.48Å; W633-H880 WeakPolarHBondContact CA-O 3.35Å; W633-G1085 PolarHBondContact N-O 3.39Å; W633-V1086 HydrophobicContact CE3-CG2 4.22Å; W633-A1087 WeakPolarHBondContact O-CA 3.41Å; W633-A1087 WeakPolarHBondContact O-CB 3.46Å; W633-A1087 PolarHBondContact O-N 3.28Å
634	V	98.3	Very high	95.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	110.6	177.1	-165.6	0	0	0	0	110.2	A631 R636 L850 H880 L882 A1087 A1089	A631-V634 HydrophobicContact CB-CG2 4.38Å; V634-R636 HydrophobicContact CG1-CG 4.18Å; V634-L850 HydrophobicContact CB-CD1 4.4Å; V634-L850 HydrophobicContact CG1-CD1 3.9Å; V634-L850 HydrophobicContact CG1-CD2 3.68Å; V634-L850 HydrophobicContact CG1-CG 4.42Å; V634-L850 HydrophobicContact CG2-CD1 3.57Å; V634-H880 HydrophobicContact CB-CB 4.2Å; V634-H880 PolarHBondContact N-O 3.27Å; V634-H880 PolarHBondContact O-N 3.35Å; V634-L882 HydrophobicContact CG2-CD1 3.64Å; V634-L882 HydrophobicContact CG2-CD2 4.5Å; V634-L882 HydrophobicContact CG2-CG 4.08Å; V634-A1087 WeakPolarHBondContact CA-O 3.3Å; V634-A1089 HydrophobicContact CG1-CB 3.97Å
635	I	98.4	Very high	95.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	123.4	172.3	-57.1	167.3	0	0	0	108	E613 L645 L647 I858 L879 V1086 A1087 V1088 A1089	E613-I635 HydrophobicContact CB-CD1 4.3Å; E613-I635 HydrophobicContact CG-CD1 4.22Å; E613-I635 HydrophobicContact CG-CG2 4.5Å; I635-L645 HydrophobicContact CB-CD2 4.43Å; I635-L645 HydrophobicContact CG2-CD1 4.06Å; I635-L645 HydrophobicContact CG2-CD2 3.57Å; I635-L645 HydrophobicContact CG2-CG 4.48Å; I635-L647 HydrophobicContact CD1-CD2 3.53Å; I635-I858 HydrophobicContact CD1-CD1 3.94Å; I635-I858 HydrophobicContact CG1-CD1 4.12Å; I635-L879 HydrophobicContact CG1-CD1 4.1Å; I635-V1086 HydrophobicContact CD1-CG1 3.97Å; I635-A1087 PolarHBondContact N-O 3.4Å; I635-V1088 HydrophobicContact CB-CG1 4.25Å; I635-V1088 HydrophobicContact CD1-CG1 4.45Å; I635-A1089 PolarHBondContact O-N 3.23Å; I635-A1089 VanDerWaalsContact O-N 3.1Å
636	R	97.1	Very high	96.1	Very high	33 Å²	33	26.2 Å²	26.2	13%	0.125	13%	0.133	C	C	.	.			trans	-121.7	151.9	-179.7	-60.8	-174.6	-177.3	-85.1	1.6	110	R611 V634 G638 E848 A878 A1089	R611-R636 PolarHBondContact NH1-O 3.39Å; V634-R636 HydrophobicContact CG1-CG 4.18Å; R636-G638 PolarHBondContact O-N 2.8Å; R636-G638 VanDerWaalsContact O-N 3.15Å; R636-E848 IonicContact CZ-OE1 2.78Å; R636-E848 VanDerWaalsContact NH1-CD 3.3Å; R636-E848 IonicContact NH1-OE1 2.89Å; R636-E848 PolarHBondContact NH1-OE1 3Å; R636-E848 IonicContact NH1-OE2 2.7Å; R636-E848 PolarHBondContact NH1-OE2 3.4Å; R636-E848 IonicContact NH2-OE1 3.9Å; R636-E848 PolarHBondContact NH2-OE1 3.43Å; R636-A878 PolarHBondContact N-O 2.89Å; R636-A878 VanDerWaalsContact O-O 3.1Å; R636-A1089 HydrophobicContact CG-CB 4.27Å
637	R	97	Very high	96.5	Very high	24 Å²	24	24.4 Å²	24.4	9%	0.091	13%	0.125	C	C	.	.			trans	-56.9	115.2	174	-170.8	176.9	-171	-172.1	1	110.2	S639 E640 E642 W668 E669 V841	R637-S639 WeakPolarHBondContact CG-O 3.47Å; R637-S639 PolarHBondContact NE-O 2.81Å; R637-E640 PolarHBondContact NH2-O 2.81Å; R637-E642 HydrophobicContact CG-CB 4.47Å; R637-E642 PolarHBondContact NE-O 2.81Å; R637-E642 PolarHBondContact NH2-O 3.35Å; R637-W668 HydrophobicContact CB-CD2 3.78Å; R637-W668 HydrophobicContact CB-CE3 3.93Å; R637-W668 HydrophobicContact CB-CG 4.41Å; R637-W668 HydrophobicContact CB-CH2 3.88Å; R637-W668 HydrophobicContact CB-CZ2 3.72Å; R637-W668 HydrophobicContact CB-CZ3 3.96Å; R637-W668 HydrophobicContact CG-CD2 3.8Å; R637-W668 HydrophobicContact CG-CE3 4.33Å; R637-W668 HydrophobicContact CG-CG 3.89Å; R637-W668 HydrophobicContact CG-CZ2 4.37Å; R637-E669 IonicContact CZ-OE1 2.66Å; R637-E669 VanDerWaalsContact CZ-OE1 3.24Å; R637-E669 IonicContact NH1-OE1 3.49Å; R637-E669 PolarHBondContact NH1-OE1 3.15Å; R637-E669 IonicContact NH2-OE1 2.8Å; R637-E669 PolarHBondContact NH2-OE1 3.43Å; R637-V841 HydrophobicContact CG-CG1 4.22Å
638	G	92.4	Very high	96.8	Very high	15 Å²	15	23.5 Å²	23.5	16%	0.155	12%	0.115	C	C	.	.			trans	-72.5	-34.4	-173.8	0	0	0	0	0	113.7	R636 E642 R842	R636-G638 PolarHBondContact O-N 2.8Å; R636-G638 VanDerWaalsContact O-N 3.15Å; G638-E642 WeakPolarHBondContact CA-OE2 3.43Å; G638-E642 PolarHBondContact N-OE2 3.43Å; G638-R842 VanDerWaalsContact O-CZ 3.22Å; G638-R842 PolarHBondContact O-NE 2.86Å; G638-R842 PolarHBondContact O-NH2 2.89Å
639	S	94.9	Very high	97	Very high	30 Å²	30	23.1 Å²	23.1	21%	0.21	11%	0.113	C	C	.	.			trans	-157.5	172.4	180	63.7	0	0	0	0	111.2	R637 E641 E642	R637-S639 WeakPolarHBondContact CG-O 3.47Å; R637-S639 PolarHBondContact NE-O 2.81Å; S639-E641 PolarHBondContact O-N 2.84Å; S639-E641 WeakPolarHBondContact OG-CB 3.48Å; S639-E641 PolarHBondContact OG-N 2.84Å; S639-E642 PolarHBondContact O-N 3.17Å; S639-E642 PolarHBondContact OG-N 2.72Å
640	E	94.8	Very high	97	Very high	130 Å²	130	27.6 Å²	27.6	61%	0.607	13%	0.133	S	C	*	.	S	Bend	trans	-73.4	-15.8	169.7	-59.6	-165.6	156.4	0	0	112.8	R637 K643 V841	R637-E640 PolarHBondContact NH2-O 2.81Å; E640-K643 VanDerWaalsContact O-CE 3.28Å; E640-K643 WeakPolarHBondContact O-CE 3.11Å; E640-K643 PolarHBondContact O-NZ 2.87Å; E640-V841 HydrophobicContact CG-CB 4.06Å; E640-V841 HydrophobicContact CG-CG1 4.15Å; E640-V841 HydrophobicContact CG-CG2 4.04Å
641	E	96.3	Very high	97	Very high	115 Å²	115	27.3 Å²	27.3	54%	0.537	13%	0.131	S	C	.	.	S	Bend	trans	-67.9	-42.8	168.5	-58.1	170.9	-161.1	0	0	110.9	N608 A609 S639 K643	N608-E641 HydrophobicContact CB-CB 4.38Å; N608-E641 WeakPolarHBondContact CB-OE2 3.49Å; N608-E641 PolarHBondContact ND2-OE2 2.87Å; A609-E641 WeakPolarHBondContact CA-O 3.48Å; S639-E641 PolarHBondContact O-N 2.84Å; S639-E641 WeakPolarHBondContact OG-CB 3.48Å; S639-E641 PolarHBondContact OG-N 2.84Å; E641-K643 WeakPolarHBondContact O-CG 3.33Å; E641-K643 PolarHBondContact O-N 2.81Å
642	E	97.4	Very high	96.9	Very high	9 Å²	9	31.3 Å²	31.3	4%	0.042	16%	0.156	C	C	.	.			trans	-61.3	108.4	178	-169.1	-169.1	139.6	0	0	109.3	N608 R611 R637 G638 S639 W668	N608-E642 WeakPolarHBondContact O-CA 3.39Å; R611-E642 HydrophobicContact CB-CG 4.07Å; R611-E642 VanDerWaalsContact CD-CD 3.41Å; R611-E642 WeakPolarHBondContact CD-OE1 3.21Å; R611-E642 WeakPolarHBondContact CD-OE2 3.35Å; R611-E642 IonicContact CZ-OE2 2.8Å; R611-E642 IonicContact NH1-OE1 3.98Å; R611-E642 IonicContact NH1-OE2 3.82Å; R611-E642 PolarHBondContact NH1-OE2 3.1Å; R637-E642 HydrophobicContact CG-CB 4.47Å; R637-E642 PolarHBondContact NE-O 2.81Å; R637-E642 PolarHBondContact NH2-O 3.35Å; G638-E642 WeakPolarHBondContact CA-OE2 3.43Å; G638-E642 PolarHBondContact N-OE2 3.43Å; S639-E642 PolarHBondContact O-N 3.17Å; S639-E642 PolarHBondContact OG-N 2.72Å; E642-W668 VanDerWaalsContact O-CD1 3.29Å; E642-W668 PolarHBondContact OE1-NE1 3.38Å
643	K	97.9	Very high	96.7	Very high	52 Å²	52	33.5 Å²	33.5	23%	0.226	18%	0.182	C	C	.	.			trans	-102.3	-32.2	-179.2	-58.1	-46	-168.2	178.2	0	113	Y603 A609 E640 E641 W668 E669	Y603-K643 HydrophobicContact CE1-CB 3.7Å; Y603-K643 HydrophobicContact CE1-CG 4.14Å; Y603-K643 VanDerWaalsContact OH-CB 3.31Å; Y603-K643 WeakPolarHBondContact OH-CB 3.44Å; A609-K643 HydrophobicContact CB-CG 4.5Å; A609-K643 PolarHBondContact O-N 2.75Å; E640-K643 VanDerWaalsContact O-CE 3.28Å; E640-K643 WeakPolarHBondContact O-CE 3.11Å; E640-K643 PolarHBondContact O-NZ 2.87Å; E641-K643 WeakPolarHBondContact O-CG 3.33Å; E641-K643 PolarHBondContact O-N 2.81Å; K643-W668 PolarHBondContact O-N 3.21Å; K643-E669 WeakPolarHBondContact CD-OE2 3.46Å; K643-E669 WeakPolarHBondContact CE-OE2 3.26Å; K643-E669 IonicContact NZ-OE1 2.83Å; K643-E669 PolarHBondContact NZ-OE1 2.89Å; K643-E669 IonicContact NZ-OE2 2.99Å; K643-E669 PolarHBondContact NZ-OE2 2.95Å
644	L	98.6	Very high	96.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126	-175.9	-167.1	75.9	0	0	0	111.2	M599 Y603 A609 V610 R611 I665 L666 A667 L775	M599-L644 HydrophobicContact CB-CD2 4.39Å; M599-L644 HydrophobicContact CE-CD2 3.8Å; Y603-L644 HydrophobicContact CD2-CB 4.45Å; Y603-L644 HydrophobicContact CD2-CD1 4.4Å; Y603-L644 HydrophobicContact CD2-CD2 4.35Å; Y603-L644 HydrophobicContact CG-CB 4.49Å; Y603-L644 HydrophobicContact CG-CD2 4.28Å; A609-L644 PolarHBondContact O-N 3.39Å; V610-L644 CarbonylContact C-O 3.27Å; V610-L644 WeakPolarHBondContact CA-O 3.44Å; V610-L644 HydrophobicContact CG1-CD2 4.45Å; V610-L644 HydrophobicContact CG2-CB 4.33Å; V610-L644 HydrophobicContact CG2-CD2 4.38Å; R611-L644 PolarHBondContact N-O 2.95Å; L644-I665 HydrophobicContact CD1-CG2 3.68Å; L644-I665 HydrophobicContact CG-CG2 4.28Å; L644-L666 WeakPolarHBondContact CA-O 3.17Å; L644-A667 HydrophobicContact CD1-CB 4.02Å; L644-L775 HydrophobicContact CD1-CD1 4.07Å; L644-L775 HydrophobicContact CD1-CD2 3.8Å; L644-L775 HydrophobicContact CD2-CD2 4.05Å
645	L	98.8	Very high	96.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.1	166.7	170	70.4	0	0	0	109.5	R611 E613 I635 L647 L666 W668 V1088	R611-L645 HydrophobicContact CB-CD1 4.46Å; R611-L645 HydrophobicContact CG-CD1 4.06Å; R611-L645 CarbonylContact O-C 3.56Å; R611-L645 WeakPolarHBondContact O-CA 3.31Å; E613-L645 HydrophobicContact CB-CD1 4.4Å; E613-L645 HydrophobicContact CG-CD1 3.72Å; I635-L645 HydrophobicContact CB-CD2 4.43Å; I635-L645 HydrophobicContact CG2-CD1 4.06Å; I635-L645 HydrophobicContact CG2-CD2 3.57Å; I635-L645 HydrophobicContact CG2-CG 4.48Å; L645-L647 HydrophobicContact CD1-CD2 4.07Å; L645-L647 HydrophobicContact CD2-CD2 4.15Å; L645-L647 HydrophobicContact CG-CD2 4.11Å; L645-L666 HydrophobicContact CB-CB 4.22Å; L645-L666 HydrophobicContact CD2-CB 4.48Å; L645-L666 HydrophobicContact CD2-CD2 4.12Å; L645-L666 PolarHBondContact N-O 2.68Å; L645-L666 PolarHBondContact O-N 3.4Å; L645-W668 HydrophobicContact CB-CZ2 4.32Å; L645-W668 HydrophobicContact CD2-CZ2 4.15Å; L645-V1088 HydrophobicContact CD2-CG1 3.91Å
646	C	98.6	Very high	96.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	120.6	174.7	-175.4	0	0	0	0	110.2	M599 R611 V612 E613	M599-C646 HydrophobicContact CG-CB 4.41Å; R611-C646 PolarHBondContact O-N 3.17Å; V612-C646 WeakPolarHBondContact CA-O 3.4Å; V612-C646 HydrophobicContact CG2-CB 4.41Å; E613-C646 PolarHBondContact N-O 2.95Å
647	L	98.8	Very high	96.1	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	129.7	172.4	-49.9	-171.3	0	0	0	109.6	E613 I635 L645 I663 L664 L853 V1086 V1088	E613-L647 HydrophobicContact CB-CD2 3.79Å; E613-L647 HydrophobicContact CG-CD2 4.41Å; E613-L647 WeakPolarHBondContact O-CA 3.37Å; I635-L647 HydrophobicContact CD1-CD2 3.53Å; L645-L647 HydrophobicContact CD1-CD2 4.07Å; L645-L647 HydrophobicContact CD2-CD2 4.15Å; L645-L647 HydrophobicContact CG-CD2 4.11Å; L647-I663 HydrophobicContact CB-CG1 3.95Å; L647-I663 PolarHBondContact O-N 3.46Å; L647-L664 HydrophobicContact CB-CB 4.12Å; L647-L664 HydrophobicContact CD1-CB 4.02Å; L647-L664 HydrophobicContact CD1-CD1 4.17Å; L647-L664 HydrophobicContact CD1-CD2 4.09Å; L647-L664 HydrophobicContact CD1-CG 4.34Å; L647-L664 HydrophobicContact CG-CB 4.07Å; L647-L664 HydrophobicContact CG-CD2 4.04Å; L647-L664 PolarHBondContact N-O 3.14Å; L647-L853 HydrophobicContact CD1-CD1 4Å; L647-V1086 HydrophobicContact CD1-CG1 4.44Å; L647-V1088 HydrophobicContact CD1-CG1 4.21Å
648	V	98.7	Very high	96	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.6	-177.4	-58.2	0	0	0	0	112.3	V592 V595 V612 E613 V614 V615 V660 L661 V662	V592-V648 HydrophobicContact CG1-CG2 4.5Å; V592-V648 HydrophobicContact CG2-CG2 4.41Å; V595-V648 HydrophobicContact CG1-CG1 3.66Å; V612-V648 HydrophobicContact CG1-CB 4.26Å; V612-V648 HydrophobicContact CG1-CG1 3.64Å; V612-V648 HydrophobicContact CG1-CG2 3.57Å; E613-V648 PolarHBondContact O-N 2.78Å; V614-V648 HydrophobicContact CG2-CG2 4.03Å; V615-V648 WeakPolarHBondContact CG2-O 3.46Å; V615-V648 PolarHBondContact N-O 2.8Å; V648-V660 HydrophobicContact CB-CG1 3.84Å; V648-V660 HydrophobicContact CG1-CG1 4.5Å; V648-V660 HydrophobicContact CG2-CG1 4.11Å; V648-L661 CarbonylContact C-O 3.55Å; V648-L661 VanDerWaalsContact CA-O 3.25Å; V648-L661 WeakPolarHBondContact CA-O 3.4Å; V648-V662 HydrophobicContact CG1-CG2 4.38Å
649	R	97.8	Very high	96.3	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	116.7	170.8	-179	172.3	75.8	82	-4.3	108.4	E579 G580 P581 V660 L661 I663 Y856	E579-R649 VanDerWaalsContact C-NH1 3.28Å; E579-R649 WeakPolarHBondContact O-CD 3.47Å; E579-R649 PolarHBondContact O-NH1 3.35Å; E579-R649 IonicContact OE1-CZ 2.9Å; E579-R649 IonicContact OE1-NH1 2.77Å; E579-R649 PolarHBondContact OE1-NH1 2.99Å; E579-R649 IonicContact OE1-NH2 3.52Å; E579-R649 PolarHBondContact OE1-NH2 3.45Å; G580-R649 PolarHBondContact O-NH2 2.89Å; P581-R649 PolarHBondContact O-NH2 3.1Å; R649-V660 WeakPolarHBondContact O-CA 3.14Å; R649-L661 PolarHBondContact N-O 3.49Å; R649-L661 PolarHBondContact O-N 3.3Å; R649-I663 HydrophobicContact CB-CG2 3.85Å; R649-Y856 HydrophobicContact CB-CE1 4.4Å; R649-Y856 HydrophobicContact CG-CE1 4.36Å
650	Q	96.3	Very high	96.4	Very high	104 Å²	104	45.2 Å²	45.2	49%	0.486	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	131	161.7	-57.8	-173.1	26	0	0	107.8	V592 V614 V660	V592-Q650 HydrophobicContact CG2-CG 4.22Å; V592-Q650 VanDerWaalsContact CG2-NE2 3.29Å; V614-Q650 HydrophobicContact CG1-CG 4.05Å; Q650-V660 HydrophobicContact CG-CG1 4.38Å; Q650-V660 HydrophobicContact CG-CG2 4.01Å
651	R	94.9	Very high	96.6	Very high	8 Å²	8	39 Å²	39	3%	0.03	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-87.3	121.3	-177.8	-53.9	167.4	63.3	-153.1	-5	109.1	E579 G653 H654 T658 A659 L661	E579-R651 IonicContact OE1-CZ 3.58Å; E579-R651 IonicContact OE1-NE 3.39Å; E579-R651 PolarHBondContact OE1-NE 3.19Å; E579-R651 IonicContact OE1-NH2 2.92Å; E579-R651 IonicContact OE2-CZ 3.51Å; E579-R651 IonicContact OE2-NE 3.71Å; E579-R651 PolarHBondContact OE2-NE 2.93Å; E579-R651 IonicContact OE2-NH2 3.76Å; E579-R651 PolarHBondContact OE2-NH2 3.04Å; R651-G653 PolarHBondContact O-N 3.36Å; R651-H654 HydrophobicContact CB-CB 3.99Å; R651-H654 WeakPolarHBondContact CB-CD2 3.38Å; R651-H654 VanDerWaalsContact CZ-CE1 3.45Å; R651-H654 PolarHBondContact NH1-ND1 3.4Å; R651-H654 PolarHBondContact NH2-CE1 3.39Å; R651-H654 PolarHBondContact NH2-ND1 2.93Å; R651-H654 PolarHBondContact NH2-NE2 3.28Å; R651-H654 PolarHBondContact O-N 3.46Å; R651-T658 WeakPolarHBondContact CD-O 3.49Å; R651-T658 PolarHBondContact NH1-O 2.91Å; R651-T658 PolarHBondContact NH1-OG1 3.35Å; R651-A659 WeakPolarHBondContact CB-O 3.37Å; R651-A659 VanDerWaalsContact CG-O 3.28Å; R651-A659 WeakPolarHBondContact CG-O 3.32Å; R651-A659 PolarHBondContact N-O 2.75Å; R651-L661 HydrophobicContact CG-CD1 4.22Å; R651-L661 HydrophobicContact CG-CG 4.17Å
652	P	92.6	Very high	96.7	Very high	89 Å²	89	33.6 Å²	33.6	58%	0.578	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.3	128.6	-178.5	-27.1	35.7	0	0	0	112.8	H654	P652-H654 VanDerWaalsContact C-N 3.33Å; P652-H654 PolarHBondContact O-CD2 3.09Å; P652-H654 PolarHBondContact O-N 2.95Å
653	G	92.3	Very high	96.8	Very high	56 Å²	56	33.2 Å²	33.2	58%	0.577	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.9	-2	179.2	0	0	0	0	0	116.2	R651	R651-G653 PolarHBondContact O-N 3.36Å
654	H	94.7	Very high	96.8	Very high	23 Å²	23	30.8 Å²	30.8	11%	0.106	17%	0.171	C	C	.	.			trans	-95.2	142.2	-177.2	-65.9	-88.3	0	0	0	113.7	C568 C570 V571 E579 R651 P652 A659	C568-H654 PolarHBondContact SG-CE1 3.31Å; C568-H654 PolarHBondContact SG-ND1 2.75Å; C568-H654 VanDerWaalsContact SG-ND1 3.42Å; C570-H654 HydrophobicContact CB-CB 4.42Å; V571-H654 VanDerWaalsContact CG2-CE1 3.41Å; V571-H654 WeakPolarHBondContact CG2-CE1 3.39Å; E579-H654 IonicContact OE2-CD2 3.67Å; E579-H654 IonicContact OE2-CE1 2.89Å; E579-H654 IonicContact OE2-NE2 2.66Å; E579-H654 PolarHBondContact OE2-NE2 3.47Å; R651-H654 HydrophobicContact CB-CB 3.99Å; R651-H654 WeakPolarHBondContact CB-CD2 3.38Å; R651-H654 VanDerWaalsContact CZ-CE1 3.45Å; R651-H654 PolarHBondContact NH1-ND1 3.4Å; R651-H654 PolarHBondContact NH2-CE1 3.39Å; R651-H654 PolarHBondContact NH2-ND1 2.93Å; R651-H654 PolarHBondContact NH2-NE2 3.28Å; R651-H654 PolarHBondContact O-N 3.46Å; P652-H654 VanDerWaalsContact C-N 3.33Å; P652-H654 PolarHBondContact O-CD2 3.09Å; P652-H654 PolarHBondContact O-N 2.95Å; H654-A659 HydrophobicContact CB-CB 3.87Å; H654-A659 WeakPolarHBondContact O-CB 3.28Å
655	Y	94.7	Very high	96.8	Very high	162 Å²	162	30.8 Å²	30.8	64%	0.635	17%	0.171	S	C	*	.			trans	-139.6	12.7	179.5	56.9	-95	0	0	0	112.9	H569 C570	H569-Y655 PolarHBondContact O-OH 3.36Å; C570-Y655 HydrophobicContact CB-CD1 3.89Å; C570-Y655 HydrophobicContact CB-CE1 3.65Å; C570-Y655 PolarHBondContact SG-N 3.26Å
656	C	95	Very high	96.8	Very high	28 Å²	28	30.8 Å²	30.8	19%	0.189	17%	0.171	C	C	.	.	S	Bend	trans	-85.3	174.6	175.1	56.7	0	0	0	0	112.3	C568 C570 P590 T658 A659	C568-C656 HydrophobicContact CB-CB 4.45Å; C570-C656 PolarHBondContact SG-N 2.94Å; P590-C656 WeakPolarHBondContact CA-O 3.37Å; C656-T658 PolarHBondContact O-N 2.77Å; C656-A659 WeakPolarHBondContact O-CB 2.96Å; C656-A659 PolarHBondContact O-N 3.11Å
657	D	95.7	Very high	96.8	Very high	128 Å²	128	30.9 Å²	30.9	68%	0.684	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-10.3	-179.6	-55	-57.8	0	0	0	115.1	G589	G589-D657 CarbonylContact C-O 3.01Å; G589-D657 WeakPolarHBondContact CA-O 3.33Å; G589-D657 PolarHBondContact N-O 3.07Å
658	T	96	Very high	96.8	Very high	35 Å²	35	31 Å²	31	22%	0.215	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118	25.8	174.2	68.1	0	0	0	0	112.8	Y582 T584 A588 R651 C656 V660 L661	Y582-T658 WeakPolarHBondContact OH-CB 3.45Å; Y582-T658 PolarHBondContact OH-OG1 3.04Å; T584-T658 HydrophobicContact CG2-CG2 3.79Å; A588-T658 HydrophobicContact CB-CG2 4.19Å; R651-T658 WeakPolarHBondContact CD-O 3.49Å; R651-T658 PolarHBondContact NH1-O 2.91Å; R651-T658 PolarHBondContact NH1-OG1 3.35Å; C656-T658 PolarHBondContact O-N 2.77Å; T658-V660 VanDerWaalsContact C-N 3.28Å; T658-V660 PolarHBondContact O-N 2.79Å; T658-L661 WeakPolarHBondContact O-CD2 3.48Å
659	A	96.8	Very high	96.7	Very high	5 Å²	5	35.6 Å²	35.6	4%	0.041	19%	0.194	C	C	.	.	S	Bend	trans	-64.8	-28.3	176.4	0	0	0	0	0	113.6	G589 R651 H654 C656	G589-A659 PolarHBondContact O-N 3.33Å; R651-A659 WeakPolarHBondContact CB-O 3.37Å; R651-A659 VanDerWaalsContact CG-O 3.28Å; R651-A659 WeakPolarHBondContact CG-O 3.32Å; R651-A659 PolarHBondContact N-O 2.75Å; H654-A659 HydrophobicContact CB-CB 3.87Å; H654-A659 WeakPolarHBondContact O-CB 3.28Å; C656-A659 WeakPolarHBondContact O-CB 2.96Å; C656-A659 PolarHBondContact O-N 3.11Å
660	V	98.2	Very high	96.6	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.03	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.8	175.1	-172.4	0	0	0	0	109.5	A588 G589 V592 V595 V648 R649 Q650 T658	A588-V660 CarbonylContact C-O 3.5Å; A588-V660 WeakPolarHBondContact CA-O 3.44Å; G589-V660 PolarHBondContact N-O 3.38Å; G589-V660 WeakPolarHBondContact O-CB 3.44Å; G589-V660 PolarHBondContact O-N 3.41Å; V592-V660 HydrophobicContact CG2-CG1 4.4Å; V595-V660 HydrophobicContact CG2-CB 4.13Å; V595-V660 HydrophobicContact CG2-CG1 4.03Å; V648-V660 HydrophobicContact CB-CG1 3.84Å; V648-V660 HydrophobicContact CG1-CG1 4.5Å; V648-V660 HydrophobicContact CG2-CG1 4.11Å; R649-V660 WeakPolarHBondContact O-CA 3.14Å; Q650-V660 HydrophobicContact CG-CG1 4.38Å; Q650-V660 HydrophobicContact CG-CG2 4.01Å; T658-V660 VanDerWaalsContact C-N 3.28Å; T658-V660 PolarHBondContact O-N 2.79Å
661	L	98.3	Very high	96.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.3	-178.2	-54.1	-179.2	0	0	0	110.9	Y582 T584 A588 V648 R649 R651 T658	Y582-L661 HydrophobicContact CD2-CD1 3.89Å; Y582-L661 HydrophobicContact CE2-CD1 4.33Å; Y582-L661 HydrophobicContact CE2-CD2 4.19Å; T584-L661 HydrophobicContact CG2-CD2 4.13Å; A588-L661 HydrophobicContact CB-CD2 3.72Å; V648-L661 CarbonylContact C-O 3.55Å; V648-L661 VanDerWaalsContact CA-O 3.25Å; V648-L661 WeakPolarHBondContact CA-O 3.4Å; R649-L661 PolarHBondContact N-O 3.49Å; R649-L661 PolarHBondContact O-N 3.3Å; R651-L661 HydrophobicContact CG-CD1 4.22Å; R651-L661 HydrophobicContact CG-CG 4.17Å; T658-L661 WeakPolarHBondContact O-CD2 3.48Å
662	V	98.8	Very high	96.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.4	167.6	177.1	0	0	0	0	108.7	L586 G587 V595 M598 V648 I665	L586-V662 HydrophobicContact CB-CB 4.08Å; L586-V662 HydrophobicContact CB-CG1 3.97Å; L586-V662 WeakPolarHBondContact CB-O 3.43Å; G587-V662 PolarHBondContact O-N 2.92Å; V595-V662 HydrophobicContact CG1-CG2 3.54Å; M598-V662 HydrophobicContact CE-CG2 3.77Å; V648-V662 HydrophobicContact CG1-CG2 4.38Å; V662-I665 HydrophobicContact CG1-CD1 3.99Å; V662-I665 HydrophobicContact CG1-CG1 3.53Å
663	I	98.6	Very high	96.9	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-31.4	179.2	70.3	170.8	0	0	0	113.4	Y583 L586 V615 L647 R649 L853 Y856	Y583-I663 WeakPolarHBondContact OH-CA 3.46Å; Y583-I663 PolarHBondContact OH-O 3.36Å; L586-I663 VanDerWaalsContact CD1-O 3.25Å; L586-I663 WeakPolarHBondContact CD1-O 3.34Å; V615-I663 HydrophobicContact CG2-CD1 3.6Å; V615-I663 HydrophobicContact CG2-CG1 4.41Å; L647-I663 HydrophobicContact CB-CG1 3.95Å; L647-I663 PolarHBondContact O-N 3.46Å; R649-I663 HydrophobicContact CB-CG2 3.85Å; I663-L853 HydrophobicContact CD1-CD1 3.74Å; I663-L853 HydrophobicContact CG1-CD1 4.37Å; I663-Y856 HydrophobicContact CD1-CD1 4.09Å; I663-Y856 HydrophobicContact CD1-CD2 4.49Å; I663-Y856 HydrophobicContact CD1-CE1 3.58Å; I663-Y856 HydrophobicContact CD1-CE2 4.02Å
664	L	98.9	Very high	97.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	134.8	-178.8	-175.3	155.2	0	0	0	110.1	L647 L666 L853 L1096 I1097 E1098	L647-L664 HydrophobicContact CB-CB 4.12Å; L647-L664 HydrophobicContact CD1-CB 4.02Å; L647-L664 HydrophobicContact CD1-CD1 4.17Å; L647-L664 HydrophobicContact CD1-CD2 4.09Å; L647-L664 HydrophobicContact CD1-CG 4.34Å; L647-L664 HydrophobicContact CG-CB 4.07Å; L647-L664 HydrophobicContact CG-CD2 4.04Å; L647-L664 PolarHBondContact N-O 3.14Å; L664-L666 HydrophobicContact CD2-CB 4.1Å; L664-L853 HydrophobicContact CD1-CD1 4.19Å; L664-L1096 HydrophobicContact CD1-CD1 4.1Å; L664-L1096 HydrophobicContact CD1-CD2 4.03Å; L664-L1096 HydrophobicContact CD1-CG 4.12Å; L664-L1096 HydrophobicContact CD2-CG 4.16Å; L664-L1096 HydrophobicContact CG-CD2 4.12Å; L664-L1096 HydrophobicContact CG-CG 4.1Å; L664-I1097 CarbonylContact C-O 3.44Å; L664-I1097 WeakPolarHBondContact CA-O 3.25Å; L664-E1098 HydrophobicContact CB-CB 4.5Å; L664-E1098 HydrophobicContact CD1-CB 4.5Å; L664-E1098 HydrophobicContact CG-CB 4.38Å
665	I	98.9	Very high	97.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.8	172.7	-54.4	162.3	0	0	0	107.7	M599 L644 V662 L775 A776 L1096 I1097	M599-I665 HydrophobicContact CE-CD1 3.82Å; M599-I665 HydrophobicContact CE-CG1 4.04Å; M599-I665 HydrophobicContact CE-CG2 3.96Å; M599-I665 HydrophobicContact SD-CD1 4.44Å; L644-I665 HydrophobicContact CD1-CG2 3.68Å; L644-I665 HydrophobicContact CG-CG2 4.28Å; V662-I665 HydrophobicContact CG1-CD1 3.99Å; V662-I665 HydrophobicContact CG1-CG1 3.53Å; I665-L775 HydrophobicContact CG2-CD1 4.2Å; I665-A776 HydrophobicContact CD1-CB 4.28Å; I665-L1096 CarbonylContact O-C 3.58Å; I665-L1096 WeakPolarHBondContact O-CA 3.45Å; I665-I1097 HydrophobicContact CB-CB 4.31Å; I665-I1097 PolarHBondContact N-O 3.46Å; I665-I1097 PolarHBondContact O-N 3.47Å
666	L	98.9	Very high	97.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	109.9	177.7	174.5	62.4	0	0	0	110	L644 L645 L664 W668 V1088 P1090 I1095 L1096	L644-L666 WeakPolarHBondContact CA-O 3.17Å; L645-L666 HydrophobicContact CB-CB 4.22Å; L645-L666 HydrophobicContact CD2-CB 4.48Å; L645-L666 HydrophobicContact CD2-CD2 4.12Å; L645-L666 PolarHBondContact N-O 2.68Å; L645-L666 PolarHBondContact O-N 3.4Å; L664-L666 HydrophobicContact CD2-CB 4.1Å; L666-W668 HydrophobicContact CD2-CD2 4.36Å; L666-W668 HydrophobicContact CD2-CE3 4.06Å; L666-W668 HydrophobicContact CD2-CH2 3.49Å; L666-W668 VanDerWaalsContact CD2-CH2 3.49Å; L666-W668 HydrophobicContact CD2-CZ2 3.8Å; L666-W668 HydrophobicContact CD2-CZ3 3.64Å; L666-W668 HydrophobicContact CG-CD2 4.4Å; L666-W668 HydrophobicContact CG-CE3 4.33Å; L666-W668 HydrophobicContact CG-CH2 4.5Å; L666-W668 HydrophobicContact CG-CZ3 4.39Å; L666-V1088 HydrophobicContact CD2-CB 4.27Å; L666-V1088 HydrophobicContact CD2-CG2 4.48Å; L666-P1090 HydrophobicContact CD1-CB 4.27Å; L666-I1095 WeakPolarHBondContact CA-O 3.22Å; L666-L1096 HydrophobicContact CD1-CB 3.99Å
667	A	98.6	Very high	97.6	Very high	2 Å²	2	35 Å²	35	2%	0.017	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.7	169.6	0	0	0	0	0	109.1	L644 E669 L771 L775 S1094 I1095	L644-A667 HydrophobicContact CD1-CB 4.02Å; A667-E669 VanDerWaalsContact C-N 3.31Å; A667-E669 PolarHBondContact O-N 3Å; A667-L771 HydrophobicContact CB-CD2 4.47Å; A667-L775 HydrophobicContact CB-CD1 4.05Å; A667-S1094 CarbonylContact O-C 3.57Å; A667-S1094 VanDerWaalsContact O-CA 3.23Å; A667-S1094 WeakPolarHBondContact O-CA 3.45Å; A667-S1094 WeakPolarHBondContact O-CB 3.27Å; A667-I1095 PolarHBondContact N-O 2.89Å; A667-I1095 PolarHBondContact O-N 2.8Å
668	W	98.3	Very high	97.7	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.015	18%	0.177	C	C	.	.	S	Bend	trans	-68.5	-31.7	-177.8	-65.9	118	0	0	0	112.9	R637 E642 K643 L645 L666 A1089 S1091	R637-W668 HydrophobicContact CB-CD2 3.78Å; R637-W668 HydrophobicContact CB-CE3 3.93Å; R637-W668 HydrophobicContact CB-CG 4.41Å; R637-W668 HydrophobicContact CB-CH2 3.88Å; R637-W668 HydrophobicContact CB-CZ2 3.72Å; R637-W668 HydrophobicContact CB-CZ3 3.96Å; R637-W668 HydrophobicContact CG-CD2 3.8Å; R637-W668 HydrophobicContact CG-CE3 4.33Å; R637-W668 HydrophobicContact CG-CG 3.89Å; R637-W668 HydrophobicContact CG-CZ2 4.37Å; E642-W668 VanDerWaalsContact O-CD1 3.29Å; E642-W668 PolarHBondContact OE1-NE1 3.38Å; K643-W668 PolarHBondContact O-N 3.21Å; L645-W668 HydrophobicContact CB-CZ2 4.32Å; L645-W668 HydrophobicContact CD2-CZ2 4.15Å; L666-W668 HydrophobicContact CD2-CD2 4.36Å; L666-W668 HydrophobicContact CD2-CE3 4.06Å; L666-W668 HydrophobicContact CD2-CH2 3.49Å; L666-W668 VanDerWaalsContact CD2-CH2 3.49Å; L666-W668 HydrophobicContact CD2-CZ2 3.8Å; L666-W668 HydrophobicContact CD2-CZ3 3.64Å; L666-W668 HydrophobicContact CG-CD2 4.4Å; L666-W668 HydrophobicContact CG-CE3 4.33Å; L666-W668 HydrophobicContact CG-CH2 4.5Å; L666-W668 HydrophobicContact CG-CZ3 4.39Å; W668-A1089 VanDerWaalsContact CZ3-O 3.29Å; W668-A1089 WeakPolarHBondContact CZ3-O 3.43Å; W668-S1091 PolarHBondContact O-OG 3.03Å
669	E	96.3	Very high	97.8	Very high	96 Å²	96	31.9 Å²	31.9	45%	0.449	17%	0.168	S	C	.	.	S	Bend	trans	-120	71.1	179.8	-72.9	161.6	-157.8	0	0	108.8	R637 K643 A667	R637-E669 IonicContact CZ-OE1 2.66Å; R637-E669 VanDerWaalsContact CZ-OE1 3.24Å; R637-E669 IonicContact NH1-OE1 3.49Å; R637-E669 PolarHBondContact NH1-OE1 3.15Å; R637-E669 IonicContact NH2-OE1 2.8Å; R637-E669 PolarHBondContact NH2-OE1 3.43Å; K643-E669 WeakPolarHBondContact CD-OE2 3.46Å; K643-E669 WeakPolarHBondContact CE-OE2 3.26Å; K643-E669 IonicContact NZ-OE1 2.83Å; K643-E669 PolarHBondContact NZ-OE1 2.89Å; K643-E669 IonicContact NZ-OE2 2.99Å; K643-E669 PolarHBondContact NZ-OE2 2.95Å; A667-E669 VanDerWaalsContact C-N 3.31Å; A667-E669 PolarHBondContact O-N 3Å
670	G	96	Very high	97.9	Very high	17 Å²	17	32.1 Å²	32.1	18%	0.175	17%	0.168	C	C	.	.			trans	-102.3	-22.9	-172.6	0	0	0	0	0	115.5	L771 G1093	G670-L771 WeakPolarHBondContact O-CD2 3.23Å; G670-G1093 PolarHBondContact N-O 2.85Å; G670-G1093 VanDerWaalsContact N-O 3.14Å
671	I	97.8	Very high	97.9	Very high	15 Å²	15	37.7 Å²	37.7	8%	0.077	19%	0.193	C	C	.	.	S	Bend	trans	-130.3	154.9	163	57.5	161.6	0	0	0	111.4	R673 A676 L679 L764 L768 C831 L833 G1093 I1095	I671-R673 PolarHBondContact O-N 2.96Å; I671-A676 HydrophobicContact CD1-CB 3.73Å; I671-A676 HydrophobicContact CG1-CB 4.18Å; I671-L679 HydrophobicContact CD1-CD1 4.25Å; I671-L764 HydrophobicContact CD1-CD1 4.26Å; I671-L764 HydrophobicContact CG2-CD1 3.89Å; I671-L768 HydrophobicContact CG2-CD2 3.69Å; I671-C831 VanDerWaalsContact CD1-SG 3.54Å; I671-L833 HydrophobicContact CD1-CD2 4.23Å; I671-G1093 PolarHBondContact N-O 3.28Å; I671-I1095 HydrophobicContact CG2-CD1 4.22Å
672	P	97.4	Very high	97.8	Very high	81 Å²	81	38.5 Å²	38.5	53%	0.526	20%	0.198	S	C	.	.			trans	-58.6	136.5	177.4	-23.4	34	0	0	0	112	T674 V675 A676	P672-T674 VanDerWaalsContact C-N 3.26Å; P672-T674 PolarHBondContact O-N 2.94Å; P672-V675 HydrophobicContact CB-CB 4.47Å; P672-V675 HydrophobicContact CB-CG2 4.11Å; P672-V675 HydrophobicContact CG-CG2 4.29Å; P672-V675 WeakPolarHBondContact O-CB 3.39Å; P672-V675 PolarHBondContact O-N 3.42Å; P672-A676 PolarHBondContact O-N 2.97Å
673	R	95.8	Very high	97.7	Very high	151 Å²	151	38.6 Å²	38.6	57%	0.57	20%	0.198	S	C	*	.	H	α-helix	trans	-55.9	-39.3	-176.7	-175.6	175.6	176.9	165.5	3.7	112.9	I671 V675 A676 D677	I671-R673 PolarHBondContact O-N 2.96Å; R673-V675 VanDerWaalsContact C-N 3.34Å; R673-V675 PolarHBondContact O-N 3.28Å; R673-A676 WeakPolarHBondContact O-CB 3.47Å; R673-A676 PolarHBondContact O-N 2.78Å; R673-D677 WeakPolarHBondContact CG-OD2 3.33Å; R673-D677 IonicContact NE-OD2 3.79Å; R673-D677 WeakPolarHBondContact O-CB 3.12Å; R673-D677 VanDerWaalsContact O-CG 3.31Å; R673-D677 PolarHBondContact O-N 2.74Å
674	T	96.8	Very high	97.7	Very high	108 Å²	108	39.3 Å²	39.3	66%	0.663	20%	0.203	S	C	*	.	H	α-helix	trans	-61.1	-38.5	175.9	47.8	0	0	0	0	113.4	P672 H678	P672-T674 VanDerWaalsContact C-N 3.26Å; P672-T674 PolarHBondContact O-N 2.94Å; T674-H678 WeakPolarHBondContact O-CB 3.23Å; T674-H678 PolarHBondContact O-N 2.9Å; T674-H678 VanDerWaalsContact O-N 3.08Å
675	V	97.6	Very high	97.5	Very high	50 Å²	50	43.9 Å²	43.9	30%	0.303	22%	0.224	S	C	.	.	H	α-helix	trans	-69.4	-41.7	175.2	178	0	0	0	0	110	P672 R673 H678 L679	P672-V675 HydrophobicContact CB-CB 4.47Å; P672-V675 HydrophobicContact CB-CG2 4.11Å; P672-V675 HydrophobicContact CG-CG2 4.29Å; P672-V675 WeakPolarHBondContact O-CB 3.39Å; P672-V675 PolarHBondContact O-N 3.42Å; R673-V675 VanDerWaalsContact C-N 3.34Å; R673-V675 PolarHBondContact O-N 3.28Å; V675-H678 PolarHBondContact O-N 2.9Å; V675-L679 HydrophobicContact CG1-CD1 3.83Å; V675-L679 HydrophobicContact CG1-CG 4.31Å; V675-L679 VanDerWaalsContact O-CB 3.32Å; V675-L679 WeakPolarHBondContact O-CB 3.42Å; V675-L679 WeakPolarHBondContact O-CG 3.38Å; V675-L679 PolarHBondContact O-N 3.49Å
676	A	98.3	Very high	97.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-43	177	0	0	0	0	0	112.8	I671 P672 R673 Y680 L833 H1092	I671-A676 HydrophobicContact CD1-CB 3.73Å; I671-A676 HydrophobicContact CG1-CB 4.18Å; P672-A676 PolarHBondContact O-N 2.97Å; R673-A676 WeakPolarHBondContact O-CB 3.47Å; R673-A676 PolarHBondContact O-N 2.78Å; A676-Y680 WeakPolarHBondContact O-CB 3.25Å; A676-Y680 PolarHBondContact O-N 2.97Å; A676-L833 HydrophobicContact CB-CD2 3.71Å; A676-H1092 VanDerWaalsContact C-NE2 3.25Å; A676-H1092 VanDerWaalsContact CB-CD2 3.41Å; A676-H1092 WeakPolarHBondContact CB-CD2 3.33Å; A676-H1092 WeakPolarHBondContact CB-NE2 2.94Å
677	D	98.1	Very high	97.1	Very high	37 Å²	37	44.2 Å²	44.2	20%	0.198	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-46	175.9	-75	-44	0	0	0	111	R673 Y680 Q681 R839 H1092	R673-D677 WeakPolarHBondContact CG-OD2 3.33Å; R673-D677 IonicContact NE-OD2 3.79Å; R673-D677 WeakPolarHBondContact O-CB 3.12Å; R673-D677 VanDerWaalsContact O-CG 3.31Å; R673-D677 PolarHBondContact O-N 2.74Å; D677-Y680 PolarHBondContact O-N 3.1Å; D677-Q681 WeakPolarHBondContact O-CG 3.27Å; D677-Q681 PolarHBondContact O-N 2.99Å; D677-R839 IonicContact OD1-CZ 3.09Å; D677-R839 IonicContact OD1-NE 3.86Å; D677-R839 IonicContact OD1-NH1 3.62Å; D677-R839 PolarHBondContact OD1-NH1 3.25Å; D677-H1092 PolarHBondContact N-NE2 3.12Å; D677-H1092 IonicContact OD1-CE1 3.41Å; D677-H1092 IonicContact OD1-NE2 2.67Å
678	H	97.9	Very high	96.9	Very high	92 Å²	92	47.3 Å²	47.3	43%	0.426	24%	0.239	S	C	.	.	H	α-helix	trans	-64.5	-47.8	177.3	174.9	38.4	0	0	0	112.2	T674 V675 Y680 Q681 D682	T674-H678 WeakPolarHBondContact O-CB 3.23Å; T674-H678 PolarHBondContact O-N 2.9Å; T674-H678 VanDerWaalsContact O-N 3.08Å; V675-H678 PolarHBondContact O-N 2.9Å; H678-Y680 VanDerWaalsContact C-N 3.28Å; H678-Y680 PolarHBondContact O-N 2.81Å; H678-Q681 PolarHBondContact O-N 2.95Å; H678-D682 VanDerWaalsContact CE1-CG 3.42Å; H678-D682 IonicContact CE1-OD1 3.12Å; H678-D682 IonicContact CE1-OD2 3.66Å; H678-D682 PolarHBondContact CE1-OD2 2.92Å; H678-D682 IonicContact ND1-OD1 3.14Å; H678-D682 IonicContact ND1-OD2 3.87Å; H678-D682 IonicContact NE2-OD2 2.69Å; H678-D682 WeakPolarHBondContact O-CB 3.37Å; H678-D682 PolarHBondContact O-N 3.03Å
679	L	98.3	Very high	96.6	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-60.2	-37.3	176.3	-74.7	169.6	0	0	0	112.2	I671 V675 L683 N760 L764 L833	I671-L679 HydrophobicContact CD1-CD1 4.25Å; V675-L679 HydrophobicContact CG1-CD1 3.83Å; V675-L679 HydrophobicContact CG1-CG 4.31Å; V675-L679 VanDerWaalsContact O-CB 3.32Å; V675-L679 WeakPolarHBondContact O-CB 3.42Å; V675-L679 WeakPolarHBondContact O-CG 3.38Å; V675-L679 PolarHBondContact O-N 3.49Å; L679-L683 HydrophobicContact CB-CD1 4.46Å; L679-L683 HydrophobicContact CD2-CD1 4.43Å; L679-L683 WeakPolarHBondContact O-CB 3.4Å; L679-L683 WeakPolarHBondContact O-CG 3.17Å; L679-L683 PolarHBondContact O-N 3.18Å; L679-N760 HydrophobicContact CD2-CB 3.91Å; L679-L764 HydrophobicContact CD1-CD1 4.3Å; L679-L764 HydrophobicContact CD1-CD2 3.89Å; L679-L833 HydrophobicContact CB-CD1 3.68Å
680	Y	98.6	Very high	96.6	Very high	10 Å²	10	50.9 Å²	50.9	4%	0.039	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-45.2	177	177.3	-89.9	0	0	0	111.3	A676 D677 H678 T684 L833 H1117 P1118 I1121	A676-Y680 WeakPolarHBondContact O-CB 3.25Å; A676-Y680 PolarHBondContact O-N 2.97Å; D677-Y680 PolarHBondContact O-N 3.1Å; H678-Y680 VanDerWaalsContact C-N 3.28Å; H678-Y680 PolarHBondContact O-N 2.81Å; Y680-T684 VanDerWaalsContact O-CB 3.25Å; Y680-T684 WeakPolarHBondContact O-CB 3.2Å; Y680-T684 PolarHBondContact O-N 3.37Å; Y680-T684 VanDerWaalsContact O-N 3.14Å; Y680-T684 PolarHBondContact O-OG1 3.1Å; Y680-L833 HydrophobicContact CD2-CB 4.1Å; Y680-H1117 PolarHBondContact OH-CD2 2.76Å; Y680-P1118 HydrophobicContact CE2-CG 4.07Å; Y680-P1118 WeakPolarHBondContact CE2-O 3.47Å; Y680-P1118 PolarHBondContact OH-O 2.88Å; Y680-I1121 HydrophobicContact CD2-CD1 4.11Å; Y680-I1121 HydrophobicContact CD2-CG1 4.35Å; Y680-I1121 HydrophobicContact CE2-CD1 4.43Å; Y680-I1121 HydrophobicContact CE2-CG1 4.43Å
681	Q	97.5	Very high	96.4	Very high	121 Å²	121	50.4 Å²	50.4	57%	0.565	25%	0.247	S	C	*	.	H	α-helix	trans	-64.9	-56.3	177.9	-67.8	170.8	-1	0	0	111.2	D677 H678 L683 T684 E685	D677-Q681 WeakPolarHBondContact O-CG 3.27Å; D677-Q681 PolarHBondContact O-N 2.99Å; H678-Q681 PolarHBondContact O-N 2.95Å; Q681-L683 PolarHBondContact O-N 2.81Å; Q681-T684 PolarHBondContact O-N 3.15Å; Q681-E685 PolarHBondContact O-N 3.39Å; Q681-E685 VanDerWaalsContact O-N 3.08Å
682	D	96.5	Very high	96.2	Very high	17 Å²	17	52.4 Å²	52.4	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-57.2	-47.9	-177.4	-97.7	6.5	0	0	0	112.5	H678 E685 T686 K756 N760	H678-D682 VanDerWaalsContact CE1-CG 3.42Å; H678-D682 IonicContact CE1-OD1 3.12Å; H678-D682 IonicContact CE1-OD2 3.66Å; H678-D682 PolarHBondContact CE1-OD2 2.92Å; H678-D682 IonicContact ND1-OD1 3.14Å; H678-D682 IonicContact ND1-OD2 3.87Å; H678-D682 IonicContact NE2-OD2 2.69Å; H678-D682 WeakPolarHBondContact O-CB 3.37Å; H678-D682 PolarHBondContact O-N 3.03Å; D682-E685 PolarHBondContact O-N 3.04Å; D682-T686 WeakPolarHBondContact O-CB 3.01Å; D682-T686 PolarHBondContact O-N 2.85Å; D682-T686 PolarHBondContact O-OG1 2.6Å; D682-K756 VanDerWaalsContact OD1-CE 3.28Å; D682-K756 WeakPolarHBondContact OD1-CE 3.31Å; D682-K756 IonicContact OD1-NZ 3.16Å; D682-K756 PolarHBondContact OD1-NZ 3.02Å; D682-K756 WeakPolarHBondContact OD2-CE 3.43Å; D682-K756 IonicContact OD2-NZ 2.81Å; D682-K756 PolarHBondContact OD2-NZ 2.86Å; D682-N760 PolarHBondContact OD2-ND2 2.93Å
683	L	97.5	Very high	96.1	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-74.4	-31.1	-176.7	-63.3	175.3	0	0	0	112	L679 Q681 L687 I757 L833 I1121 L1123	L679-L683 HydrophobicContact CB-CD1 4.46Å; L679-L683 HydrophobicContact CD2-CD1 4.43Å; L679-L683 WeakPolarHBondContact O-CB 3.4Å; L679-L683 WeakPolarHBondContact O-CG 3.17Å; L679-L683 PolarHBondContact O-N 3.18Å; Q681-L683 PolarHBondContact O-N 2.81Å; L683-L687 HydrophobicContact CB-CD1 4.14Å; L683-L687 WeakPolarHBondContact O-CB 3.28Å; L683-L687 WeakPolarHBondContact O-CG 3.41Å; L683-L687 PolarHBondContact O-N 3.03Å; L683-I757 HydrophobicContact CD2-CD1 3.76Å; L683-I757 HydrophobicContact CD2-CG1 3.77Å; L683-L833 HydrophobicContact CD1-CD1 4.44Å; L683-I1121 HydrophobicContact CB-CD1 4.36Å; L683-L1123 HydrophobicContact CD1-CD1 3.75Å; L683-L1123 HydrophobicContact CD1-CD2 3.69Å; L683-L1123 HydrophobicContact CD1-CG 4.34Å
684	T	97	Very high	95.9	Very high	17 Å²	17	47.6 Å²	47.6	10%	0.104	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-48.2	171.1	-62.1	0	0	0	0	110.3	Y680 Q681 F688 R1116 P1118	Y680-T684 VanDerWaalsContact O-CB 3.25Å; Y680-T684 WeakPolarHBondContact O-CB 3.2Å; Y680-T684 PolarHBondContact O-N 3.37Å; Y680-T684 VanDerWaalsContact O-N 3.14Å; Y680-T684 PolarHBondContact O-OG1 3.1Å; Q681-T684 PolarHBondContact O-N 3.15Å; T684-F688 WeakPolarHBondContact O-CB 3.12Å; T684-F688 PolarHBondContact O-N 2.91Å; T684-F688 VanDerWaalsContact O-N 3.15Å; T684-R1116 VanDerWaalsContact CG2-O 3.25Å; T684-R1116 WeakPolarHBondContact CG2-O 3.32Å; T684-P1118 HydrophobicContact CG2-CG 4.43Å; T684-P1118 WeakPolarHBondContact OG1-CD 3.31Å
685	E	95.1	Very high	95.7	Very high	96 Å²	96	48.3 Å²	48.3	45%	0.449	26%	0.259	S	S	.	.	H	α-helix	trans	-68.1	-56.1	-178.3	-176.6	169.9	-159	0	0	112.7	Q681 D682 L687 F688 K689	Q681-E685 PolarHBondContact O-N 3.39Å; Q681-E685 VanDerWaalsContact O-N 3.08Å; D682-E685 PolarHBondContact O-N 3.04Å; E685-L687 PolarHBondContact O-N 2.82Å; E685-F688 PolarHBondContact O-N 3.04Å; E685-K689 HydrophobicContact CG-CD 3.9Å; E685-K689 WeakPolarHBondContact O-CB 3.47Å; E685-K689 WeakPolarHBondContact O-CG 3.21Å; E685-K689 PolarHBondContact O-N 2.98Å; E685-K689 WeakPolarHBondContact OE1-CE 3.48Å; E685-K689 IonicContact OE1-NZ 3.34Å; E685-K689 PolarHBondContact OE1-NZ 3.11Å
686	T	95.4	Very high	95.5	Very high	4 Å²	4	48.3 Å²	48.3	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-39.3	-175.3	-66	0	0	0	0	111.8	D682 Y690 G691 L746 E753 I757	D682-T686 WeakPolarHBondContact O-CB 3.01Å; D682-T686 PolarHBondContact O-N 2.85Å; D682-T686 PolarHBondContact O-OG1 2.6Å; T686-Y690 HydrophobicContact CG2-CD2 4.34Å; T686-Y690 WeakPolarHBondContact O-CA 3.44Å; T686-Y690 WeakPolarHBondContact O-CB 3.45Å; T686-Y690 PolarHBondContact O-N 3.18Å; T686-G691 PolarHBondContact O-N 2.69Å; T686-L746 HydrophobicContact CG2-CD1 3.87Å; T686-L746 HydrophobicContact CG2-CD2 4.43Å; T686-E753 WeakPolarHBondContact CG2-OE2 3.21Å; T686-E753 PolarHBondContact OG1-OE2 2.78Å; T686-I757 HydrophobicContact CG2-CB 4.49Å; T686-I757 HydrophobicContact CG2-CD1 4.3Å
687	L	95.7	Very high	95.2	Very high	4 Å²	4	59 Å²	59	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-75.7	-31.8	179.2	-59.9	175.6	0	0	0	112.9	L683 E685 G691 F720 F722 I757 A808 V810	L683-L687 HydrophobicContact CB-CD1 4.14Å; L683-L687 WeakPolarHBondContact O-CB 3.28Å; L683-L687 WeakPolarHBondContact O-CG 3.41Å; L683-L687 PolarHBondContact O-N 3.03Å; E685-L687 PolarHBondContact O-N 2.82Å; L687-G691 WeakPolarHBondContact O-CA 3.5Å; L687-G691 PolarHBondContact O-N 2.9Å; L687-G691 VanDerWaalsContact O-N 3.12Å; L687-F720 HydrophobicContact CB-CD2 4.28Å; L687-F720 HydrophobicContact CB-CE2 4.06Å; L687-F720 HydrophobicContact CB-CZ 4.22Å; L687-F720 HydrophobicContact CD1-CD2 3.96Å; L687-F720 HydrophobicContact CD1-CE2 4.4Å; L687-F720 HydrophobicContact CD1-CG 4.43Å; L687-F720 HydrophobicContact CD2-CB 4.13Å; L687-F720 HydrophobicContact CD2-CD1 4.32Å; L687-F720 HydrophobicContact CD2-CD2 4.31Å; L687-F720 HydrophobicContact CD2-CG 4.02Å; L687-F720 HydrophobicContact CG-CD2 4.43Å; L687-F722 HydrophobicContact CD2-CE2 3.92Å; L687-F722 HydrophobicContact CD2-CZ 3.66Å; L687-I757 HydrophobicContact CD2-CD1 3.67Å; L687-I757 HydrophobicContact CG-CD1 4.36Å; L687-A808 HydrophobicContact CD1-CB 3.67Å; L687-V810 HydrophobicContact CD1-CG2 4.03Å
688	F	93.8	Very high	95.2	Very high	67 Å²	67	57.6 Å²	57.6	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-44.5	173.3	170.6	-113.5	0	0	0	111.9	T684 E685 R1115 R1116	T684-F688 WeakPolarHBondContact O-CB 3.12Å; T684-F688 PolarHBondContact O-N 2.91Å; T684-F688 VanDerWaalsContact O-N 3.15Å; E685-F688 PolarHBondContact O-N 3.04Å; F688-R1115 HydrophobicContact CD2-CG 4.34Å; F688-R1116 HydrophobicContact CD1-CG 4.22Å; F688-R1116 HydrophobicContact CD2-CG 3.62Å; F688-R1116 HydrophobicContact CE1-CG 4.13Å; F688-R1116 HydrophobicContact CE2-CG 3.53Å; F688-R1116 VanDerWaalsContact CE2-NE 3.34Å; F688-R1116 HydrophobicContact CG-CG 4Å; F688-R1116 HydrophobicContact CZ-CG 3.82Å
689	K	92.5	Very high	95.1	Very high	103 Å²	103	54 Å²	54	45%	0.448	27%	0.274	S	S	.	.	H	α-helix	trans	-76.7	-44.8	-177.5	-69.8	175.5	174	-179.6	0	113.6	E685	E685-K689 HydrophobicContact CG-CD 3.9Å; E685-K689 WeakPolarHBondContact O-CB 3.47Å; E685-K689 WeakPolarHBondContact O-CG 3.21Å; E685-K689 PolarHBondContact O-N 2.98Å; E685-K689 WeakPolarHBondContact OE1-CE 3.48Å; E685-K689 IonicContact OE1-NZ 3.34Å; E685-K689 PolarHBondContact OE1-NZ 3.11Å
690	Y	94.4	Very high	94.9	Very high	71 Å²	71	55.4 Å²	55.4	28%	0.278	28%	0.281	S	S	.	.	H	α-helix	trans	-127.4	-6.2	-164.7	-47	-59.7	0	0	0	113.8	T686 L746 L747 L750 E753	T686-Y690 HydrophobicContact CG2-CD2 4.34Å; T686-Y690 WeakPolarHBondContact O-CA 3.44Å; T686-Y690 WeakPolarHBondContact O-CB 3.45Å; T686-Y690 PolarHBondContact O-N 3.18Å; Y690-L746 WeakPolarHBondContact O-CB 3.02Å; Y690-L747 WeakPolarHBondContact O-CB 3.14Å; Y690-L747 WeakPolarHBondContact O-CG 3.39Å; Y690-L747 PolarHBondContact O-N 3.2Å; Y690-L750 HydrophobicContact CD1-CD1 3.32Å; Y690-L750 HydrophobicContact CE1-CD1 3.54Å; Y690-L750 HydrophobicContact CG-CD1 3.87Å; Y690-E753 HydrophobicContact CD2-CB 4.36Å; Y690-E753 HydrophobicContact CD2-CG 3.79Å; Y690-E753 HydrophobicContact CE2-CG 3.74Å
691	G	93.5	Very high	94.7	Very high	7 Å²	7	55.1 Å²	55.1	7%	0.072	28%	0.28	C	S	.	.			trans	-65.1	139	-179.8	0	0	0	0	0	112.6	T686 L687 P693 L747	T686-G691 PolarHBondContact O-N 2.69Å; L687-G691 WeakPolarHBondContact O-CA 3.5Å; L687-G691 PolarHBondContact O-N 2.9Å; L687-G691 VanDerWaalsContact O-N 3.12Å; G691-P693 WeakPolarHBondContact O-CD 3.32Å; G691-L747 WeakPolarHBondContact O-CD1 3.14Å
692	S	92.7	Very high	94.4	Very high	57 Å²	57	55.7 Å²	55.7	40%	0.399	28%	0.283	S	S	.	.			trans	-100.5	106.3	173	-168.3	0	0	0	0	110.6	T694 F720	S692-T694 PolarHBondContact O-N 3.01Å; S692-F720 WeakPolarHBondContact O-CD1 3.23Å
693	P	94.4	Very high	94.1	Very high	79 Å²	79	60.1 Å²	60.1	51%	0.513	31%	0.307	S	S	.	.			trans	-62.7	127.6	-174.3	-25	35.3	0	0	0	113.1	G691 A718 F720	G691-P693 WeakPolarHBondContact O-CD 3.32Å; P693-A718 HydrophobicContact CB-CB 4.49Å; P693-F720 HydrophobicContact CB-CE1 4.33Å; P693-F720 HydrophobicContact CG-CE1 3.84Å; P693-F720 HydrophobicContact CG-CZ 4.35Å
694	T	93.6	Very high	93.8	Very high	52 Å²	52	64.1 Å²	64.1	32%	0.319	32%	0.321	S	S	.	.			trans	-89.2	119.4	176.3	-57.6	0	0	0	0	109.9	S692 R696 S719 S721	S692-T694 PolarHBondContact O-N 3.01Å; T694-R696 PolarHBondContact O-N 2.84Å; T694-S719 WeakPolarHBondContact CB-O 3.48Å; T694-S719 PolarHBondContact N-O 2.99Å; T694-S719 PolarHBondContact O-OG 2.98Å; T694-S721 PolarHBondContact OG1-N 3.05Å; T694-S721 VanDerWaalsContact OG1-N 3.17Å
695	S	91.3	Very high	93.6	Very high	124 Å²	124	64.3 Å²	64.3	87%	0.867	32%	0.323	S	S	*	.			trans	-77.1	113.4	176.1	-172.7	0	0	0	0	110.7
696	R	92.8	Very high	93.5	Very high	50 Å²	50	59.9 Å²	59.9	19%	0.189	30%	0.302	C	S	.	.			trans	-106.3	155.5	175.8	-73.8	-176	162	-116.3	2.6	111.3	T694 A699 T807 F812 D819	T694-R696 PolarHBondContact O-N 2.84Å; R696-A699 VanDerWaalsContact O-CB 3.31Å; R696-A699 WeakPolarHBondContact O-CB 3.29Å; R696-A699 PolarHBondContact O-N 3.04Å; R696-T807 PolarHBondContact NH2-OG1 3.45Å; R696-F812 HydrophobicContact CB-CZ 4.35Å; R696-D819 IonicContact NH1-OD1 3.78Å; R696-D819 PolarHBondContact NH1-OD1 3.44Å; R696-D819 IonicContact NH1-OD2 2.64Å
697	R	93.4	Very high	93.4	Very high	223 Å²	223	60.6 Å²	60.6	84%	0.842	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-62.4	-44.1	176	-179	179.8	173.9	-173	-4.3	111.7	A699 L700	R697-A699 PolarHBondContact O-N 2.9Å; R697-A699 VanDerWaalsContact O-N 3.09Å; R697-L700 PolarHBondContact O-N 3.43Å
698	C	96.6	Very high	93.3	Very high	9 Å²	9	61 Å²	61	6%	0.061	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-67.8	0.5	179.1	52.1	0	0	0	0	114.7	L700 C813 H815 H817	C698-L700 PolarHBondContact O-N 2.8Å; C698-C813 VanDerWaalsContact O-O 3.14Å; C698-H815 WeakPolarHBondContact CB-O 3.42Å; C698-H815 WeakPolarHBondContact O-CB 3.38Å; C698-H815 PolarHBondContact O-N 3.1Å; C698-H815 PolarHBondContact O-ND1 3.2Å; C698-H817 HydrophobicContact CB-CB 4.13Å; C698-H817 PolarHBondContact SG-CD2 2.96Å; C698-H817 PolarHBondContact SG-NE2 2.98Å
699	A	95.9	Very high	93.4	Very high	17 Å²	17	58.8 Å²	58.8	14%	0.14	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-68.9	-13.4	172.9	0	0	0	0	0	113.3	R696 R697 Q709 F812	R696-A699 VanDerWaalsContact O-CB 3.31Å; R696-A699 WeakPolarHBondContact O-CB 3.29Å; R696-A699 PolarHBondContact O-N 3.04Å; R697-A699 PolarHBondContact O-N 2.9Å; R697-A699 VanDerWaalsContact O-N 3.09Å; A699-Q709 PolarHBondContact O-NE2 3.35Å; A699-F812 HydrophobicContact CB-CE2 3.63Å; A699-F812 HydrophobicContact CB-CZ 3.75Å
700	L	94.8	Very high	93.4	Very high	33 Å²	33	55.2 Å²	55.2	17%	0.173	30%	0.295	C	S	.	.	S	Bend	trans	-143	158.7	-176.6	-60.8	168.9	0	0	0	111.4	R697 C698 R704 C706 H815 V896	R697-L700 PolarHBondContact O-N 3.43Å; C698-L700 PolarHBondContact O-N 2.8Å; L700-R704 HydrophobicContact CB-CB 4.36Å; L700-R704 HydrophobicContact CB-CG 4.36Å; L700-R704 HydrophobicContact CD1-CB 3.99Å; L700-R704 HydrophobicContact CD1-CG 4.47Å; L700-C706 WeakPolarHBondContact CD2-O 3.45Å; L700-H815 VanDerWaalsContact C-CG 3.46Å; L700-V896 HydrophobicContact CD1-CB 3.68Å; L700-V896 HydrophobicContact CD1-CG1 4.12Å; L700-V896 HydrophobicContact CD1-CG2 3.74Å; L700-V896 HydrophobicContact CD2-CG2 4.41Å
701	N	93.8	Very high	93.2	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.027	30%	0.301	C	S	.	.			trans	-63.9	174.3	168.7	69.4	-23.9	0	0	0	112.6	Q626 D703 R704 T705 C706 H815	Q626-N701 WeakPolarHBondContact O-CB 3.31Å; Q626-N701 PolarHBondContact O-ND2 3.31Å; N701-D703 PolarHBondContact O-N 3.5Å; N701-R704 WeakPolarHBondContact O-CA 3.45Å; N701-R704 VanDerWaalsContact O-CG 3.25Å; N701-R704 WeakPolarHBondContact O-CG 3.47Å; N701-R704 PolarHBondContact O-N 3.09Å; N701-R704 VanDerWaalsContact OD1-CA 3.29Å; N701-R704 WeakPolarHBondContact OD1-CA 3.34Å; N701-R704 PolarHBondContact OD1-N 3.35Å; N701-T705 PolarHBondContact ND2-OG1 2.81Å; N701-T705 PolarHBondContact OD1-N 3.23Å; N701-C706 HydrophobicContact CB-CB 4.12Å; N701-C706 PolarHBondContact N-SG 2.8Å; N701-C706 PolarHBondContact OD1-N 3.36Å; N701-C706 PolarHBondContact OD1-SG 2.85Å; N701-H815 VanDerWaalsContact CA-CD2 3.5Å; N701-H815 WeakPolarHBondContact CA-CD2 3.48Å; N701-H815 PolarHBondContact N-CD2 2.95Å; N701-H815 VanDerWaalsContact N-CD2 3.31Å; N701-H815 PolarHBondContact N-NE2 3.13Å
702	E	91.6	Very high	93	Very high	133 Å²	133	58.9 Å²	58.9	62%	0.621	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-39.6	-173.8	-56	-159.3	91.8	0	0	113.1	K623 R704	K623-E702 IonicContact NZ-OE2 2.73Å; E702-R704 PolarHBondContact O-N 3.39Å
703	D	90.1	Very high	92.9	Very high	110 Å²	110	60.5 Å²	60.5	59%	0.588	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-16	173.1	-60.4	-62.5	0	0	0	113.6	N701 T705 P895	N701-D703 PolarHBondContact O-N 3.5Å; D703-T705 VanDerWaalsContact C-N 3.31Å; D703-T705 HydrophobicContact CB-CG2 4.21Å; D703-T705 PolarHBondContact O-N 3.03Å; D703-P895 WeakPolarHBondContact O-CB 3.42Å
704	R	92.3	Very high	92.7	Very high	85 Å²	85	60.4 Å²	60.4	32%	0.321	32%	0.322	S	S	.	.	S	Bend	trans	62.8	35	178.8	-56	175	64.9	-112.8	-16	113.4	L700 N701 E702 P895 V896 K897	L700-R704 HydrophobicContact CB-CB 4.36Å; L700-R704 HydrophobicContact CB-CG 4.36Å; L700-R704 HydrophobicContact CD1-CB 3.99Å; L700-R704 HydrophobicContact CD1-CG 4.47Å; N701-R704 WeakPolarHBondContact O-CA 3.45Å; N701-R704 VanDerWaalsContact O-CG 3.25Å; N701-R704 WeakPolarHBondContact O-CG 3.47Å; N701-R704 PolarHBondContact O-N 3.09Å; N701-R704 VanDerWaalsContact OD1-CA 3.29Å; N701-R704 WeakPolarHBondContact OD1-CA 3.34Å; N701-R704 PolarHBondContact OD1-N 3.35Å; E702-R704 PolarHBondContact O-N 3.39Å; R704-P895 WeakPolarHBondContact O-CA 3.32Å; R704-V896 PolarHBondContact NH1-O 2.9Å; R704-V896 PolarHBondContact NH2-O 2.87Å; R704-V896 PolarHBondContact O-N 3.23Å; R704-K897 PolarHBondContact NH2-O 3.19Å
705	T	91.9	Very high	92.7	Very high	22 Å²	22	59.5 Å²	59.5	14%	0.135	32%	0.316	C	S	.	.			trans	-110	-19.3	-178.2	50.3	0	0	0	0	113.9	N701 D703 L892 P895	N701-T705 PolarHBondContact ND2-OG1 2.81Å; N701-T705 PolarHBondContact OD1-N 3.23Å; D703-T705 VanDerWaalsContact C-N 3.31Å; D703-T705 HydrophobicContact CB-CG2 4.21Å; D703-T705 PolarHBondContact O-N 3.03Å; T705-L892 WeakPolarHBondContact O-CB 3.33Å; T705-L892 WeakPolarHBondContact O-CG 3.31Å; T705-L892 PolarHBondContact O-N 3.48Å; T705-P895 HydrophobicContact CG2-CB 4.43Å; T705-P895 HydrophobicContact CG2-CG 3.92Å
706	C	92.4	Very high	92.9	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.014	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-66	145.8	-173.5	68.2	0	0	0	0	113.7	L700 N701 H815	L700-C706 WeakPolarHBondContact CD2-O 3.45Å; N701-C706 HydrophobicContact CB-CB 4.12Å; N701-C706 PolarHBondContact N-SG 2.8Å; N701-C706 PolarHBondContact OD1-N 3.36Å; N701-C706 PolarHBondContact OD1-SG 2.85Å; C706-H815 PolarHBondContact SG-NE2 3Å; C706-H815 VanDerWaalsContact SG-NE2 3.4Å
707	A	93.3	Very high	93.1	Very high	19 Å²	19	52.7 Å²	52.7	16%	0.157	28%	0.277	C	S	.	.			trans	-94.9	25.8	171.9	0	0	0	0	0	114.3	Q709 G710 L711 R890	A707-Q709 PolarHBondContact O-N 2.92Å; A707-G710 WeakPolarHBondContact O-CA 3.41Å; A707-G710 PolarHBondContact O-N 3.23Å; A707-L711 HydrophobicContact CB-CD2 3.59Å; A707-L711 HydrophobicContact CB-CG 3.9Å; A707-R890 HydrophobicContact CB-CB 3.89Å; A707-R890 WeakPolarHBondContact CB-O 3.47Å; A707-R890 PolarHBondContact N-O 3.46Å; A707-R890 VanDerWaalsContact N-O 3.08Å
708	C	94.3	Very high	93.3	Very high	14 Å²	14	42.5 Å²	42.5	10%	0.095	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-13.9	-170.9	-71.3	0	0	0	0	116.6	C813 P1109	C708-C813 HydrophobicContact CB-CB 3.99Å; C708-P1109 HydrophobicContact CB-CB 4.11Å
709	Q	95.4	Very high	93.3	Very high	20 Å²	20	42.1 Å²	42.1	9%	0.093	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.5	171.1	-47	-54.2	-26.9	0	0	112.8	A699 A707 C716 G717 C813 P1113	A699-Q709 PolarHBondContact O-NE2 3.35Å; A707-Q709 PolarHBondContact O-N 2.92Å; Q709-C716 HydrophobicContact CB-CB 4.37Å; Q709-C716 CarbonylContact O-C 3.43Å; Q709-C716 WeakPolarHBondContact O-CA 3.41Å; Q709-C716 WeakPolarHBondContact O-CB 3.19Å; Q709-G717 PolarHBondContact O-N 3.17Å; Q709-C813 PolarHBondContact NE2-O 3.07Å; Q709-P1113 WeakPolarHBondContact O-CB 3.25Å
710	G	93.3	Very high	93.4	Very high	28 Å²	28	41.4 Å²	41.4	29%	0.289	23%	0.231	S	C	.	.			trans	83.6	149.4	-162.2	0	0	0	0	0	112.6	A707 C716	A707-G710 WeakPolarHBondContact O-CA 3.41Å; A707-G710 PolarHBondContact O-N 3.23Å; G710-C716 WeakPolarHBondContact O-CB 3.5Å
711	L	89.7	Confident	93.6	Very high	76 Å²	76	41.2 Å²	41.2	40%	0.398	23%	0.233	S	C	.	.	S	Bend	trans	-85.6	-18.8	-176.9	-65.9	177.3	0	0	0	114.2	A707 P713 R890 L892	A707-L711 HydrophobicContact CB-CD2 3.59Å; A707-L711 HydrophobicContact CB-CG 3.9Å; L711-P713 WeakPolarHBondContact O-CD 3.43Å; L711-R890 HydrophobicContact CD1-CB 4.41Å; L711-L892 HydrophobicContact CD2-CD2 3.6Å; L711-L892 HydrophobicContact CD2-CG 4.44Å
712	N	90.5	Very high	93.8	Very high	78 Å²	78	41.3 Å²	41.3	42%	0.417	23%	0.233	S	C	.	.			trans	-80.5	115.1	-177.3	179.6	-0.8	0	0	0	110.4	D714 T715 C716	N712-D714 PolarHBondContact O-N 2.73Å; N712-D714 VanDerWaalsContact O-N 3.07Å; N712-D714 PolarHBondContact OD1-N 3.3Å; N712-D714 VanDerWaalsContact OD1-N 3.1Å; N712-T715 PolarHBondContact O-N 3.41Å; N712-C716 WeakPolarHBondContact O-CB 3.49Å; N712-C716 PolarHBondContact O-N 2.94Å; N712-C716 PolarHBondContact O-SG 3.15Å; N712-C716 VanDerWaalsContact O-SG 3.41Å
713	P	89.5	Confident	94.1	Very high	92 Å²	92	35 Å²	35	60%	0.597	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-17	-176.5	27.7	-36.5	0	0	0	114.2	L711 R1115	L711-P713 WeakPolarHBondContact O-CD 3.43Å; P713-R1115 VanDerWaalsContact O-CZ 3.23Å; P713-R1115 PolarHBondContact O-NH1 3Å; P713-R1115 PolarHBondContact O-NH2 3.13Å
714	D	89.5	Confident	94.5	Very high	77 Å²	77	29.8 Å²	29.8	41%	0.412	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-25.8	179.6	-83.6	14.7	0	0	0	114.2	N712 R1115 R1116	N712-D714 PolarHBondContact O-N 2.73Å; N712-D714 VanDerWaalsContact O-N 3.07Å; N712-D714 PolarHBondContact OD1-N 3.3Å; N712-D714 VanDerWaalsContact OD1-N 3.1Å; D714-R1115 PolarHBondContact O-NH2 2.65Å; D714-R1116 IonicContact OD2-NH2 2.68Å; D714-R1116 PolarHBondContact OD2-NH2 3.22Å
715	T	94.1	Very high	94.7	Very high	32 Å²	32	27 Å²	27	20%	0.196	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-16.1	-175.3	70.4	0	0	0	0	112.7	N712 P1113 N1114 R1115	N712-T715 PolarHBondContact O-N 3.41Å; T715-P1113 CarbonylContact O-C 3.57Å; T715-P1113 VanDerWaalsContact O-O 3.12Å; T715-P1113 PolarHBondContact OG1-O 3.28Å; T715-N1114 CarbonylContact O-C 3.47Å; T715-N1114 VanDerWaalsContact O-CA 3.26Å; T715-N1114 WeakPolarHBondContact O-CA 3.42Å; T715-N1114 PolarHBondContact O-N 3.4Å; T715-R1115 PolarHBondContact O-N 3.06Å
716	C	95.4	Very high	95	Very high	25 Å²	25	28.5 Å²	28.5	17%	0.169	17%	0.172	C	C	.	.	S	Bend	trans	-58.2	148.7	-174.6	63.1	0	0	0	0	114.1	Q709 G710 N712 R1115	Q709-C716 HydrophobicContact CB-CB 4.37Å; Q709-C716 CarbonylContact O-C 3.43Å; Q709-C716 WeakPolarHBondContact O-CA 3.41Å; Q709-C716 WeakPolarHBondContact O-CB 3.19Å; G710-C716 WeakPolarHBondContact O-CB 3.5Å; N712-C716 WeakPolarHBondContact O-CB 3.49Å; N712-C716 PolarHBondContact O-N 2.94Å; N712-C716 PolarHBondContact O-SG 3.15Å; N712-C716 VanDerWaalsContact O-SG 3.41Å; C716-R1115 PolarHBondContact O-NH1 2.84Å; C716-R1115 PolarHBondContact SG-NH1 2.59Å; C716-R1115 VanDerWaalsContact SG-NH1 3.44Å
717	G	97.1	Very high	95.2	Very high	7 Å²	7	29.2 Å²	29.2	7%	0.072	18%	0.178	C	C	.	.			trans	-58.4	135.6	175.7	0	0	0	0	0	111.9	Q709 V810 D811	Q709-G717 PolarHBondContact O-N 3.17Å; G717-V810 CarbonylContact C-O 3.57Å; G717-V810 VanDerWaalsContact CA-O 3.24Å; G717-V810 WeakPolarHBondContact CA-O 3.03Å; G717-D811 WeakPolarHBondContact CA-O 3.26Å
718	A	97.3	Very high	95.2	Very high	8 Å²	8	35 Å²	35	7%	0.066	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	149.8	-168.6	0	0	0	0	0	112.3	P693 F720 V810	P693-A718 HydrophobicContact CB-CB 4.49Å; A718-F720 HydrophobicContact CB-CE2 3.66Å; A718-F720 HydrophobicContact CB-CZ 3.73Å; A718-V810 PolarHBondContact N-O 2.8Å; A718-V810 PolarHBondContact O-N 3.23Å
719	S	97.9	Very high	95	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	141.2	170.9	83.5	0	0	0	0	110.4	T694 A808	T694-S719 WeakPolarHBondContact CB-O 3.48Å; T694-S719 PolarHBondContact N-O 2.99Å; T694-S719 PolarHBondContact O-OG 2.98Å; S719-A808 CarbonylContact C-O 3.19Å; S719-A808 WeakPolarHBondContact CA-O 3.48Å
720	F	98.1	Very high	94.7	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.009	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	110.9	-178.1	-55.6	-91.2	0	0	0	109.1	L687 S692 P693 A718 F722 T807 A808 V810	L687-F720 HydrophobicContact CB-CD2 4.28Å; L687-F720 HydrophobicContact CB-CE2 4.06Å; L687-F720 HydrophobicContact CB-CZ 4.22Å; L687-F720 HydrophobicContact CD1-CD2 3.96Å; L687-F720 HydrophobicContact CD1-CE2 4.4Å; L687-F720 HydrophobicContact CD1-CG 4.43Å; L687-F720 HydrophobicContact CD2-CB 4.13Å; L687-F720 HydrophobicContact CD2-CD1 4.32Å; L687-F720 HydrophobicContact CD2-CD2 4.31Å; L687-F720 HydrophobicContact CD2-CG 4.02Å; L687-F720 HydrophobicContact CG-CD2 4.43Å; S692-F720 WeakPolarHBondContact O-CD1 3.23Å; P693-F720 HydrophobicContact CB-CE1 4.33Å; P693-F720 HydrophobicContact CG-CE1 3.84Å; P693-F720 HydrophobicContact CG-CZ 4.35Å; A718-F720 HydrophobicContact CB-CE2 3.66Å; A718-F720 HydrophobicContact CB-CZ 3.73Å; F720-F722 HydrophobicContact CB-CE2 3.96Å; F720-F722 HydrophobicContact CB-CZ 3.99Å; F720-T807 CarbonylContact O-C 3.59Å; F720-T807 VanDerWaalsContact O-CA 3.31Å; F720-T807 WeakPolarHBondContact O-CA 3.41Å; F720-A808 HydrophobicContact CB-CB 4.49Å; F720-A808 PolarHBondContact N-O 3.15Å; F720-A808 PolarHBondContact O-N 2.88Å; F720-V810 HydrophobicContact CD2-CG2 4.26Å; F720-V810 HydrophobicContact CE2-CB 4.43Å; F720-V810 HydrophobicContact CE2-CG2 4.07Å
721	S	97.8	Very high	94.7	Very high	30 Å²	30	47.1 Å²	47.1	21%	0.21	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	113.9	-170.5	-65.1	0	0	0	0	113.5	T694 T807	T694-S721 PolarHBondContact OG1-N 3.05Å; T694-S721 VanDerWaalsContact OG1-N 3.17Å; S721-T807 WeakPolarHBondContact CB-OG1 3.43Å; S721-T807 WeakPolarHBondContact OG-CG2 3.5Å; S721-T807 PolarHBondContact OG-OG1 2.78Å
722	F	98.4	Very high	94.9	Very high	7 Å²	7	44 Å²	44	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	172	-179.4	-52.9	-67	0	0	0	112.8	L687 F720 F744 L746 I757 L761 G805 V806	L687-F722 HydrophobicContact CD2-CE2 3.92Å; L687-F722 HydrophobicContact CD2-CZ 3.66Å; F720-F722 HydrophobicContact CB-CE2 3.96Å; F720-F722 HydrophobicContact CB-CZ 3.99Å; F722-F744 HydrophobicContact CB-CD1 3.63Å; F722-F744 HydrophobicContact CB-CE1 3.86Å; F722-F744 HydrophobicContact CB-CG 4.48Å; F722-F744 HydrophobicContact CD1-CD1 4.35Å; F722-F744 AromaticContact CG-CD1 3.96Å; F722-F744 HydrophobicContact CG-CD1 3.96Å; F722-L746 HydrophobicContact CE1-CD2 4.27Å; F722-L746 HydrophobicContact CZ-CD2 4.31Å; F722-I757 HydrophobicContact CE2-CD1 3.83Å; F722-I757 HydrophobicContact CZ-CD1 3.78Å; F722-L761 HydrophobicContact CD2-CD1 3.73Å; F722-L761 HydrophobicContact CE2-CD1 4.25Å; F722-L761 HydrophobicContact CG-CD1 4.41Å; F722-G805 WeakPolarHBondContact O-CA 3.23Å; F722-V806 HydrophobicContact CB-CG1 4.07Å; F722-V806 PolarHBondContact N-O 3.19Å; F722-V806 PolarHBondContact O-N 3.12Å; F722-V806 VanDerWaalsContact O-N 3.15Å
723	G	97.8	Very high	95.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.5	-156.4	-176.4	0	0	0	0	0	112.9	K734 K743	G723-K734 WeakPolarHBondContact O-CE 3.36Å; G723-K734 PolarHBondContact O-NZ 2.92Å; G723-K743 PolarHBondContact N-O 2.89Å
724	C	98.1	Very high	95.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.2	C	C	.	.			trans	-92.7	147.2	-175.9	-62.2	0	0	0	0	112.5	C793 S804 L1131 H1136	C724-C793 HydrophobicContact CB-CB 4.41Å; C724-S804 WeakPolarHBondContact CA-O 3.24Å; C724-S804 WeakPolarHBondContact CB-O 3.34Å; C724-S804 PolarHBondContact N-O 2.87Å; C724-S804 CarbonylContact O-C 3.55Å; C724-S804 PolarHBondContact O-OG 3.02Å; C724-L1131 HydrophobicContact CB-CD1 4.18Å; C724-H1136 PolarHBondContact SG-CE1 3.31Å
725	S	97.6	Very high	96	Very high	26 Å²	26	36.8 Å²	36.8	18%	0.182	19%	0.185	C	C	.	.			trans	-148.8	140	178	62.5	0	0	0	0	110.3	K734	S725-K734 PolarHBondContact O-N 3.09Å; S725-K734 VanDerWaalsContact OG-CD 3.27Å; S725-K734 WeakPolarHBondContact OG-CD 3.39Å; S725-K734 WeakPolarHBondContact OG-CE 3.31Å
726	W	97.8	Very high	96	Very high	54 Å²	54	35.3 Å²	35.3	21%	0.205	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	144.5	172.3	178.3	86.4	0	0	0	112.6	M728 N731 G732 H1128 K1129	W726-M728 HydrophobicContact CH2-CB 3.6Å; W726-M728 HydrophobicContact CZ2-CB 4.21Å; W726-M728 HydrophobicContact CZ3-CB 3.99Å; W726-N731 WeakPolarHBondContact CZ2-OD1 3.47Å; W726-N731 PolarHBondContact NE1-OD1 2.95Å; W726-G732 CarbonylContact C-O 3.19Å; W726-G732 WeakPolarHBondContact CA-O 3.24Å; W726-H1128 HydrophobicContact CB-CB 3.7Å; W726-H1128 PolarHBondContact N-ND1 3.39Å; W726-H1128 VanDerWaalsContact N-ND1 3.1Å; W726-K1129 HydrophobicContact CB-CG 4.45Å; W726-K1129 WeakPolarHBondContact CB-O 3.34Å; W726-K1129 HydrophobicContact CD2-CG 4.38Å; W726-K1129 VanDerWaalsContact CE2-CE 3.46Å; W726-K1129 HydrophobicContact CG-CG 4.04Å
727	S	95.9	Very high	96	Very high	18 Å²	18	42.6 Å²	42.6	13%	0.126	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	122	-178.8	171.6	0	0	0	0	110.1	Y729 F730 N731 G732	S727-Y729 PolarHBondContact O-N 3.36Å; S727-Y729 VanDerWaalsContact O-N 3.12Å; S727-F730 PolarHBondContact O-N 2.84Å; S727-F730 VanDerWaalsContact O-N 3.14Å; S727-F730 WeakPolarHBondContact OG-CD2 3.27Å; S727-N731 WeakPolarHBondContact O-CA 3.16Å; S727-N731 PolarHBondContact O-N 2.81Å; S727-G732 PolarHBondContact N-O 2.96Å
728	M	92.9	Very high	95.8	Very high	140 Å²	140	44.3 Å²	44.3	69%	0.69	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.6	178.8	68.7	-175.2	-66.4	0	0	114.3	W726 F730	W726-M728 HydrophobicContact CH2-CB 3.6Å; W726-M728 HydrophobicContact CZ2-CB 4.21Å; W726-M728 HydrophobicContact CZ3-CB 3.99Å; M728-F730 VanDerWaalsContact C-N 3.35Å
729	Y	90.3	Very high	95.5	Very high	177 Å²	177	53.4 Å²	53.4	69%	0.694	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-32	179.1	-61.7	-78.1	0	0	0	112.6	S727	S727-Y729 PolarHBondContact O-N 3.36Å; S727-Y729 VanDerWaalsContact O-N 3.12Å
730	F	90.3	Very high	95.3	Very high	40 Å²	40	58.9 Å²	58.9	18%	0.175	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-26.3	-179.1	-50.2	-50.3	0	0	0	111.3	S727 M728 C733 A736 R737 W1141	S727-F730 PolarHBondContact O-N 2.84Å; S727-F730 VanDerWaalsContact O-N 3.14Å; S727-F730 WeakPolarHBondContact OG-CD2 3.27Å; M728-F730 VanDerWaalsContact C-N 3.35Å; F730-C733 WeakPolarHBondContact CD2-O 3.46Å; F730-A736 HydrophobicContact CB-CB 4.25Å; F730-A736 HydrophobicContact CD1-CB 4.44Å; F730-A736 HydrophobicContact CD2-CB 4.13Å; F730-A736 HydrophobicContact CG-CB 4.01Å; F730-R737 HydrophobicContact CE1-CG 3.93Å; F730-R737 HydrophobicContact CZ-CG 4.11Å; F730-W1141 HydrophobicContact CB-CE3 4.5Å; F730-W1141 AromaticContact CD1-CD2 3.83Å; F730-W1141 HydrophobicContact CD1-CD2 3.83Å; F730-W1141 AromaticContact CD1-CE3 3.53Å; F730-W1141 HydrophobicContact CD1-CE3 3.53Å; F730-W1141 AromaticContact CD1-CH2 3.95Å; F730-W1141 HydrophobicContact CD1-CH2 3.95Å; F730-W1141 HydrophobicContact CD1-CZ2 4.26Å; F730-W1141 AromaticContact CD1-CZ3 3.6Å; F730-W1141 HydrophobicContact CD1-CZ3 3.6Å; F730-W1141 HydrophobicContact CE1-CD2 4.23Å; F730-W1141 HydrophobicContact CE1-CE3 4.27Å; F730-W1141 HydrophobicContact CE1-CH2 4.07Å; F730-W1141 HydrophobicContact CE1-CZ2 4.06Å; F730-W1141 HydrophobicContact CE1-CZ3 4.19Å; F730-W1141 HydrophobicContact CG-CE3 4.47Å
731	N	91.9	Very high	95.1	Very high	99 Å²	99	61 Å²	61	53%	0.529	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	31	-158.5	-164.2	43.2	0	0	0	113	W726 S727	W726-N731 WeakPolarHBondContact CZ2-OD1 3.47Å; W726-N731 PolarHBondContact NE1-OD1 2.95Å; S727-N731 WeakPolarHBondContact O-CA 3.16Å; S727-N731 PolarHBondContact O-N 2.81Å
732	G	95	Very high	94.9	Very high	11 Å²	11	62 Å²	62	11%	0.113	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	-154.3	-177	0	0	0	0	0	110.2	W726 S727 A1130	W726-G732 CarbonylContact C-O 3.19Å; W726-G732 WeakPolarHBondContact CA-O 3.24Å; S727-G732 PolarHBondContact N-O 2.96Å; G732-A1130 WeakPolarHBondContact CA-O 3.41Å
733	C	97.7	Very high	94.8	Very high	2 Å²	2	63.2 Å²	63.2	1%	0.014	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	141.9	-178	-170.9	0	0	0	0	113.3	F730 F735 A736 L1131 H1136	F730-C733 WeakPolarHBondContact CD2-O 3.46Å; C733-F735 PolarHBondContact O-N 3.3Å; C733-F735 PolarHBondContact SG-N 2.65Å; C733-F735 VanDerWaalsContact SG-N 3.45Å; C733-A736 WeakPolarHBondContact O-CB 3.13Å; C733-A736 PolarHBondContact O-N 3.36Å; C733-A736 VanDerWaalsContact O-N 3.13Å; C733-L1131 VanDerWaalsContact CA-CD2 3.41Å; C733-L1131 HydrophobicContact CB-CD2 3.63Å; C733-H1136 HydrophobicContact CB-CB 3.84Å; C733-H1136 WeakPolarHBondContact CB-O 3.4Å
734	K	96.7	Very high	94.8	Very high	68 Å²	68	63.3 Å²	63.3	30%	0.296	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-20.9	169.2	62.9	170	167.2	-172.9	0	114.5	G723 S725	G723-K734 WeakPolarHBondContact O-CE 3.36Å; G723-K734 PolarHBondContact O-NZ 2.92Å; S725-K734 PolarHBondContact O-N 3.09Å; S725-K734 VanDerWaalsContact OG-CD 3.27Å; S725-K734 WeakPolarHBondContact OG-CD 3.39Å; S725-K734 WeakPolarHBondContact OG-CE 3.31Å
735	F	97.3	Very high	94.6	Very high	25 Å²	25	70.5 Å²	70.5	11%	0.11	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	7.9	-178.1	-63.1	-53.4	0	0	0	114.7	C733 R737 S738 P741 R742 K743 H1136	C733-F735 PolarHBondContact O-N 3.3Å; C733-F735 PolarHBondContact SG-N 2.65Å; C733-F735 VanDerWaalsContact SG-N 3.45Å; F735-R737 PolarHBondContact O-N 3.12Å; F735-S738 WeakPolarHBondContact O-CB 3.25Å; F735-S738 PolarHBondContact O-N 2.88Å; F735-P741 HydrophobicContact CB-CB 4.1Å; F735-P741 HydrophobicContact CB-CG 4.35Å; F735-P741 HydrophobicContact CD1-CB 4.06Å; F735-P741 HydrophobicContact CD2-CB 4.05Å; F735-P741 HydrophobicContact CE1-CB 4.46Å; F735-P741 HydrophobicContact CE2-CB 4.45Å; F735-P741 HydrophobicContact CG-CB 3.84Å; F735-R742 WeakPolarHBondContact CZ-O 3.3Å; F735-K743 HydrophobicContact CE2-CG 4.26Å; F735-H1136 HydrophobicContact CB-CB 4.08Å
736	A	95.3	Very high	94.5	Very high	2 Å²	2	69.3 Å²	69.3	2%	0.017	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-4.2	179.9	0	0	0	0	0	115.8	F730 C733 W1141	F730-A736 HydrophobicContact CB-CB 4.25Å; F730-A736 HydrophobicContact CD1-CB 4.44Å; F730-A736 HydrophobicContact CD2-CB 4.13Å; F730-A736 HydrophobicContact CG-CB 4.01Å; C733-A736 WeakPolarHBondContact O-CB 3.13Å; C733-A736 PolarHBondContact O-N 3.36Å; C733-A736 VanDerWaalsContact O-N 3.13Å; A736-W1141 HydrophobicContact CB-CB 4.22Å
737	R	94.1	Very high	94.2	Very high	177 Å²	177	71 Å²	71	67%	0.668	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	11.1	173.3	-68	-176.1	64.1	-163.3	-0.9	113.5	F730 F735 W1141	F730-R737 HydrophobicContact CE1-CG 3.93Å; F730-R737 HydrophobicContact CZ-CG 4.11Å; F735-R737 PolarHBondContact O-N 3.12Å; R737-W1141 HydrophobicContact CG-CG 4.35Å
738	S	94.1	Very high	93.7	Very high	44 Å²	44	72.4 Å²	72.4	31%	0.308	35%	0.351	S	S	.	.			trans	-107.7	99.4	-170.2	-62.6	0	0	0	0	111.1	F735 V740 P741	F735-S738 WeakPolarHBondContact O-CB 3.25Å; F735-S738 PolarHBondContact O-N 2.88Å; S738-V740 PolarHBondContact O-N 3.45Å; S738-P741 WeakPolarHBondContact O-CD 3.44Å; S738-P741 WeakPolarHBondContact O-CG 3.43Å
739	K	91.3	Very high	93.3	Very high	199 Å²	199	71.2 Å²	71.2	87%	0.865	35%	0.347	S	S	*	.	S	Bend	trans	-55.4	-32.3	176.3	-63.5	-171.1	177	-172.7	0	113.5
740	V	91.9	Very high	93.2	Very high	116 Å²	116	66.3 Å²	66.3	70%	0.703	33%	0.332	S	S	*	.	S	Bend	trans	-132.1	93.8	173.3	-175	0	0	0	0	109.3	S738 R742	S738-V740 PolarHBondContact O-N 3.45Å; V740-R742 PolarHBondContact O-N 3.23Å
741	P	94.3	Very high	93.2	Very high	45 Å²	45	71.8 Å²	71.8	29%	0.292	35%	0.352	S	S	.	.			trans	-73.9	113.1	-177.5	-16.8	30.7	0	0	0	113.3	F735 S738 K743 H1136	F735-P741 HydrophobicContact CB-CB 4.1Å; F735-P741 HydrophobicContact CB-CG 4.35Å; F735-P741 HydrophobicContact CD1-CB 4.06Å; F735-P741 HydrophobicContact CD2-CB 4.05Å; F735-P741 HydrophobicContact CE1-CB 4.46Å; F735-P741 HydrophobicContact CE2-CB 4.45Å; F735-P741 HydrophobicContact CG-CB 3.84Å; S738-P741 WeakPolarHBondContact O-CD 3.44Å; S738-P741 WeakPolarHBondContact O-CG 3.43Å; P741-K743 PolarHBondContact O-N 3.34Å; P741-H1136 VanDerWaalsContact CG-CD2 3.4Å; P741-H1136 WeakPolarHBondContact CG-CD2 3.39Å; P741-H1136 VanDerWaalsContact CG-NE2 3.31Å; P741-H1136 WeakPolarHBondContact CG-NE2 3.46Å
742	R	94.4	Very high	93.1	Very high	52 Å²	52	75.2 Å²	75.2	20%	0.196	37%	0.365	C	S	.	.			trans	-81.7	90.5	167.1	-79.2	162.5	68.9	-169.6	2.3	110	F735 V740 F744 R745 G748 D749 E754	F735-R742 WeakPolarHBondContact CZ-O 3.3Å; V740-R742 PolarHBondContact O-N 3.23Å; R742-F744 VanDerWaalsContact C-N 3.3Å; R742-F744 PolarHBondContact O-N 3.42Å; R742-R745 HydrophobicContact CB-CB 4.17Å; R742-G748 PolarHBondContact NH2-O 3.35Å; R742-D749 IonicContact CZ-OD1 2.68Å; R742-D749 VanDerWaalsContact CZ-OD1 3.31Å; R742-D749 IonicContact NH1-OD1 3.02Å; R742-D749 PolarHBondContact NH1-OD1 3.27Å; R742-D749 IonicContact NH2-OD1 3.22Å; R742-D749 PolarHBondContact NH2-OD1 3.08Å; R742-D749 VanDerWaalsContact NH2-OD1 3.13Å; R742-E754 IonicContact CZ-OE1 2.87Å; R742-E754 IonicContact CZ-OE2 2.7Å; R742-E754 IonicContact NE-OE1 2.87Å; R742-E754 PolarHBondContact NE-OE1 3.08Å; R742-E754 IonicContact NE-OE2 2.74Å; R742-E754 PolarHBondContact NE-OE2 2.87Å; R742-E754 IonicContact NH2-OE1 3Å; R742-E754 PolarHBondContact NH2-OE1 3.45Å; R742-E754 IonicContact NH2-OE2 2.75Å; R742-E754 PolarHBondContact NH2-OE2 2.92Å
743	K	96.6	Very high	93	Very high	33 Å²	33	77 Å²	77	14%	0.143	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-40	176.4	-77.3	-177.4	179.9	-179.2	0	112.3	G723 F735 P741 A792 R794 L795	G723-K743 PolarHBondContact N-O 2.89Å; F735-K743 HydrophobicContact CE2-CG 4.26Å; P741-K743 PolarHBondContact O-N 3.34Å; K743-A792 WeakPolarHBondContact CE-O 3.46Å; K743-A792 PolarHBondContact NZ-O 2.93Å; K743-R794 PolarHBondContact NZ-O 3.19Å; K743-L795 HydrophobicContact CD-CD2 4.19Å
744	F	96.8	Very high	92.9	Very high	2 Å²	2	77.5 Å²	77.5	1%	0.009	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	42.4	-171.3	-66.4	-83.5	0	0	0	112.9	F722 R742 L746 I757 E758 L761 Q762 L795 V806	F722-F744 HydrophobicContact CB-CD1 3.63Å; F722-F744 HydrophobicContact CB-CE1 3.86Å; F722-F744 HydrophobicContact CB-CG 4.48Å; F722-F744 HydrophobicContact CD1-CD1 4.35Å; F722-F744 AromaticContact CG-CD1 3.96Å; F722-F744 HydrophobicContact CG-CD1 3.96Å; R742-F744 VanDerWaalsContact C-N 3.3Å; R742-F744 PolarHBondContact O-N 3.42Å; F744-L746 PolarHBondContact O-N 2.94Å; F744-I757 HydrophobicContact CB-CG2 4.13Å; F744-E758 HydrophobicContact CB-CB 3.99Å; F744-E758 HydrophobicContact CD1-CB 4.41Å; F744-E758 HydrophobicContact CD2-CB 3.41Å; F744-E758 VanDerWaalsContact CD2-CB 3.41Å; F744-E758 HydrophobicContact CD2-CG 3.43Å; F744-E758 VanDerWaalsContact CD2-CG 3.43Å; F744-E758 WeakPolarHBondContact CD2-OE2 3.28Å; F744-E758 HydrophobicContact CE2-CB 3.95Å; F744-E758 VanDerWaalsContact CE2-CD 3.47Å; F744-E758 HydrophobicContact CE2-CG 3.54Å; F744-E758 WeakPolarHBondContact CE2-OE1 3.45Å; F744-E758 HydrophobicContact CG-CB 3.67Å; F744-E758 HydrophobicContact CG-CG 4.2Å; F744-E758 HydrophobicContact CZ-CG 4.4Å; F744-L761 HydrophobicContact CD1-CB 4.44Å; F744-L761 HydrophobicContact CD1-CD1 3.93Å; F744-L761 HydrophobicContact CE1-CB 3.64Å; F744-L761 HydrophobicContact CE1-CD1 3.73Å; F744-L761 HydrophobicContact CE1-CG 4.32Å; F744-L761 HydrophobicContact CZ-CB 4.27Å; F744-Q762 HydrophobicContact CE2-CG 4.05Å; F744-Q762 HydrophobicContact CZ-CG 4.07Å; F744-L795 HydrophobicContact CE2-CD2 4.14Å; F744-L795 HydrophobicContact CZ-CD2 3.79Å; F744-V806 HydrophobicContact CE1-CG1 4.42Å
745	R	95.1	Very high	92.9	Very high	150 Å²	150	77 Å²	77	57%	0.566	38%	0.381	S	S	*	.			trans	-64.8	127.1	-170.1	-175.4	174.8	-177.3	174.6	6.6	113.5	R742 E754	R742-R745 HydrophobicContact CB-CB 4.17Å; R745-E754 VanDerWaalsContact CA-OE1 3.27Å; R745-E754 WeakPolarHBondContact CA-OE1 3.45Å
746	L	94.5	Very high	92.8	Very high	2 Å²	2	79.2 Å²	79.2	1%	0.01	39%	0.39	C	S	.	.			trans	-104.1	-178.5	171.3	-64.6	175.7	0	0	0	111.6	T686 Y690 F722 F744 E753 E754 I757	T686-L746 HydrophobicContact CG2-CD1 3.87Å; T686-L746 HydrophobicContact CG2-CD2 4.43Å; Y690-L746 WeakPolarHBondContact O-CB 3.02Å; F722-L746 HydrophobicContact CE1-CD2 4.27Å; F722-L746 HydrophobicContact CZ-CD2 4.31Å; F744-L746 PolarHBondContact O-N 2.94Å; L746-E753 HydrophobicContact CD1-CB 3.62Å; L746-E754 HydrophobicContact CB-CG 4.05Å; L746-E754 HydrophobicContact CD1-CG 4.07Å; L746-E754 HydrophobicContact CG-CG 4Å; L746-E754 PolarHBondContact N-OE1 2.97Å; L746-I757 HydrophobicContact CD1-CG2 4.2Å; L746-I757 HydrophobicContact CG-CG2 4.44Å
747	L	91.4	Very high	92.8	Very high	88 Å²	88	79.2 Å²	79.2	46%	0.461	39%	0.39	S	S	.	.	S	Bend	trans	-74.2	133.6	171.5	-66.2	176	0	0	0	110.6	Y690 G691	Y690-L747 WeakPolarHBondContact O-CB 3.14Å; Y690-L747 WeakPolarHBondContact O-CG 3.39Å; Y690-L747 PolarHBondContact O-N 3.2Å; G691-L747 WeakPolarHBondContact O-CD1 3.14Å
748	G	86.9	Confident	93	Very high	49 Å²	49	74 Å²	74	51%	0.505	37%	0.374	S	S	.	.	S	Bend	trans	78.3	-157.6	-171.6	0	0	0	0	0	113.1	R742	R742-G748 PolarHBondContact NH2-O 3.35Å
749	D	83.8	Confident	93.1	Very high	114 Å²	114	74.1 Å²	74.1	61%	0.61	37%	0.374	S	S	*	.	S	Bend	trans	-122.2	40.9	179.9	-68.6	-32.3	0	0	0	111.4	R742 R751	R742-D749 IonicContact CZ-OD1 2.68Å; R742-D749 VanDerWaalsContact CZ-OD1 3.31Å; R742-D749 IonicContact NH1-OD1 3.02Å; R742-D749 PolarHBondContact NH1-OD1 3.27Å; R742-D749 IonicContact NH2-OD1 3.22Å; R742-D749 PolarHBondContact NH2-OD1 3.08Å; R742-D749 VanDerWaalsContact NH2-OD1 3.13Å; D749-R751 PolarHBondContact O-N 3.44Å
750	L	87.6	Confident	93.4	Very high	74 Å²	74	66.1 Å²	66.1	39%	0.387	34%	0.341	S	S	.	.			trans	-75.6	81.4	-178.5	-61.5	174.3	0	0	0	111.4	Y690 E752 E753 E754	Y690-L750 HydrophobicContact CD1-CD1 3.32Å; Y690-L750 HydrophobicContact CE1-CD1 3.54Å; Y690-L750 HydrophobicContact CG-CD1 3.87Å; L750-E752 VanDerWaalsContact C-N 3.3Å; L750-E752 PolarHBondContact O-N 3.26Å; L750-E753 HydrophobicContact CB-CB 4.23Å; L750-E753 HydrophobicContact CB-CG 4.45Å; L750-E753 PolarHBondContact O-N 3.05Å; L750-E754 WeakPolarHBondContact O-CG 3.48Å; L750-E754 PolarHBondContact O-N 2.89Å
751	R	89.6	Confident	93.7	Very high	155 Å²	155	60.6 Å²	60.6	59%	0.585	31%	0.307	S	S	*	.	H	α-helix	trans	-60.5	-33.1	-173.5	-65.5	-55.8	-164.8	132.7	9.2	114.7	D749 A755	D749-R751 PolarHBondContact O-N 3.44Å; R751-A755 WeakPolarHBondContact O-CB 3.15Å; R751-A755 PolarHBondContact O-N 2.83Å
752	E	91.1	Very high	93.9	Very high	172 Å²	172	59.3 Å²	59.3	80%	0.804	30%	0.297	S	S	*	.	H	α-helix	trans	-70.5	-46.7	-179.4	-68.9	164.4	-163.6	0	0	111.5	L750 E754 A755 K756	L750-E752 VanDerWaalsContact C-N 3.3Å; L750-E752 PolarHBondContact O-N 3.26Å; E752-E754 PolarHBondContact O-N 2.75Å; E752-A755 PolarHBondContact O-N 3.35Å; E752-K756 PolarHBondContact O-N 3.17Å
753	E	93.2	Very high	94.1	Very high	48 Å²	48	58.8 Å²	58.8	22%	0.224	30%	0.302	C	S	.	.	H	α-helix	trans	-63.3	-39	173.5	-69.1	-67.1	133.6	0	0	112	T686 Y690 L746 L750 K756 I757	T686-E753 WeakPolarHBondContact CG2-OE2 3.21Å; T686-E753 PolarHBondContact OG1-OE2 2.78Å; Y690-E753 HydrophobicContact CD2-CB 4.36Å; Y690-E753 HydrophobicContact CD2-CG 3.79Å; Y690-E753 HydrophobicContact CE2-CG 3.74Å; L746-E753 HydrophobicContact CD1-CB 3.62Å; L750-E753 HydrophobicContact CB-CB 4.23Å; L750-E753 HydrophobicContact CB-CG 4.45Å; L750-E753 PolarHBondContact O-N 3.05Å; E753-K756 PolarHBondContact O-N 3.37Å; E753-I757 WeakPolarHBondContact O-CG2 3.24Å; E753-I757 PolarHBondContact O-N 3.45Å
754	E	95.4	Very high	94.2	Very high	12 Å²	12	57.3 Å²	57.3	6%	0.056	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-40.2	173.4	-70.9	-167.7	165.4	0	0	111.9	R742 R745 L746 L750 E752 E758	R742-E754 IonicContact CZ-OE1 2.87Å; R742-E754 IonicContact CZ-OE2 2.7Å; R742-E754 IonicContact NE-OE1 2.87Å; R742-E754 PolarHBondContact NE-OE1 3.08Å; R742-E754 IonicContact NE-OE2 2.74Å; R742-E754 PolarHBondContact NE-OE2 2.87Å; R742-E754 IonicContact NH2-OE1 3Å; R742-E754 PolarHBondContact NH2-OE1 3.45Å; R742-E754 IonicContact NH2-OE2 2.75Å; R742-E754 PolarHBondContact NH2-OE2 2.92Å; R745-E754 VanDerWaalsContact CA-OE1 3.27Å; R745-E754 WeakPolarHBondContact CA-OE1 3.45Å; L746-E754 HydrophobicContact CB-CG 4.05Å; L746-E754 HydrophobicContact CD1-CG 4.07Å; L746-E754 HydrophobicContact CG-CG 4Å; L746-E754 PolarHBondContact N-OE1 2.97Å; L750-E754 WeakPolarHBondContact O-CG 3.48Å; L750-E754 PolarHBondContact O-N 2.89Å; E752-E754 PolarHBondContact O-N 2.75Å; E754-E758 WeakPolarHBondContact O-CB 3.23Å; E754-E758 PolarHBondContact O-N 2.93Å
755	A	95.7	Very high	94.3	Very high	58 Å²	58	57.2 Å²	57.2	48%	0.479	30%	0.295	S	S	.	.	H	α-helix	trans	-69.1	-36.3	176.2	0	0	0	0	0	112.5	R751 E752 S759	R751-A755 WeakPolarHBondContact O-CB 3.15Å; R751-A755 PolarHBondContact O-N 2.83Å; E752-A755 PolarHBondContact O-N 3.35Å; A755-S759 VanDerWaalsContact O-CB 3.3Å; A755-S759 WeakPolarHBondContact O-CB 3.34Å; A755-S759 PolarHBondContact O-N 2.79Å
756	K	95.3	Very high	94.4	Very high	71 Å²	71	50.8 Å²	50.8	31%	0.309	27%	0.272	S	S	.	.	H	α-helix	trans	-62.9	-53.8	174.8	-174	-177.2	176.1	-168.4	0	111.1	D682 E752 E753 S759 N760	D682-K756 VanDerWaalsContact OD1-CE 3.28Å; D682-K756 WeakPolarHBondContact OD1-CE 3.31Å; D682-K756 IonicContact OD1-NZ 3.16Å; D682-K756 PolarHBondContact OD1-NZ 3.02Å; D682-K756 WeakPolarHBondContact OD2-CE 3.43Å; D682-K756 IonicContact OD2-NZ 2.81Å; D682-K756 PolarHBondContact OD2-NZ 2.86Å; E752-K756 PolarHBondContact O-N 3.17Å; E753-K756 PolarHBondContact O-N 3.37Å; K756-S759 PolarHBondContact O-N 3.1Å; K756-N760 PolarHBondContact O-N 3.35Å; K756-N760 PolarHBondContact O-OD1 2.99Å
757	I	96.4	Very high	94.6	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-70.7	-32.2	-179.2	-161.2	172.6	0	0	0	112.5	L683 T686 L687 F722 F744 L746 E753 L761	L683-I757 HydrophobicContact CD2-CD1 3.76Å; L683-I757 HydrophobicContact CD2-CG1 3.77Å; T686-I757 HydrophobicContact CG2-CB 4.49Å; T686-I757 HydrophobicContact CG2-CD1 4.3Å; L687-I757 HydrophobicContact CD2-CD1 3.67Å; L687-I757 HydrophobicContact CG-CD1 4.36Å; F722-I757 HydrophobicContact CE2-CD1 3.83Å; F722-I757 HydrophobicContact CZ-CD1 3.78Å; F744-I757 HydrophobicContact CB-CG2 4.13Å; L746-I757 HydrophobicContact CD1-CG2 4.2Å; L746-I757 HydrophobicContact CG-CG2 4.44Å; E753-I757 WeakPolarHBondContact O-CG2 3.24Å; E753-I757 PolarHBondContact O-N 3.45Å; I757-L761 HydrophobicContact CD1-CD1 4.38Å; I757-L761 HydrophobicContact CG1-CD1 3.83Å; I757-L761 HydrophobicContact CG1-CG 4.32Å; I757-L761 WeakPolarHBondContact O-CB 3.27Å; I757-L761 WeakPolarHBondContact O-CG 3.22Å; I757-L761 PolarHBondContact O-N 2.66Å; I757-L761 VanDerWaalsContact O-N 3.13Å
758	E	97.1	Very high	94.9	Very high	69 Å²	69	50.8 Å²	50.8	32%	0.322	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-50.8	166.9	174.1	143.1	-151.6	0	0	110.4	F744 E754 N760 L761 Q762	F744-E758 HydrophobicContact CB-CB 3.99Å; F744-E758 HydrophobicContact CD1-CB 4.41Å; F744-E758 HydrophobicContact CD2-CB 3.41Å; F744-E758 VanDerWaalsContact CD2-CB 3.41Å; F744-E758 HydrophobicContact CD2-CG 3.43Å; F744-E758 VanDerWaalsContact CD2-CG 3.43Å; F744-E758 WeakPolarHBondContact CD2-OE2 3.28Å; F744-E758 HydrophobicContact CE2-CB 3.95Å; F744-E758 VanDerWaalsContact CE2-CD 3.47Å; F744-E758 HydrophobicContact CE2-CG 3.54Å; F744-E758 WeakPolarHBondContact CE2-OE1 3.45Å; F744-E758 HydrophobicContact CG-CB 3.67Å; F744-E758 HydrophobicContact CG-CG 4.2Å; F744-E758 HydrophobicContact CZ-CG 4.4Å; E754-E758 WeakPolarHBondContact O-CB 3.23Å; E754-E758 PolarHBondContact O-N 2.93Å; E758-N760 PolarHBondContact O-N 3.11Å; E758-L761 PolarHBondContact O-N 2.8Å; E758-Q762 HydrophobicContact CG-CG 3.68Å; E758-Q762 VanDerWaalsContact O-CB 3.24Å; E758-Q762 WeakPolarHBondContact O-CB 3.41Å; E758-Q762 WeakPolarHBondContact O-CG 3.38Å; E758-Q762 PolarHBondContact O-N 3.36Å; E758-Q762 PolarHBondContact OE1-NE2 3.35Å
759	S	97.5	Very high	95.5	Very high	45 Å²	45	48.8 Å²	48.8	32%	0.315	25%	0.252	S	S	.	.	H	α-helix	trans	-60.1	-48.6	-176.6	-165.1	0	0	0	0	112.1	A755 K756 L761 Q762 S763 R797	A755-S759 VanDerWaalsContact O-CB 3.3Å; A755-S759 WeakPolarHBondContact O-CB 3.34Å; A755-S759 PolarHBondContact O-N 2.79Å; K756-S759 PolarHBondContact O-N 3.1Å; S759-L761 PolarHBondContact O-N 3.33Å; S759-Q762 PolarHBondContact O-N 2.89Å; S759-S763 WeakPolarHBondContact O-CB 3.3Å; S759-S763 PolarHBondContact O-N 3.07Å; S759-S763 PolarHBondContact O-OG 2.87Å; S759-S763 VanDerWaalsContact O-OG 3.07Å; S759-R797 PolarHBondContact OG-NH2 2.78Å
760	N	97.5	Very high	96.2	Very high	31 Å²	31	47 Å²	47	17%	0.166	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-44.4	-180	-71.4	7.5	0	0	0	112	L679 D682 K756 E758 L764	L679-N760 HydrophobicContact CD2-CB 3.91Å; D682-N760 PolarHBondContact OD2-ND2 2.93Å; K756-N760 PolarHBondContact O-N 3.35Å; K756-N760 PolarHBondContact O-OD1 2.99Å; E758-N760 PolarHBondContact O-N 3.11Å; N760-L764 WeakPolarHBondContact O-CB 3.32Å; N760-L764 PolarHBondContact O-N 3.12Å
761	L	98.3	Very high	96.7	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-78.8	-28.5	-178.1	-66	175.5	0	0	0	113.5	F722 F744 I757 E758 S759 A765 V806 L1123	F722-L761 HydrophobicContact CD2-CD1 3.73Å; F722-L761 HydrophobicContact CE2-CD1 4.25Å; F722-L761 HydrophobicContact CG-CD1 4.41Å; F744-L761 HydrophobicContact CD1-CB 4.44Å; F744-L761 HydrophobicContact CD1-CD1 3.93Å; F744-L761 HydrophobicContact CE1-CB 3.64Å; F744-L761 HydrophobicContact CE1-CD1 3.73Å; F744-L761 HydrophobicContact CE1-CG 4.32Å; F744-L761 HydrophobicContact CZ-CB 4.27Å; I757-L761 HydrophobicContact CD1-CD1 4.38Å; I757-L761 HydrophobicContact CG1-CD1 3.83Å; I757-L761 HydrophobicContact CG1-CG 4.32Å; I757-L761 WeakPolarHBondContact O-CB 3.27Å; I757-L761 WeakPolarHBondContact O-CG 3.22Å; I757-L761 PolarHBondContact O-N 2.66Å; I757-L761 VanDerWaalsContact O-N 3.13Å; E758-L761 PolarHBondContact O-N 2.8Å; S759-L761 PolarHBondContact O-N 3.33Å; L761-A765 VanDerWaalsContact O-CB 3.24Å; L761-A765 WeakPolarHBondContact O-CB 3.3Å; L761-A765 PolarHBondContact O-N 3.49Å; L761-V806 HydrophobicContact CB-CG1 4.45Å; L761-V806 HydrophobicContact CD1-CG1 3.98Å; L761-L1123 HydrophobicContact CD2-CD1 4.23Å
762	Q	98.4	Very high	97.1	Very high	17 Å²	17	37.6 Å²	37.6	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-73	-39.4	172.6	-67.3	-81.9	30.1	0	0	111.6	F744 E758 S759 T766 R797	F744-Q762 HydrophobicContact CE2-CG 4.05Å; F744-Q762 HydrophobicContact CZ-CG 4.07Å; E758-Q762 HydrophobicContact CG-CG 3.68Å; E758-Q762 VanDerWaalsContact O-CB 3.24Å; E758-Q762 WeakPolarHBondContact O-CB 3.41Å; E758-Q762 WeakPolarHBondContact O-CG 3.38Å; E758-Q762 PolarHBondContact O-N 3.36Å; E758-Q762 PolarHBondContact OE1-NE2 3.35Å; S759-Q762 PolarHBondContact O-N 2.89Å; Q762-T766 PolarHBondContact O-N 3.31Å; Q762-T766 PolarHBondContact O-OG1 2.97Å; Q762-R797 HydrophobicContact CB-CG 4.28Å
763	S	98.1	Very high	97.5	Very high	41 Å²	41	35 Å²	35	29%	0.287	19%	0.194	S	C	.	.	H	α-helix	trans	-66.1	-49.3	173.8	-62.5	0	0	0	0	110.4	S759 A765 T766 D767 R797	S759-S763 WeakPolarHBondContact O-CB 3.3Å; S759-S763 PolarHBondContact O-N 3.07Å; S759-S763 PolarHBondContact O-OG 2.87Å; S759-S763 VanDerWaalsContact O-OG 3.07Å; S763-A765 VanDerWaalsContact C-N 3.32Å; S763-A765 PolarHBondContact O-N 3.35Å; S763-T766 CarbonylContact O-C 3.57Å; S763-T766 VanDerWaalsContact O-CA 3.31Å; S763-T766 WeakPolarHBondContact O-CA 3.44Å; S763-T766 WeakPolarHBondContact O-CB 3.47Å; S763-T766 PolarHBondContact O-N 3.14Å; S763-D767 VanDerWaalsContact O-CG 3.29Å; S763-D767 PolarHBondContact O-N 3.34Å; S763-R797 PolarHBondContact OG-NE 2.8Å
764	L	98.5	Very high	97.7	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-58.1	-40.8	174.6	-178.5	62.9	0	0	0	112.9	I671 L679 N760 T766 D767 L768 L1123 F1125	I671-L764 HydrophobicContact CD1-CD1 4.26Å; I671-L764 HydrophobicContact CG2-CD1 3.89Å; L679-L764 HydrophobicContact CD1-CD1 4.3Å; L679-L764 HydrophobicContact CD1-CD2 3.89Å; N760-L764 WeakPolarHBondContact O-CB 3.32Å; N760-L764 PolarHBondContact O-N 3.12Å; L764-T766 PolarHBondContact O-N 3.2Å; L764-D767 PolarHBondContact O-N 2.87Å; L764-L768 HydrophobicContact CD1-CD1 4.02Å; L764-L768 HydrophobicContact CD1-CD2 4.2Å; L764-L768 HydrophobicContact CD1-CG 3.86Å; L764-L768 HydrophobicContact CG-CD1 3.9Å; L764-L768 HydrophobicContact CG-CG 4.17Å; L764-L768 WeakPolarHBondContact O-CB 3.22Å; L764-L768 VanDerWaalsContact O-CG 3.23Å; L764-L768 WeakPolarHBondContact O-CG 3.47Å; L764-L768 PolarHBondContact O-N 3.49Å; L764-L1123 HydrophobicContact CD2-CD1 3.45Å; L764-L1123 VanDerWaalsContact CD2-CD1 3.45Å; L764-F1125 HydrophobicContact CB-CZ 4.29Å; L764-F1125 HydrophobicContact CD2-CE2 3.74Å; L764-F1125 HydrophobicContact CD2-CZ 3.72Å; L764-F1125 HydrophobicContact CG-CE2 4.06Å; L764-F1125 HydrophobicContact CG-CZ 3.84Å
765	A	98.6	Very high	97.9	Very high	1 Å²	1	37 Å²	37	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-29.6	173.3	0	0	0	0	0	113	L761 S763 L795 F803 F1125	L761-A765 VanDerWaalsContact O-CB 3.24Å; L761-A765 WeakPolarHBondContact O-CB 3.3Å; L761-A765 PolarHBondContact O-N 3.49Å; S763-A765 VanDerWaalsContact C-N 3.32Å; S763-A765 PolarHBondContact O-N 3.35Å; A765-L795 HydrophobicContact CB-CB 4Å; A765-F803 HydrophobicContact CB-CD2 4.15Å; A765-F1125 HydrophobicContact CB-CD1 4.37Å; A765-F1125 HydrophobicContact CB-CE1 3.86Å
766	T	98.4	Very high	98	Very high	14 Å²	14	34.2 Å²	34.2	9%	0.086	18%	0.179	C	C	.	.	H	α-helix	trans	-76.2	-46.3	175.6	-47.6	0	0	0	0	110.9	Q762 S763 L764 L768 A769 P770 G796 R797 M798	Q762-T766 PolarHBondContact O-N 3.31Å; Q762-T766 PolarHBondContact O-OG1 2.97Å; S763-T766 CarbonylContact O-C 3.57Å; S763-T766 VanDerWaalsContact O-CA 3.31Å; S763-T766 WeakPolarHBondContact O-CA 3.44Å; S763-T766 WeakPolarHBondContact O-CB 3.47Å; S763-T766 PolarHBondContact O-N 3.14Å; L764-T766 PolarHBondContact O-N 3.2Å; T766-L768 VanDerWaalsContact C-N 3.32Å; T766-L768 PolarHBondContact O-N 3.42Å; T766-A769 PolarHBondContact O-N 2.89Å; T766-P770 WeakPolarHBondContact O-CD 3.45Å; T766-G796 WeakPolarHBondContact OG1-CA 3.33Å; T766-R797 PolarHBondContact OG1-N 3.04Å; T766-M798 HydrophobicContact CG2-CB 3.87Å; T766-M798 HydrophobicContact CG2-CE 3.51Å; T766-M798 HydrophobicContact CG2-CG 3.78Å; T766-M798 HydrophobicContact CG2-SD 4.46Å
767	D	97.2	Very high	98.2	Very high	88 Å²	88	33.1 Å²	33.1	47%	0.471	18%	0.179	S	C	.	.	H	α-helix	trans	-65.9	-34.1	-177.7	-55.8	-32	0	0	0	112.3	S763 L764	S763-D767 VanDerWaalsContact O-CG 3.29Å; S763-D767 PolarHBondContact O-N 3.34Å; L764-D767 PolarHBondContact O-N 2.87Å
768	L	98.4	Very high	98.3	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-75.9	-24.5	178.5	-66.2	179.2	0	0	0	113.9	I671 L764 T766 L771 Y772 F803 V829 C831 I1095 F1125	I671-L768 HydrophobicContact CG2-CD2 3.69Å; L764-L768 HydrophobicContact CD1-CD1 4.02Å; L764-L768 HydrophobicContact CD1-CD2 4.2Å; L764-L768 HydrophobicContact CD1-CG 3.86Å; L764-L768 HydrophobicContact CG-CD1 3.9Å; L764-L768 HydrophobicContact CG-CG 4.17Å; L764-L768 WeakPolarHBondContact O-CB 3.22Å; L764-L768 VanDerWaalsContact O-CG 3.23Å; L764-L768 WeakPolarHBondContact O-CG 3.47Å; L764-L768 PolarHBondContact O-N 3.49Å; T766-L768 VanDerWaalsContact C-N 3.32Å; T766-L768 PolarHBondContact O-N 3.42Å; L768-L771 PolarHBondContact O-N 3.15Å; L768-Y772 WeakPolarHBondContact O-CB 3.28Å; L768-Y772 PolarHBondContact O-N 2.81Å; L768-F803 HydrophobicContact CB-CE2 4.08Å; L768-F803 HydrophobicContact CB-CZ 4.35Å; L768-V829 HydrophobicContact CD1-CG1 4.42Å; L768-C831 HydrophobicContact CD1-CB 4.46Å; L768-I1095 HydrophobicContact CD2-CD1 3.33Å; L768-I1095 HydrophobicContact CD2-CG1 3.75Å; L768-I1095 HydrophobicContact CD2-CG2 4.4Å; L768-F1125 HydrophobicContact CD1-CD2 3.64Å; L768-F1125 HydrophobicContact CD1-CE2 3.51Å; L768-F1125 HydrophobicContact CD1-CG 4.38Å; L768-F1125 HydrophobicContact CD1-CZ 4.16Å
769	A	98.4	Very high	98.4	Very high	8 Å²	8	33.1 Å²	33.1	7%	0.066	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-45.9	-173.2	0	0	0	0	0	113.5	T766 L771 Y772 K773 F780 G800 P802	T766-A769 PolarHBondContact O-N 2.89Å; A769-L771 PolarHBondContact O-N 3.08Å; A769-Y772 PolarHBondContact O-N 2.81Å; A769-K773 WeakPolarHBondContact O-CB 3.44Å; A769-K773 PolarHBondContact O-N 3.27Å; A769-F780 HydrophobicContact CB-CE2 4.15Å; A769-F780 WeakPolarHBondContact O-CE2 3.46Å; A769-G800 VanDerWaalsContact CB-O 3.28Å; A769-G800 WeakPolarHBondContact CB-O 3.48Å; A769-P802 HydrophobicContact CB-CG 4.43Å
770	P	98.4	Very high	98.4	Very high	77 Å²	77	31.2 Å²	31.2	50%	0.5	17%	0.17	S	C	.	.	H	α-helix	trans	-60.7	-40.7	173.7	-25.7	35	0	0	0	113.6	T766 K773 K774	T766-P770 WeakPolarHBondContact O-CD 3.45Å; P770-K773 PolarHBondContact O-N 3.44Å; P770-K774 VanDerWaalsContact O-CB 3.31Å; P770-K774 WeakPolarHBondContact O-CB 3.35Å; P770-K774 PolarHBondContact O-N 3.08Å
771	L	98.4	Very high	98.5	Very high	30 Å²	30	34.7 Å²	34.7	16%	0.157	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-40.8	178.2	-178	62.6	0	0	0	111.3	A667 G670 L768 A769 K774 L775 I1095	A667-L771 HydrophobicContact CB-CD2 4.47Å; G670-L771 WeakPolarHBondContact O-CD2 3.23Å; L768-L771 PolarHBondContact O-N 3.15Å; A769-L771 PolarHBondContact O-N 3.08Å; L771-K774 PolarHBondContact O-N 2.81Å; L771-L775 HydrophobicContact CD1-CD1 3.75Å; L771-L775 HydrophobicContact CD1-CG 4.07Å; L771-L775 HydrophobicContact CG-CD1 3.98Å; L771-L775 WeakPolarHBondContact O-CB 3.39Å; L771-L775 WeakPolarHBondContact O-CG 3.47Å; L771-L775 PolarHBondContact O-N 3.12Å; L771-I1095 HydrophobicContact CD2-CB 4.13Å; L771-I1095 HydrophobicContact CD2-CG1 4.03Å; L771-I1095 HydrophobicContact CD2-CG2 4.3Å
772	Y	98.8	Very high	98.5	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-64.5	-45.9	175.2	-180	-152.8	0	0	0	111.6	L768 A769 K774 L775 A776 A779 F780 Q783 P802 F803 S827 V829 I1097	L768-Y772 WeakPolarHBondContact O-CB 3.28Å; L768-Y772 PolarHBondContact O-N 2.81Å; A769-Y772 PolarHBondContact O-N 2.81Å; Y772-K774 VanDerWaalsContact C-N 3.28Å; Y772-K774 PolarHBondContact O-N 3.29Å; Y772-L775 PolarHBondContact O-N 3.45Å; Y772-A776 HydrophobicContact CD2-CB 4.07Å; Y772-A776 HydrophobicContact CE2-CB 3.84Å; Y772-A776 CarbonylContact O-C 3.57Å; Y772-A776 PolarHBondContact O-N 2.95Å; Y772-A779 HydrophobicContact CE2-CB 4.02Å; Y772-A779 VanDerWaalsContact OH-C 3.25Å; Y772-A779 VanDerWaalsContact OH-CB 3.26Å; Y772-A779 WeakPolarHBondContact OH-CB 3.38Å; Y772-A779 PolarHBondContact OH-O 2.95Å; Y772-F780 HydrophobicContact CD1-CB 4.27Å; Y772-F780 AromaticContact CD1-CD2 3.75Å; Y772-F780 HydrophobicContact CD1-CD2 3.75Å; Y772-F780 HydrophobicContact CE1-CB 4.19Å; Y772-F780 HydrophobicContact CE1-CD2 4.28Å; Y772-F780 HydrophobicContact CE2-CB 4.48Å; Y772-F780 HydrophobicContact CG-CB 4.41Å; Y772-F780 HydrophobicContact CG-CD2 4.13Å; Y772-Q783 PolarHBondContact OH-OE1 3.42Å; Y772-P802 HydrophobicContact CD1-CB 4.06Å; Y772-P802 HydrophobicContact CD1-CG 3.73Å; Y772-P802 HydrophobicContact CE1-CB 3.85Å; Y772-P802 HydrophobicContact CE1-CG 4.06Å; Y772-F803 AromaticContact CD1-CE1 3.82Å; Y772-F803 HydrophobicContact CD1-CE1 3.82Å; Y772-F803 AromaticContact CD1-CZ 3.82Å; Y772-F803 HydrophobicContact CD1-CZ 3.82Å; Y772-F803 HydrophobicContact CE1-CE1 4.11Å; Y772-S827 WeakPolarHBondContact CE2-OG 3.24Å; Y772-S827 VanDerWaalsContact CZ-OG 3.22Å; Y772-S827 PolarHBondContact OH-N 3.47Å; Y772-S827 PolarHBondContact OH-OG 3.31Å; Y772-V829 HydrophobicContact CD1-CG2 3.9Å; Y772-V829 HydrophobicContact CD2-CG2 3.96Å; Y772-V829 HydrophobicContact CE1-CG2 4.19Å; Y772-V829 HydrophobicContact CE2-CG2 4.22Å; Y772-V829 HydrophobicContact CG-CG2 3.81Å; Y772-I1097 HydrophobicContact CD2-CD1 4.14Å; Y772-I1097 HydrophobicContact CD2-CG2 4.14Å; Y772-I1097 HydrophobicContact CE2-CG2 3.94Å
773	K	98.7	Very high	98.5	Very high	116 Å²	116	35.9 Å²	35.9	50%	0.504	19%	0.192	S	C	.	.	H	α-helix	trans	-56.6	-40.5	173.4	-172.4	173.4	-175.6	171.5	0	112.2	A769 P770 P777 F780	A769-K773 WeakPolarHBondContact O-CB 3.44Å; A769-K773 PolarHBondContact O-N 3.27Å; P770-K773 PolarHBondContact O-N 3.44Å; K773-P777 VanDerWaalsContact O-CA 3.23Å; K773-P777 WeakPolarHBondContact O-CA 3.45Å; K773-P777 VanDerWaalsContact O-CB 3.3Å; K773-P777 WeakPolarHBondContact O-CB 3.26Å; K773-F780 HydrophobicContact CB-CB 4.4Å; K773-F780 HydrophobicContact CB-CD1 3.85Å; K773-F780 HydrophobicContact CB-CD2 3.68Å; K773-F780 HydrophobicContact CB-CE1 4.01Å; K773-F780 HydrophobicContact CB-CE2 3.83Å; K773-F780 HydrophobicContact CB-CG 3.7Å; K773-F780 HydrophobicContact CB-CZ 4Å; K773-F780 HydrophobicContact CD-CD1 4.04Å; K773-F780 HydrophobicContact CD-CE1 3.64Å; K773-F780 HydrophobicContact CD-CZ 3.99Å; K773-F780 HydrophobicContact CG-CD1 3.7Å; K773-F780 HydrophobicContact CG-CD2 4.45Å; K773-F780 HydrophobicContact CG-CE1 3.84Å; K773-F780 HydrophobicContact CG-CG 4.05Å; K773-F780 HydrophobicContact CG-CZ 4.27Å
774	K	98.4	Very high	98.5	Very high	102 Å²	102	34.8 Å²	34.8	44%	0.443	18%	0.183	S	C	.	.	H	α-helix	trans	-68.5	-46.2	178.8	-177.7	173.5	177	-176.9	0	112.6	R602 Y603 P770 L771 Y772	R602-K774 WeakPolarHBondContact O-CE 3.11Å; R602-K774 WeakPolarHBondContact O-CG 3.4Å; Y603-K774 WeakPolarHBondContact O-CE 3.08Å; Y603-K774 PolarHBondContact O-NZ 3.32Å; P770-K774 VanDerWaalsContact O-CB 3.31Å; P770-K774 WeakPolarHBondContact O-CB 3.35Å; P770-K774 PolarHBondContact O-N 3.08Å; L771-K774 PolarHBondContact O-N 2.81Å; Y772-K774 VanDerWaalsContact C-N 3.28Å; Y772-K774 PolarHBondContact O-N 3.29Å
775	L	98.7	Very high	98.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-83.9	-34.5	-173.5	-69.9	178	0	0	0	114.4	M599 R602 Y603 L644 I665 A667 L771 Y772 I1097	M599-L775 HydrophobicContact CE-CD2 4.33Å; R602-L775 WeakPolarHBondContact CD-O 3.3Å; R602-L775 PolarHBondContact NH1-O 3Å; Y603-L775 HydrophobicContact CD2-CD2 4.16Å; L644-L775 HydrophobicContact CD1-CD1 4.07Å; L644-L775 HydrophobicContact CD1-CD2 3.8Å; L644-L775 HydrophobicContact CD2-CD2 4.05Å; I665-L775 HydrophobicContact CG2-CD1 4.2Å; A667-L775 HydrophobicContact CB-CD1 4.05Å; L771-L775 HydrophobicContact CD1-CD1 3.75Å; L771-L775 HydrophobicContact CD1-CG 4.07Å; L771-L775 HydrophobicContact CG-CD1 3.98Å; L771-L775 WeakPolarHBondContact O-CB 3.39Å; L771-L775 WeakPolarHBondContact O-CG 3.47Å; L771-L775 PolarHBondContact O-N 3.12Å; Y772-L775 PolarHBondContact O-N 3.45Å; L775-I1097 HydrophobicContact CB-CD1 3.78Å; L775-I1097 HydrophobicContact CD1-CD1 3.91Å
776	A	98.7	Very high	98.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.			trans	-138.5	64.9	-178.3	0	0	0	0	0	111.2	L586 I665 Y772 V778 A779 F780 I1097	L586-A776 HydrophobicContact CD2-CB 3.97Å; I665-A776 HydrophobicContact CD1-CB 4.28Å; Y772-A776 HydrophobicContact CD2-CB 4.07Å; Y772-A776 HydrophobicContact CE2-CB 3.84Å; Y772-A776 CarbonylContact O-C 3.57Å; Y772-A776 PolarHBondContact O-N 2.95Å; A776-V778 VanDerWaalsContact C-N 3.32Å; A776-V778 PolarHBondContact O-N 2.83Å; A776-A779 HydrophobicContact CB-CB 4.23Å; A776-A779 PolarHBondContact O-N 2.84Å; A776-F780 PolarHBondContact O-N 3.19Å; A776-I1097 HydrophobicContact CB-CG2 4.32Å
777	P	98.7	Very high	98.2	Very high	49 Å²	49	43.6 Å²	43.6	32%	0.318	23%	0.227	S	C	.	.	H	α-helix	trans	-57.6	-37.5	-169.8	18.4	-31.9	0	0	0	114.4	K773 Q781	K773-P777 VanDerWaalsContact O-CA 3.23Å; K773-P777 WeakPolarHBondContact O-CA 3.45Å; K773-P777 VanDerWaalsContact O-CB 3.3Å; K773-P777 WeakPolarHBondContact O-CB 3.26Å; P777-Q781 WeakPolarHBondContact O-CB 3.23Å; P777-Q781 PolarHBondContact O-N 3.45Å
778	V	98.6	Very high	98.1	Very high	71 Å²	71	44 Å²	44	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-68.5	-46.6	179.9	179.6	0	0	0	0	110.8	H585 A776 F780 Q781 N782	H585-V778 HydrophobicContact CB-CB 4.38Å; H585-V778 HydrophobicContact CB-CG1 3.95Å; A776-V778 VanDerWaalsContact C-N 3.32Å; A776-V778 PolarHBondContact O-N 2.83Å; V778-F780 VanDerWaalsContact C-N 3.33Å; V778-F780 PolarHBondContact O-N 3.12Å; V778-Q781 PolarHBondContact O-N 3.34Å; V778-N782 PolarHBondContact O-N 3.44Å; V778-N782 PolarHBondContact O-ND2 3.4Å; V778-N782 VanDerWaalsContact O-ND2 3.13Å; V778-N782 PolarHBondContact O-OD1 3.49Å
779	A	98.7	Very high	97.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-40.7	176.2	0	0	0	0	0	112.3	H585 L586 Y772 A776 Q783	H585-A779 HydrophobicContact CB-CB 4.19Å; H585-A779 PolarHBondContact O-N 2.85Å; H585-A779 VanDerWaalsContact O-N 3.16Å; L586-A779 HydrophobicContact CD2-CB 4.27Å; Y772-A779 HydrophobicContact CE2-CB 4.02Å; Y772-A779 VanDerWaalsContact OH-C 3.25Å; Y772-A779 VanDerWaalsContact OH-CB 3.26Å; Y772-A779 WeakPolarHBondContact OH-CB 3.38Å; Y772-A779 PolarHBondContact OH-O 2.95Å; A776-A779 HydrophobicContact CB-CB 4.23Å; A776-A779 PolarHBondContact O-N 2.84Å; A779-Q783 PolarHBondContact O-N 3.23Å
780	F	98.8	Very high	97.7	Very high	5 Å²	5	46 Å²	46	2%	0.022	26%	0.259	C	S	.	.	H	α-helix	trans	-59.8	-50.5	172.5	176.5	-83.1	0	0	0	111.4	A769 Y772 K773 A776 V778 N782 Q783 V784 P802	A769-F780 HydrophobicContact CB-CE2 4.15Å; A769-F780 WeakPolarHBondContact O-CE2 3.46Å; Y772-F780 HydrophobicContact CD1-CB 4.27Å; Y772-F780 AromaticContact CD1-CD2 3.75Å; Y772-F780 HydrophobicContact CD1-CD2 3.75Å; Y772-F780 HydrophobicContact CE1-CB 4.19Å; Y772-F780 HydrophobicContact CE1-CD2 4.28Å; Y772-F780 HydrophobicContact CE2-CB 4.48Å; Y772-F780 HydrophobicContact CG-CB 4.41Å; Y772-F780 HydrophobicContact CG-CD2 4.13Å; K773-F780 HydrophobicContact CB-CB 4.4Å; K773-F780 HydrophobicContact CB-CD1 3.85Å; K773-F780 HydrophobicContact CB-CD2 3.68Å; K773-F780 HydrophobicContact CB-CE1 4.01Å; K773-F780 HydrophobicContact CB-CE2 3.83Å; K773-F780 HydrophobicContact CB-CG 3.7Å; K773-F780 HydrophobicContact CB-CZ 4Å; K773-F780 HydrophobicContact CD-CD1 4.04Å; K773-F780 HydrophobicContact CD-CE1 3.64Å; K773-F780 HydrophobicContact CD-CZ 3.99Å; K773-F780 HydrophobicContact CG-CD1 3.7Å; K773-F780 HydrophobicContact CG-CD2 4.45Å; K773-F780 HydrophobicContact CG-CE1 3.84Å; K773-F780 HydrophobicContact CG-CG 4.05Å; K773-F780 HydrophobicContact CG-CZ 4.27Å; A776-F780 PolarHBondContact O-N 3.19Å; V778-F780 VanDerWaalsContact C-N 3.33Å; V778-F780 PolarHBondContact O-N 3.12Å; F780-N782 VanDerWaalsContact C-N 3.32Å; F780-N782 PolarHBondContact O-N 3.3Å; F780-Q783 PolarHBondContact O-N 3.41Å; F780-V784 HydrophobicContact CD1-CG1 4.36Å; F780-V784 HydrophobicContact CD1-CG2 4.08Å; F780-V784 HydrophobicContact CE1-CB 4.42Å; F780-V784 HydrophobicContact CE1-CG1 3.77Å; F780-V784 HydrophobicContact CE1-CG2 3.76Å; F780-V784 HydrophobicContact CE2-CG1 4.29Å; F780-V784 HydrophobicContact CZ-CG1 3.74Å; F780-V784 PolarHBondContact O-N 2.95Å; F780-V784 VanDerWaalsContact O-N 3.12Å; F780-P802 HydrophobicContact CD2-CB 4.1Å; F780-P802 HydrophobicContact CD2-CG 3.8Å; F780-P802 HydrophobicContact CE2-CB 4.23Å; F780-P802 HydrophobicContact CE2-CG 3.67Å
781	Q	98.7	Very high	97.5	Very high	103 Å²	103	46.2 Å²	46.2	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-60.5	-42.2	-176.5	-170.3	59.3	40.6	0	0	111.7	P777 V778 Q783 V784 E785	P777-Q781 WeakPolarHBondContact O-CB 3.23Å; P777-Q781 PolarHBondContact O-N 3.45Å; V778-Q781 PolarHBondContact O-N 3.34Å; Q781-Q783 PolarHBondContact O-N 3.2Å; Q781-V784 WeakPolarHBondContact O-CG2 3.47Å; Q781-V784 PolarHBondContact O-N 2.55Å; Q781-E785 PolarHBondContact O-N 3.34Å
782	N	98.4	Very high	97.4	Very high	42 Å²	42	45.9 Å²	45.9	23%	0.225	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-28.8	175.7	-62.8	-23.7	0	0	0	112.8	V778 F780 M823 N825	V778-N782 PolarHBondContact O-N 3.44Å; V778-N782 PolarHBondContact O-ND2 3.4Å; V778-N782 VanDerWaalsContact O-ND2 3.13Å; V778-N782 PolarHBondContact O-OD1 3.49Å; F780-N782 VanDerWaalsContact C-N 3.32Å; F780-N782 PolarHBondContact O-N 3.3Å; N782-M823 WeakPolarHBondContact O-CE 3.44Å; N782-N825 WeakPolarHBondContact ND2-CB 3.31Å; N782-N825 PolarHBondContact ND2-O 2.81Å
783	Q	98.5	Very high	97.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-83	-37.1	179.6	-82	173.8	-129	0	0	112.8	Y772 A779 F780 Q781 R794 P802 M823 S827 Q1127	Y772-Q783 PolarHBondContact OH-OE1 3.42Å; A779-Q783 PolarHBondContact O-N 3.23Å; F780-Q783 PolarHBondContact O-N 3.41Å; Q781-Q783 PolarHBondContact O-N 3.2Å; Q783-R794 PolarHBondContact O-NH2 3.39Å; Q783-P802 HydrophobicContact CB-CB 3.6Å; Q783-P802 PolarHBondContact NE2-O 3.39Å; Q783-M823 HydrophobicContact CB-SD 4.42Å; Q783-M823 HydrophobicContact CG-CE 4.49Å; Q783-M823 HydrophobicContact CG-CG 4.33Å; Q783-M823 HydrophobicContact CG-SD 3.57Å; Q783-M823 VanDerWaalsContact CG-SD 3.57Å; Q783-S827 PolarHBondContact OE1-O 3.29Å; Q783-Q1127 VanDerWaalsContact CB-OE1 3.29Å; Q783-Q1127 HydrophobicContact CG-CB 4.14Å; Q783-Q1127 PolarHBondContact O-NE2 3.11Å; Q783-Q1127 PolarHBondContact O-OE1 3.39Å
784	V	98.3	Very high	97.3	Very high	18 Å²	18	40.6 Å²	40.6	11%	0.109	24%	0.235	C	C	.	.	H	α-helix	trans	-83.3	-11.8	177	-58.2	0	0	0	0	114.5	F780 Q781 C786 E787 P802	F780-V784 HydrophobicContact CD1-CG1 4.36Å; F780-V784 HydrophobicContact CD1-CG2 4.08Å; F780-V784 HydrophobicContact CE1-CB 4.42Å; F780-V784 HydrophobicContact CE1-CG1 3.77Å; F780-V784 HydrophobicContact CE1-CG2 3.76Å; F780-V784 HydrophobicContact CE2-CG1 4.29Å; F780-V784 HydrophobicContact CZ-CG1 3.74Å; F780-V784 PolarHBondContact O-N 2.95Å; F780-V784 VanDerWaalsContact O-N 3.12Å; Q781-V784 WeakPolarHBondContact O-CG2 3.47Å; Q781-V784 PolarHBondContact O-N 2.55Å; V784-C786 PolarHBondContact O-N 2.74Å; V784-E787 HydrophobicContact CB-CB 4.38Å; V784-E787 WeakPolarHBondContact O-CB 3.26Å; V784-E787 PolarHBondContact O-N 2.93Å; V784-P802 HydrophobicContact CG1-CB 4.05Å
785	E	97.1	Very high	97.3	Very high	144 Å²	144	35.7 Å²	35.7	67%	0.673	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-43.2	-43.5	177.1	-179.2	-175.4	-147.6	0	0	113.5	Q781	Q781-E785 PolarHBondContact O-N 3.34Å
786	C	95.3	Very high	97.2	Very high	34 Å²	34	36.3 Å²	36.3	23%	0.23	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	33	178.1	-66.7	0	0	0	0	113.1	V784 G790 R794 N1132	V784-C786 PolarHBondContact O-N 2.74Å; C786-G790 PolarHBondContact O-N 3.46Å; C786-R794 PolarHBondContact O-NH2 3.07Å; C786-R794 VanDerWaalsContact O-NH2 3.15Å; C786-N1132 HydrophobicContact CB-CB 3.69Å; C786-N1132 WeakPolarHBondContact CB-ND2 3.34Å; C786-N1132 PolarHBondContact SG-ND2 3.29Å
787	E	96.8	Very high	97.2	Very high	25 Å²	25	42.7 Å²	42.7	12%	0.117	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-50.2	-179.8	175.9	170.5	168.2	0	0	112.4	V784 G790 D791 R794 G800 R801	V784-E787 HydrophobicContact CB-CB 4.38Å; V784-E787 WeakPolarHBondContact O-CB 3.26Å; V784-E787 PolarHBondContact O-N 2.93Å; E787-G790 CarbonylContact O-C 3.6Å; E787-G790 PolarHBondContact O-N 2.85Å; E787-D791 VanDerWaalsContact O-CA 3.32Å; E787-D791 WeakPolarHBondContact O-CA 3.41Å; E787-D791 PolarHBondContact O-N 3.43Å; E787-R794 HydrophobicContact CG-CG 4.49Å; E787-G800 PolarHBondContact OE1-N 3.29Å; E787-G800 WeakPolarHBondContact OE2-CA 3.05Å; E787-G800 PolarHBondContact OE2-N 3.21Å; E787-G800 VanDerWaalsContact OE2-N 3.11Å; E787-R801 VanDerWaalsContact CD-N 3.29Å; E787-R801 HydrophobicContact CG-CB 4.23Å; E787-R801 WeakPolarHBondContact OE1-CB 3.43Å; E787-R801 VanDerWaalsContact OE1-CD 3.31Å; E787-R801 WeakPolarHBondContact OE1-CD 3.32Å; E787-R801 WeakPolarHBondContact OE1-CG 3.46Å; E787-R801 PolarHBondContact OE1-N 3Å; E787-R801 IonicContact OE1-NE 3.56Å; E787-R801 PolarHBondContact OE2-N 3.21Å
788	A	94.9	Very high	97	Very high	96 Å²	96	46.1 Å²	46.1	79%	0.793	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-39.8	-175.7	0	0	0	0	0	113
789	A	94.1	Very high	96.9	Very high	52 Å²	52	51.5 Å²	51.5	43%	0.43	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-34	176.3	0	0	0	0	0	112.5	N1132 E1133 P1134	A789-N1132 CarbonylContact C-O 3.6Å; A789-N1132 VanDerWaalsContact C-O 3.25Å; A789-N1132 WeakPolarHBondContact CB-O 3.4Å; A789-E1133 CarbonylContact O-C 3.5Å; A789-P1134 WeakPolarHBondContact O-CA 3.29Å; A789-P1134 WeakPolarHBondContact O-CB 3.45Å; A789-P1134 WeakPolarHBondContact O-CD 3.35Å
790	G	93.8	Very high	96.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	27.1	-178.7	0	0	0	0	0	114.3	C786 E787 A792 C793 R794 N1132	C786-G790 PolarHBondContact O-N 3.46Å; E787-G790 CarbonylContact O-C 3.6Å; E787-G790 PolarHBondContact O-N 2.85Å; G790-A792 PolarHBondContact O-N 3.01Å; G790-C793 CarbonylContact O-C 3.5Å; G790-C793 WeakPolarHBondContact O-CA 3.46Å; G790-C793 VanDerWaalsContact O-CB 3.28Å; G790-C793 WeakPolarHBondContact O-CB 3.22Å; G790-C793 PolarHBondContact O-N 3.43Å; G790-R794 PolarHBondContact O-N 3.04Å; G790-R794 PolarHBondContact O-NH1 3.34Å; G790-N1132 PolarHBondContact N-O 2.87Å
791	D	94.8	Very high	96.8	Very high	82 Å²	82	55.6 Å²	55.6	44%	0.439	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-54.3	-51.1	-168.2	78.4	-50.8	0	0	0	112.7	E787 C793 R794	E787-D791 VanDerWaalsContact O-CA 3.32Å; E787-D791 WeakPolarHBondContact O-CA 3.41Å; E787-D791 PolarHBondContact O-N 3.43Å; D791-C793 PolarHBondContact O-N 2.91Å; D791-C793 VanDerWaalsContact O-N 3.15Å; D791-R794 PolarHBondContact O-N 2.97Å
792	A	95.9	Very high	96.8	Very high	23 Å²	23	50.7 Å²	50.7	19%	0.19	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-60.1	-31	178.7	0	0	0	0	0	110.8	K743 G790 R794 H1136	K743-A792 WeakPolarHBondContact CE-O 3.46Å; K743-A792 PolarHBondContact NZ-O 2.93Å; G790-A792 PolarHBondContact O-N 3.01Å; A792-R794 VanDerWaalsContact C-N 3.34Å; A792-H1136 PolarHBondContact O-CE1 3.16Å
793	C	98	Very high	96.8	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.007	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-79.2	-5.9	177	-83.1	0	0	0	0	115.1	C724 G790 D791 S804 L1131 H1136	C724-C793 HydrophobicContact CB-CB 4.41Å; G790-C793 CarbonylContact O-C 3.5Å; G790-C793 WeakPolarHBondContact O-CA 3.46Å; G790-C793 VanDerWaalsContact O-CB 3.28Å; G790-C793 WeakPolarHBondContact O-CB 3.22Å; G790-C793 PolarHBondContact O-N 3.43Å; D791-C793 PolarHBondContact O-N 2.91Å; D791-C793 VanDerWaalsContact O-N 3.15Å; C793-S804 WeakPolarHBondContact O-CA 3.48Å; C793-S804 VanDerWaalsContact O-CB 3.27Å; C793-S804 WeakPolarHBondContact O-CB 3.18Å; C793-L1131 HydrophobicContact CB-CB 4.1Å; C793-L1131 WeakPolarHBondContact CB-O 3.5Å; C793-H1136 PolarHBondContact SG-ND1 2.84Å
794	R	98.2	Very high	96.8	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.015	26%	0.264	C	S	.	.			trans	-91.9	168.2	179.3	-61.4	-49.3	-174.6	-87.4	8.9	114.9	K743 Q783 C786 E787 G790 D791 A792 R801 F803 L1131	K743-R794 PolarHBondContact NZ-O 3.19Å; Q783-R794 PolarHBondContact O-NH2 3.39Å; C786-R794 PolarHBondContact O-NH2 3.07Å; C786-R794 VanDerWaalsContact O-NH2 3.15Å; E787-R794 HydrophobicContact CG-CG 4.49Å; G790-R794 PolarHBondContact O-N 3.04Å; G790-R794 PolarHBondContact O-NH1 3.34Å; D791-R794 PolarHBondContact O-N 2.97Å; A792-R794 VanDerWaalsContact C-N 3.34Å; R794-R801 HydrophobicContact CB-CB 3.86Å; R794-R801 WeakPolarHBondContact CD-O 3.45Å; R794-R801 HydrophobicContact CG-CB 4.11Å; R794-R801 PolarHBondContact NE-O 3.09Å; R794-F803 CarbonylContact C-O 3.5Å; R794-F803 VanDerWaalsContact CA-O 3.32Å; R794-F803 WeakPolarHBondContact CA-O 3.5Å; R794-L1131 PolarHBondContact NH1-O 2.81Å
795	L	98.4	Very high	96.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-126.2	151.4	169.7	-58.3	-179.3	0	0	0	109.3	K743 F744 A765 R801 F803 V806	K743-L795 HydrophobicContact CD-CD2 4.19Å; F744-L795 HydrophobicContact CE2-CD2 4.14Å; F744-L795 HydrophobicContact CZ-CD2 3.79Å; A765-L795 HydrophobicContact CB-CB 4Å; L795-R801 WeakPolarHBondContact O-CB 3.37Å; L795-F803 HydrophobicContact CB-CB 4.33Å; L795-F803 PolarHBondContact N-O 2.65Å; L795-V806 HydrophobicContact CD1-CB 4.36Å; L795-V806 HydrophobicContact CD1-CG1 4.12Å
796	G	97.7	Very high	96.9	Very high	13 Å²	13	41 Å²	41	13%	0.134	23%	0.227	C	C	.	.			trans	108.7	150.8	-170.5	0	0	0	0	0	111.7	T766 R801	T766-G796 WeakPolarHBondContact OG1-CA 3.33Å; G796-R801 PolarHBondContact O-NE 3.16Å
797	R	96.9	Very high	97.1	Very high	133 Å²	133	39.3 Å²	39.3	50%	0.502	22%	0.216	S	C	.	.	S	Bend	trans	-99.6	-45.1	-174.3	-60.4	-178.5	179.5	-82.1	10.9	112.3	S759 Q762 S763 T766 R801	S759-R797 PolarHBondContact OG-NH2 2.78Å; Q762-R797 HydrophobicContact CB-CG 4.28Å; S763-R797 PolarHBondContact OG-NE 2.8Å; T766-R797 PolarHBondContact OG1-N 3.04Å; R797-R801 PolarHBondContact O-NH2 2.87Å
798	M	95.7	Very high	97.2	Very high	122 Å²	122	38.2 Å²	38.2	60%	0.601	21%	0.211	S	C	*	.	S	Bend	trans	-78	173.8	174	-61.7	-165.8	-71.2	0	0	111.7	T766 R801	T766-M798 HydrophobicContact CG2-CB 3.87Å; T766-M798 HydrophobicContact CG2-CE 3.51Å; T766-M798 HydrophobicContact CG2-CG 3.78Å; T766-M798 HydrophobicContact CG2-SD 4.46Å; M798-R801 WeakPolarHBondContact O-CG 3.45Å; M798-R801 PolarHBondContact O-NE 3.01Å
799	E	95.4	Very high	97.3	Very high	184 Å²	184	34.2 Å²	34.2	86%	0.86	18%	0.177	S	C	*	.	S	Bend	trans	-65.5	151.5	170.9	-172.6	-172.4	155	0	0	111.3
800	G	97.8	Very high	97.5	Very high	16 Å²	16	31.9 Å²	31.9	17%	0.165	16%	0.158	C	C	.	.			trans	87.6	63.3	-179	0	0	0	0	0	110.4	A769 E787 P802	A769-G800 VanDerWaalsContact CB-O 3.28Å; A769-G800 WeakPolarHBondContact CB-O 3.48Å; E787-G800 PolarHBondContact OE1-N 3.29Å; E787-G800 WeakPolarHBondContact OE2-CA 3.05Å; E787-G800 PolarHBondContact OE2-N 3.21Å; E787-G800 VanDerWaalsContact OE2-N 3.11Å; G800-P802 VanDerWaalsContact C-CD 3.45Å; G800-P802 WeakPolarHBondContact O-CD 3.05Å
801	R	98.4	Very high	97.7	Very high	74 Å²	74	31.9 Å²	31.9	28%	0.279	16%	0.158	S	C	.	.			trans	-107.9	79.5	-170.5	-60.9	170.7	-175.9	162.4	-1.4	111.4	E787 R794 L795 G796 R797 M798 F803	E787-R801 VanDerWaalsContact CD-N 3.29Å; E787-R801 HydrophobicContact CG-CB 4.23Å; E787-R801 WeakPolarHBondContact OE1-CB 3.43Å; E787-R801 VanDerWaalsContact OE1-CD 3.31Å; E787-R801 WeakPolarHBondContact OE1-CD 3.32Å; E787-R801 WeakPolarHBondContact OE1-CG 3.46Å; E787-R801 PolarHBondContact OE1-N 3Å; E787-R801 IonicContact OE1-NE 3.56Å; E787-R801 PolarHBondContact OE2-N 3.21Å; R794-R801 HydrophobicContact CB-CB 3.86Å; R794-R801 WeakPolarHBondContact CD-O 3.45Å; R794-R801 HydrophobicContact CG-CB 4.11Å; R794-R801 PolarHBondContact NE-O 3.09Å; L795-R801 WeakPolarHBondContact O-CB 3.37Å; G796-R801 PolarHBondContact O-NE 3.16Å; R797-R801 PolarHBondContact O-NH2 2.87Å; M798-R801 WeakPolarHBondContact O-CG 3.45Å; M798-R801 PolarHBondContact O-NE 3.01Å; R801-F803 VanDerWaalsContact C-N 3.26Å; R801-F803 PolarHBondContact O-N 3.02Å
802	P	98.4	Very high	97.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.138	C	C	.	.			trans	-76.6	-6.5	-176	32.3	-39.2	0	0	0	114	A769 Y772 F780 Q783 V784 G800 Q1127	A769-P802 HydrophobicContact CB-CG 4.43Å; Y772-P802 HydrophobicContact CD1-CB 4.06Å; Y772-P802 HydrophobicContact CD1-CG 3.73Å; Y772-P802 HydrophobicContact CE1-CB 3.85Å; Y772-P802 HydrophobicContact CE1-CG 4.06Å; F780-P802 HydrophobicContact CD2-CB 4.1Å; F780-P802 HydrophobicContact CD2-CG 3.8Å; F780-P802 HydrophobicContact CE2-CB 4.23Å; F780-P802 HydrophobicContact CE2-CG 3.67Å; Q783-P802 HydrophobicContact CB-CB 3.6Å; Q783-P802 PolarHBondContact NE2-O 3.39Å; V784-P802 HydrophobicContact CG1-CB 4.05Å; G800-P802 VanDerWaalsContact C-CD 3.45Å; G800-P802 WeakPolarHBondContact O-CD 3.05Å; P802-Q1127 PolarHBondContact O-OE1 3.39Å
803	F	98.8	Very high	98	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-104.9	135.6	-171.8	-50.3	-55	0	0	0	111.1	A765 L768 Y772 R794 L795 R801 V829 F1125	A765-F803 HydrophobicContact CB-CD2 4.15Å; L768-F803 HydrophobicContact CB-CE2 4.08Å; L768-F803 HydrophobicContact CB-CZ 4.35Å; Y772-F803 AromaticContact CD1-CE1 3.82Å; Y772-F803 HydrophobicContact CD1-CE1 3.82Å; Y772-F803 AromaticContact CD1-CZ 3.82Å; Y772-F803 HydrophobicContact CD1-CZ 3.82Å; Y772-F803 HydrophobicContact CE1-CE1 4.11Å; R794-F803 CarbonylContact C-O 3.5Å; R794-F803 VanDerWaalsContact CA-O 3.32Å; R794-F803 WeakPolarHBondContact CA-O 3.5Å; L795-F803 HydrophobicContact CB-CB 4.33Å; L795-F803 PolarHBondContact N-O 2.65Å; R801-F803 VanDerWaalsContact C-N 3.26Å; R801-F803 PolarHBondContact O-N 3.02Å; F803-V829 HydrophobicContact CE1-CB 3.97Å; F803-V829 HydrophobicContact CE1-CG2 3.74Å; F803-V829 HydrophobicContact CZ-CB 4.16Å; F803-V829 HydrophobicContact CZ-CG1 4.49Å; F803-V829 HydrophobicContact CZ-CG2 4.01Å; F803-F1125 HydrophobicContact CB-CD1 4.31Å; F803-F1125 HydrophobicContact CD1-CB 3.65Å; F803-F1125 HydrophobicContact CD2-CB 4.4Å; F803-F1125 HydrophobicContact CD2-CD1 4.14Å; F803-F1125 HydrophobicContact CE1-CB 3.88Å; F803-F1125 HydrophobicContact CG-CB 3.93Å; F803-F1125 HydrophobicContact CG-CD1 4.13Å; F803-F1125 HydrophobicContact CG-CG 4.43Å; F803-F1125 HydrophobicContact CZ-CB 4.35Å
804	S	98.5	Very high	98	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-101.4	-31.5	171.1	80.4	0	0	0	0	113	C724 C793 Y1126 Q1127 H1128 L1131	C724-S804 WeakPolarHBondContact CA-O 3.24Å; C724-S804 WeakPolarHBondContact CB-O 3.34Å; C724-S804 PolarHBondContact N-O 2.87Å; C724-S804 CarbonylContact O-C 3.55Å; C724-S804 PolarHBondContact O-OG 3.02Å; C793-S804 WeakPolarHBondContact O-CA 3.48Å; C793-S804 VanDerWaalsContact O-CB 3.27Å; C793-S804 WeakPolarHBondContact O-CB 3.18Å; S804-Y1126 PolarHBondContact N-O 2.86Å; S804-Y1126 PolarHBondContact OG-O 2.9Å; S804-Q1127 WeakPolarHBondContact OG-CA 3.46Å; S804-H1128 PolarHBondContact OG-N 3.48Å; S804-L1131 VanDerWaalsContact OG-CD1 3.22Å; S804-L1131 WeakPolarHBondContact OG-CD1 3.45Å
805	G	98.4	Very high	98	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	162.2	-174.9	0	0	0	0	0	111.5	F722 Y1126	F722-G805 WeakPolarHBondContact O-CA 3.23Å; G805-Y1126 PolarHBondContact N-O 2.91Å; G805-Y1126 VanDerWaalsContact N-O 3.08Å; G805-Y1126 PolarHBondContact O-N 3.3Å
806	V	98.8	Very high	98	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	139.8	175.7	60.2	0	0	0	0	109.1	F722 F744 L761 L795 L1123 V1124 F1125	F722-V806 HydrophobicContact CB-CG1 4.07Å; F722-V806 PolarHBondContact N-O 3.19Å; F722-V806 PolarHBondContact O-N 3.12Å; F722-V806 VanDerWaalsContact O-N 3.15Å; F744-V806 HydrophobicContact CE1-CG1 4.42Å; L761-V806 HydrophobicContact CB-CG1 4.45Å; L761-V806 HydrophobicContact CD1-CG1 3.98Å; L795-V806 HydrophobicContact CD1-CB 4.36Å; L795-V806 HydrophobicContact CD1-CG1 4.12Å; V806-L1123 HydrophobicContact CG2-CB 4.36Å; V806-V1124 CarbonylContact C-O 3.52Å; V806-V1124 VanDerWaalsContact CA-O 3.28Å; V806-V1124 WeakPolarHBondContact CA-O 3.46Å; V806-F1125 HydrophobicContact CB-CD1 3.7Å; V806-F1125 HydrophobicContact CB-CE1 3.73Å; V806-F1125 HydrophobicContact CB-CG 4.22Å; V806-F1125 HydrophobicContact CB-CZ 4.29Å; V806-F1125 HydrophobicContact CG1-CE1 4.29Å; V806-F1125 HydrophobicContact CG2-CD1 3.75Å; V806-F1125 HydrophobicContact CG2-CD2 3.93Å; V806-F1125 HydrophobicContact CG2-CE1 3.62Å; V806-F1125 HydrophobicContact CG2-CE2 3.81Å; V806-F1125 HydrophobicContact CG2-CG 3.9Å; V806-F1125 HydrophobicContact CG2-CZ 3.66Å
807	T	98.8	Very high	98	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.8	171.2	-65.1	0	0	0	0	109.8	R696 F720 S721 V1124 Y1126	R696-T807 PolarHBondContact NH2-OG1 3.45Å; F720-T807 CarbonylContact O-C 3.59Å; F720-T807 VanDerWaalsContact O-CA 3.31Å; F720-T807 WeakPolarHBondContact O-CA 3.41Å; S721-T807 WeakPolarHBondContact CB-OG1 3.43Å; S721-T807 WeakPolarHBondContact OG-CG2 3.5Å; S721-T807 PolarHBondContact OG-OG1 2.78Å; T807-V1124 PolarHBondContact N-O 3.31Å; T807-V1124 PolarHBondContact O-N 2.93Å; T807-Y1126 PolarHBondContact OG1-OH 2.83Å
808	A	98.7	Very high	98.1	Very high	2 Å²	2	27.9 Å²	27.9	2%	0.017	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	114.3	168.8	0	0	0	0	0	109.3	L687 S719 F720 S1122 L1123	L687-A808 HydrophobicContact CD1-CB 3.67Å; S719-A808 CarbonylContact C-O 3.19Å; S719-A808 WeakPolarHBondContact CA-O 3.48Å; F720-A808 HydrophobicContact CB-CB 4.49Å; F720-A808 PolarHBondContact N-O 3.15Å; F720-A808 PolarHBondContact O-N 2.88Å; A808-S1122 CarbonylContact C-O 3.18Å; A808-S1122 WeakPolarHBondContact CA-O 3.49Å; A808-L1123 HydrophobicContact CB-CD2 3.64Å
809	C	98.6	Very high	98.2	Very high	12 Å²	12	23 Å²	23	8%	0.081	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	112.8	176.6	-79.8	0	0	0	0	108.9	F812 I1121 S1122	C809-F812 HydrophobicContact CB-CB 3.98Å; C809-F812 HydrophobicContact CB-CD1 4.29Å; C809-F812 HydrophobicContact CB-CG 4.46Å; C809-I1121 CarbonylContact O-C 3.12Å; C809-I1121 WeakPolarHBondContact O-CA 3.49Å; C809-S1122 WeakPolarHBondContact CB-OG 3.31Å; C809-S1122 PolarHBondContact N-O 3.21Å; C809-S1122 PolarHBondContact O-N 2.82Å; C809-S1122 PolarHBondContact O-OG 3.4Å
810	V	98.4	Very high	98.2	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.018	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.8	-172	-177.9	0	0	0	0	108.7	L687 G717 A718 F720 F812 R1115 P1118 I1121	L687-V810 HydrophobicContact CD1-CG2 4.03Å; G717-V810 CarbonylContact C-O 3.57Å; G717-V810 VanDerWaalsContact CA-O 3.24Å; G717-V810 WeakPolarHBondContact CA-O 3.03Å; A718-V810 PolarHBondContact N-O 2.8Å; A718-V810 PolarHBondContact O-N 3.23Å; F720-V810 HydrophobicContact CD2-CG2 4.26Å; F720-V810 HydrophobicContact CE2-CB 4.43Å; F720-V810 HydrophobicContact CE2-CG2 4.07Å; V810-F812 PolarHBondContact O-N 2.82Å; V810-R1115 HydrophobicContact CB-CB 4.49Å; V810-R1115 HydrophobicContact CG1-CB 3.66Å; V810-P1118 HydrophobicContact CG1-CB 3.56Å; V810-P1118 HydrophobicContact CG1-CG 3.78Å; V810-I1121 HydrophobicContact CG1-CG1 4.31Å; V810-I1121 HydrophobicContact CG2-CG1 4.22Å; V810-I1121 HydrophobicContact CG2-CG2 4.19Å
811	D	97.9	Very high	98.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	46.3	27.1	-170.1	-75.1	-2.8	0	0	0	114.4	G717 P1113 N1114 P1118 T1119 R1120	G717-D811 WeakPolarHBondContact CA-O 3.26Å; D811-P1113 HydrophobicContact CB-CB 4.17Å; D811-N1114 PolarHBondContact OD2-N 2.84Å; D811-P1118 WeakPolarHBondContact OD1-CB 3.5Å; D811-P1118 WeakPolarHBondContact OD2-CA 3.4Å; D811-T1119 WeakPolarHBondContact OD1-CA 3.33Å; D811-T1119 PolarHBondContact OD1-N 2.88Å; D811-T1119 PolarHBondContact OD2-N 3.4Å; D811-R1120 PolarHBondContact N-O 2.89Å; D811-R1120 PolarHBondContact OD1-N 2.78Å
812	F	98.3	Very high	98.1	Very high	7 Å²	7	16.4 Å²	16.4	3%	0.031	10%	0.095	C	C	.	.			trans	-88.2	118.1	-169.1	179	-99.5	0	0	0	111.1	R696 A699 C809 V810 A814 Q849 T1107	R696-F812 HydrophobicContact CB-CZ 4.35Å; A699-F812 HydrophobicContact CB-CE2 3.63Å; A699-F812 HydrophobicContact CB-CZ 3.75Å; C809-F812 HydrophobicContact CB-CB 3.98Å; C809-F812 HydrophobicContact CB-CD1 4.29Å; C809-F812 HydrophobicContact CB-CG 4.46Å; V810-F812 PolarHBondContact O-N 2.82Å; F812-A814 HydrophobicContact CD1-CB 4.18Å; F812-A814 HydrophobicContact CE1-CB 3.94Å; F812-A814 PolarHBondContact O-N 2.9Å; F812-Q849 PolarHBondContact O-NE2 2.82Å; F812-T1107 PolarHBondContact O-OG1 3.16Å
813	C	98	Very high	98	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.			trans	-77.9	105.6	172.4	178.9	0	0	0	0	109.8	C698 C708 Q709 T1107 P1109	C698-C813 VanDerWaalsContact O-O 3.14Å; C708-C813 HydrophobicContact CB-CB 3.99Å; Q709-C813 PolarHBondContact NE2-O 3.07Å; C813-T1107 PolarHBondContact SG-O 2.93Å; C813-P1109 HydrophobicContact CB-CB 4.17Å
814	A	98.3	Very high	97.9	Very high	10 Å²	10	22.3 Å²	22.3	8%	0.083	13%	0.127	C	C	.	.			trans	-87.8	106.6	173.6	0	0	0	0	0	109.4	F812 A1106 T1107	F812-A814 HydrophobicContact CD1-CB 4.18Å; F812-A814 HydrophobicContact CE1-CB 3.94Å; F812-A814 PolarHBondContact O-N 2.9Å; A814-A1106 CarbonylContact O-C 2.85Å; A814-A1106 WeakPolarHBondContact O-CA 3.08Å; A814-A1106 VanDerWaalsContact O-CB 3.27Å; A814-A1106 WeakPolarHBondContact O-CB 3.31Å; A814-T1107 HydrophobicContact CB-CG2 4.45Å; A814-T1107 WeakPolarHBondContact CB-OG1 3.45Å; A814-T1107 PolarHBondContact N-OG1 3Å; A814-T1107 PolarHBondContact O-N 3.08Å
815	H	98.3	Very high	97.7	Very high	7 Å²	7	26.5 Å²	26.5	3%	0.032	15%	0.149	C	C	.	.			trans	-63.4	153.1	171.8	-65	67.6	0	0	0	110.8	C698 L700 N701 C706 H817	C698-H815 WeakPolarHBondContact CB-O 3.42Å; C698-H815 WeakPolarHBondContact O-CB 3.38Å; C698-H815 PolarHBondContact O-N 3.1Å; C698-H815 PolarHBondContact O-ND1 3.2Å; L700-H815 VanDerWaalsContact C-CG 3.46Å; N701-H815 VanDerWaalsContact CA-CD2 3.5Å; N701-H815 WeakPolarHBondContact CA-CD2 3.48Å; N701-H815 PolarHBondContact N-CD2 2.95Å; N701-H815 VanDerWaalsContact N-CD2 3.31Å; N701-H815 PolarHBondContact N-NE2 3.13Å; C706-H815 PolarHBondContact SG-NE2 3Å; C706-H815 VanDerWaalsContact SG-NE2 3.4Å; H815-H817 PolarHBondContact O-N 2.92Å; H815-H817 PolarHBondContact O-ND1 2.71Å
816	A	98.3	Very high	97.7	Very high	33 Å²	33	26.7 Å²	26.7	27%	0.273	15%	0.151	S	C	.	.	S	Bend	trans	-49.2	120.2	-173.6	0	0	0	0	0	112.5	E621 P854 L1104 H1105 A1106	E621-A816 WeakPolarHBondContact OE1-CB 3.37Å; A816-P854 HydrophobicContact CB-CG 4.3Å; A816-L1104 HydrophobicContact CB-CD1 4.27Å; A816-L1104 HydrophobicContact CB-CD2 4.07Å; A816-L1104 HydrophobicContact CB-CG 4.12Å; A816-H1105 WeakPolarHBondContact CA-O 3.14Å; A816-A1106 HydrophobicContact CB-CB 4.47Å
817	H	98.2	Very high	97.7	Very high	36 Å²	36	26.9 Å²	26.9	17%	0.167	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-154.7	172.6	-173.7	70.8	-41	0	0	0	113.2	C698 H815 L1104 H1105	C698-H817 HydrophobicContact CB-CB 4.13Å; C698-H817 PolarHBondContact SG-CD2 2.96Å; C698-H817 PolarHBondContact SG-NE2 2.98Å; H815-H817 PolarHBondContact O-N 2.92Å; H815-H817 PolarHBondContact O-ND1 2.71Å; H817-L1104 WeakPolarHBondContact O-CA 3.26Å; H817-H1105 AromaticContact CE1-CD2 3.7Å; H817-H1105 AromaticContact CE1-CE1 3.88Å; H817-H1105 AromaticContact CE1-NE2 3.15Å; H817-H1105 PolarHBondContact CE1-NE2 3.08Å; H817-H1105 PolarHBondContact N-O 3.48Å; H817-H1105 AromaticContact ND1-CD2 3.96Å; H817-H1105 AromaticContact ND1-CE1 3.89Å; H817-H1105 AromaticContact ND1-NE2 3.55Å; H817-H1105 PolarHBondContact ND1-O 2.91Å; H817-H1105 AromaticContact NE2-NE2 3.8Å; H817-H1105 PolarHBondContact O-CE1 3.13Å; H817-H1105 PolarHBondContact O-N 3.25Å; H817-H1105 PolarHBondContact O-ND1 3.41Å; H817-H1105 VanDerWaalsContact O-ND1 3.11Å
818	K	98.1	Very high	97.7	Very high	78 Å²	78	27 Å²	27	34%	0.339	15%	0.153	S	C	.	.			trans	-131.5	134.8	170	-50.5	-164.4	176.3	-168	0	108.3	T820 A1100 R1102 E1103 L1104	K818-T820 HydrophobicContact CB-CG2 4.41Å; K818-T820 PolarHBondContact O-N 3.29Å; K818-A1100 CarbonylContact C-O 3.25Å; K818-A1100 WeakPolarHBondContact CA-O 3.18Å; K818-R1102 WeakPolarHBondContact CD-O 3.25Å; K818-R1102 VanDerWaalsContact CE-O 3.28Å; K818-R1102 WeakPolarHBondContact CE-O 3.12Å; K818-R1102 PolarHBondContact NZ-O 3.09Å; K818-E1103 WeakPolarHBondContact CG-O 3.44Å; K818-L1104 HydrophobicContact CG-CD1 4.02Å
819	D	97.6	Very high	97.7	Very high	20 Å²	20	27 Å²	27	11%	0.107	15%	0.153	C	C	.	.			trans	-78.8	71.4	179.3	-97	-22.1	0	0	0	110.9	R696 S821 N822 A1100	R696-D819 IonicContact NH1-OD1 3.78Å; R696-D819 PolarHBondContact NH1-OD1 3.44Å; R696-D819 IonicContact NH1-OD2 2.64Å; D819-S821 PolarHBondContact O-N 3.26Å; D819-N822 HydrophobicContact CB-CB 4.45Å; D819-N822 WeakPolarHBondContact CB-ND2 3.44Å; D819-N822 WeakPolarHBondContact O-CB 2.91Å; D819-N822 PolarHBondContact O-N 3.47Å; D819-A1100 PolarHBondContact N-O 2.75Å
820	T	95.6	Very high	97.7	Very high	96 Å²	96	26.7 Å²	26.7	59%	0.589	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-4.2	-177.6	55.4	0	0	0	0	115.6	K818 R1101	K818-T820 HydrophobicContact CB-CG2 4.41Å; K818-T820 PolarHBondContact O-N 3.29Å; T820-R1101 VanDerWaalsContact C-NH1 3.3Å; T820-R1101 PolarHBondContact O-NH1 2.99Å
821	S	96	Very high	97.7	Very high	33 Å²	33	26.5 Å²	26.5	23%	0.231	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-16.1	172.8	-63.1	0	0	0	0	114.3	D819 H1128 K1129	D819-S821 PolarHBondContact O-N 3.26Å; S821-H1128 VanDerWaalsContact O-CA 3.31Å; S821-H1128 WeakPolarHBondContact O-CA 3.37Å; S821-H1128 WeakPolarHBondContact O-CB 3.43Å; S821-K1129 PolarHBondContact O-N 2.95Å
822	N	98.1	Very high	97.7	Very high	6 Å²	6	26.5 Å²	26.5	3%	0.032	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-62	155.5	172.7	-66.7	1.9	0	0	0	110	D819 T828 R1101 Q1127 H1128	D819-N822 HydrophobicContact CB-CB 4.45Å; D819-N822 WeakPolarHBondContact CB-ND2 3.44Å; D819-N822 WeakPolarHBondContact O-CB 2.91Å; D819-N822 PolarHBondContact O-N 3.47Å; N822-T828 PolarHBondContact ND2-OG1 3.5Å; N822-R1101 HydrophobicContact CB-CB 4.32Å; N822-R1101 WeakPolarHBondContact O-CD 3.1Å; N822-R1101 VanDerWaalsContact O-CZ 3.25Å; N822-R1101 PolarHBondContact O-NE 3.44Å; N822-R1101 PolarHBondContact O-NH1 2.9Å; N822-Q1127 CarbonylContact C-O 3.35Å; N822-Q1127 VanDerWaalsContact CA-O 3.31Å; N822-Q1127 WeakPolarHBondContact CA-O 3.44Å; N822-H1128 PolarHBondContact OD1-CD2 3.32Å; N822-H1128 VanDerWaalsContact OD1-CD2 3.25Å
823	M	97	Very high	97.8	Very high	26 Å²	26	26.2 Å²	26.2	13%	0.128	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-70.2	158.8	-179.8	69.1	177.1	-79.7	0	0	112.9	N782 Q783 R1101 Q1127 K1129	N782-M823 WeakPolarHBondContact O-CE 3.44Å; Q783-M823 HydrophobicContact CB-SD 4.42Å; Q783-M823 HydrophobicContact CG-CE 4.49Å; Q783-M823 HydrophobicContact CG-CG 4.33Å; Q783-M823 HydrophobicContact CG-SD 3.57Å; Q783-M823 VanDerWaalsContact CG-SD 3.57Å; M823-R1101 WeakPolarHBondContact O-CD 3.5Å; M823-Q1127 HydrophobicContact CG-CB 4.36Å; M823-Q1127 HydrophobicContact CG-CG 4.3Å; M823-Q1127 PolarHBondContact N-O 2.92Å; M823-Q1127 HydrophobicContact SD-CB 4.08Å; M823-Q1127 HydrophobicContact SD-CG 3.65Å; M823-Q1127 PolarHBondContact SD-NE2 2.83Å; M823-K1129 HydrophobicContact CB-CB 4.42Å
824	N	95.6	Very high	97.8	Very high	98 Å²	98	26.3 Å²	26.3	52%	0.524	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	149	169.8	-68.3	-15.7	0	0	0	109.9	G826 R1101	N824-G826 PolarHBondContact O-N 3.24Å; N824-R1101 VanDerWaalsContact OD1-CZ 3.23Å; N824-R1101 PolarHBondContact OD1-NE 3.19Å; N824-R1101 PolarHBondContact OD1-NH2 2.97Å
825	N	95.8	Very high	97.7	Very high	88 Å²	88	27.7 Å²	27.7	47%	0.471	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	3.2	170.9	-53.1	-11.7	0	0	0	117.3	H585 N782	H585-N825 WeakPolarHBondContact CB-O 3.41Å; H585-N825 VanDerWaalsContact CG-O 3.25Å; N782-N825 WeakPolarHBondContact ND2-CB 3.31Å; N782-N825 PolarHBondContact ND2-O 2.81Å
826	G	97	Very high	97.5	Very high	5 Å²	5	31.6 Å²	31.6	5%	0.052	17%	0.172	C	C	.	.			trans	-94	174.3	162.5	0	0	0	0	0	112.3	H585 N824	H585-G826 PolarHBondContact NE2-O 2.87Å; N824-G826 PolarHBondContact O-N 3.24Å
827	S	98.3	Very high	97.3	Very high	5 Å²	5	33 Å²	33	4%	0.035	17%	0.174	C	C	.	.			trans	-127.1	177.6	179.1	72.1	0	0	0	0	112.3	Y772 Q783 I1097 E1098	Y772-S827 WeakPolarHBondContact CE2-OG 3.24Å; Y772-S827 VanDerWaalsContact CZ-OG 3.22Å; Y772-S827 PolarHBondContact OH-N 3.47Å; Y772-S827 PolarHBondContact OH-OG 3.31Å; Q783-S827 PolarHBondContact OE1-O 3.29Å; S827-I1097 WeakPolarHBondContact OG-CG2 3.27Å; S827-E1098 VanDerWaalsContact CB-O 3.32Å; S827-E1098 WeakPolarHBondContact CB-O 3.33Å
828	T	98.8	Very high	97.1	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.1	172.7	-64.3	0	0	0	0	108.9	N822 V830 I1097 E1098 A1100 V1124	N822-T828 PolarHBondContact ND2-OG1 3.5Å; T828-V830 HydrophobicContact CG2-CG2 4Å; T828-I1097 WeakPolarHBondContact O-CA 3.43Å; T828-E1098 PolarHBondContact N-O 3.44Å; T828-E1098 PolarHBondContact O-N 3.27Å; T828-E1098 VanDerWaalsContact O-N 3.09Å; T828-A1100 HydrophobicContact CG2-CB 4.42Å; T828-V1124 HydrophobicContact CG2-CG1 3.44Å; T828-V1124 VanDerWaalsContact CG2-CG1 3.44Å
829	V	98.9	Very high	96.9	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	120.6	179.2	-179.7	0	0	0	0	108.1	L768 Y772 F803 I1095 L1096 I1097 F1125	L768-V829 HydrophobicContact CD1-CG1 4.42Å; Y772-V829 HydrophobicContact CD1-CG2 3.9Å; Y772-V829 HydrophobicContact CD2-CG2 3.96Å; Y772-V829 HydrophobicContact CE1-CG2 4.19Å; Y772-V829 HydrophobicContact CE2-CG2 4.22Å; Y772-V829 HydrophobicContact CG-CG2 3.81Å; F803-V829 HydrophobicContact CE1-CB 3.97Å; F803-V829 HydrophobicContact CE1-CG2 3.74Å; F803-V829 HydrophobicContact CZ-CB 4.16Å; F803-V829 HydrophobicContact CZ-CG1 4.49Å; F803-V829 HydrophobicContact CZ-CG2 4.01Å; V829-I1095 HydrophobicContact CG1-CG2 3.58Å; V829-L1096 CarbonylContact C-O 3.41Å; V829-L1096 WeakPolarHBondContact CA-O 3.39Å; V829-I1097 HydrophobicContact CG2-CG1 4.35Å; V829-I1097 HydrophobicContact CG2-CG2 4.36Å; V829-F1125 HydrophobicContact CB-CB 4.42Å; V829-F1125 PolarHBondContact N-O 2.92Å; V829-F1125 PolarHBondContact O-N 2.86Å
830	V	98.9	Very high	96.5	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.036	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	111.7	-175.2	-173.4	0	0	0	0	110.2	T828 I1095 L1096 L1123 V1124	T828-V830 HydrophobicContact CG2-CG2 4Å; V830-I1095 WeakPolarHBondContact O-CA 3.4Å; V830-L1096 HydrophobicContact CB-CB 4.25Å; V830-L1096 PolarHBondContact N-O 2.9Å; V830-L1096 PolarHBondContact O-N 3.41Å; V830-L1123 WeakPolarHBondContact CA-O 3.46Å; V830-V1124 HydrophobicContact CG1-CG2 4.08Å; V830-V1124 HydrophobicContact CG2-CB 4.47Å; V830-V1124 HydrophobicContact CG2-CG1 4.16Å; V830-V1124 HydrophobicContact CG2-CG2 4.21Å
831	C	98.9	Very high	96.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	126.7	169.5	179.2	0	0	0	0	110.3	I671 L768 I1095 S1122 L1123	I671-C831 VanDerWaalsContact CD1-SG 3.54Å; L768-C831 HydrophobicContact CD1-CB 4.46Å; C831-I1095 HydrophobicContact CB-CD1 3.42Å; C831-I1095 VanDerWaalsContact CB-CD1 3.42Å; C831-S1122 CarbonylContact O-C 3.55Å; C831-S1122 WeakPolarHBondContact O-CA 3.26Å; C831-L1123 HydrophobicContact CB-CB 4.23Å; C831-L1123 PolarHBondContact N-O 3.01Å; C831-L1123 PolarHBondContact O-N 2.81Å
832	T	98.8	Very high	95.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	129.3	179.5	-62.1	0	0	0	0	111.8	T834 P1090 G1093 S1094 R1120	T832-T834 HydrophobicContact CG2-CG2 4.06Å; T832-P1090 HydrophobicContact CG2-CB 4.12Å; T832-P1090 WeakPolarHBondContact CG2-O 3.18Å; T832-G1093 PolarHBondContact O-N 3.14Å; T832-S1094 PolarHBondContact N-O 2.86Å; T832-R1120 HydrophobicContact CG2-CG 4.02Å; T832-R1120 VanDerWaalsContact CG2-NE 3.29Å; T832-R1120 PolarHBondContact OG1-NH2 3.1Å
833	L	98.8	Very high	95.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.8	173.7	-44.5	173.6	0	0	0	108.1	I671 A676 L679 Y680 L683 I1121 L1123	I671-L833 HydrophobicContact CD1-CD2 4.23Å; A676-L833 HydrophobicContact CB-CD2 3.71Å; L679-L833 HydrophobicContact CB-CD1 3.68Å; Y680-L833 HydrophobicContact CD2-CB 4.1Å; L683-L833 HydrophobicContact CD1-CD1 4.44Å; L833-I1121 HydrophobicContact CB-CB 4.25Å; L833-I1121 PolarHBondContact N-O 3.31Å; L833-I1121 PolarHBondContact O-N 3.07Å; L833-I1121 VanDerWaalsContact O-O 3.12Å; L833-L1123 HydrophobicContact CD1-CD1 4.04Å; L833-L1123 HydrophobicContact CD1-CG 4.45Å
834	T	98.1	Very high	94.9	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	157.9	-177.9	55.3	0	0	0	0	112.7	T832 N838 R839 H1092	T832-T834 HydrophobicContact CG2-CG2 4.06Å; T834-N838 WeakPolarHBondContact CB-O 3.45Å; T834-N838 HydrophobicContact CG2-CB 4.47Å; T834-N838 PolarHBondContact OG1-O 2.93Å; T834-R839 VanDerWaalsContact O-CZ 3.3Å; T834-R839 PolarHBondContact O-NE 3.28Å; T834-R839 PolarHBondContact O-NH2 3.49Å; T834-H1092 PolarHBondContact N-ND1 2.86Å; T834-H1092 PolarHBondContact O-CE1 3.49Å; T834-H1092 VanDerWaalsContact O-CE1 3.29Å; T834-H1092 PolarHBondContact O-ND1 3.44Å; T834-H1092 VanDerWaalsContact OG1-CB 3.26Å; T834-H1092 WeakPolarHBondContact OG1-CB 3.48Å; T834-H1092 PolarHBondContact OG1-ND1 3.15Å
835	K	96.6	Very high	94.7	Very high	39 Å²	39	39.4 Å²	39.4	17%	0.17	20%	0.201	C	C	.	.			trans	-54.9	155.6	164.5	-169.6	173.5	175.1	-60.8	0	112.2	D837 N838 R839 H1117 T1119	K835-D837 VanDerWaalsContact C-N 3.29Å; K835-D837 WeakPolarHBondContact CB-OD1 3.39Å; K835-D837 WeakPolarHBondContact CG-OD1 3.4Å; K835-D837 IonicContact NZ-OD1 2.72Å; K835-D837 IonicContact NZ-OD2 3.96Å; K835-D837 PolarHBondContact NZ-OD2 2.79Å; K835-D837 PolarHBondContact O-N 2.8Å; K835-N838 PolarHBondContact O-N 3.09Å; K835-N838 VanDerWaalsContact O-N 3.08Å; K835-R839 WeakPolarHBondContact O-CG 3.2Å; K835-R839 PolarHBondContact O-NE 3.39Å; K835-H1117 VanDerWaalsContact CE-CE1 3.44Å; K835-H1117 WeakPolarHBondContact CE-CE1 3.31Å; K835-T1119 PolarHBondContact N-O 3.41Å; K835-T1119 VanDerWaalsContact N-O 3.07Å
836	E	94.3	Very high	94.4	Very high	90 Å²	90	44.5 Å²	44.5	42%	0.421	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-60.4	-27.6	-170.5	62.9	-67.9	148.5	0	0	115.9	H1117	E836-H1117 VanDerWaalsContact CD-NE2 3.32Å; E836-H1117 IonicContact OE1-CE1 2.75Å; E836-H1117 PolarHBondContact OE1-CE1 3.12Å; E836-H1117 IonicContact OE1-NE2 3.6Å; E836-H1117 PolarHBondContact OE1-NE2 3.29Å; E836-H1117 VanDerWaalsContact OE1-NE2 3.12Å; E836-H1117 IonicContact OE2-CD2 3.31Å; E836-H1117 IonicContact OE2-CE1 2.59Å; E836-H1117 IonicContact OE2-NE2 2.98Å; E836-H1117 PolarHBondContact OE2-NE2 2.92Å
837	D	93.3	Very high	94.1	Very high	62 Å²	62	45.9 Å²	45.9	33%	0.332	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-68	-34.4	173.2	43.3	19.5	0	0	0	112.9	K835 R839 N843	K835-D837 VanDerWaalsContact C-N 3.29Å; K835-D837 WeakPolarHBondContact CB-OD1 3.39Å; K835-D837 WeakPolarHBondContact CG-OD1 3.4Å; K835-D837 IonicContact NZ-OD1 2.72Å; K835-D837 IonicContact NZ-OD2 3.96Å; K835-D837 PolarHBondContact NZ-OD2 2.79Å; K835-D837 PolarHBondContact O-N 2.8Å; D837-R839 PolarHBondContact O-N 3.06Å; D837-N843 PolarHBondContact O-ND2 2.87Å
838	N	94.1	Very high	94	Very high	22 Å²	22	47 Å²	47	12%	0.118	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-98.5	49.6	-179.6	-162.8	-1.5	0	0	0	112.6	T834 K835 P845	T834-N838 WeakPolarHBondContact CB-O 3.45Å; T834-N838 HydrophobicContact CG2-CB 4.47Å; T834-N838 PolarHBondContact OG1-O 2.93Å; K835-N838 PolarHBondContact O-N 3.09Å; K835-N838 VanDerWaalsContact O-N 3.08Å; N838-P845 HydrophobicContact CB-CB 4.33Å; N838-P845 HydrophobicContact CB-CG 3.93Å
839	R	94.3	Very high	93.9	Very high	40 Å²	40	47.2 Å²	47.2	15%	0.151	23%	0.234	C	C	.	.			trans	-123.6	4.5	178.3	-54.2	-168.4	-175.2	161.6	4.7	115.2	D677 T834 K835 D837 H1092	D677-R839 IonicContact OD1-CZ 3.09Å; D677-R839 IonicContact OD1-NE 3.86Å; D677-R839 IonicContact OD1-NH1 3.62Å; D677-R839 PolarHBondContact OD1-NH1 3.25Å; T834-R839 VanDerWaalsContact O-CZ 3.3Å; T834-R839 PolarHBondContact O-NE 3.28Å; T834-R839 PolarHBondContact O-NH2 3.49Å; K835-R839 WeakPolarHBondContact O-CG 3.2Å; K835-R839 PolarHBondContact O-NE 3.39Å; D837-R839 PolarHBondContact O-N 3.06Å; R839-H1092 HydrophobicContact CB-CB 4.36Å; R839-H1092 HydrophobicContact CG-CB 4.01Å; R839-H1092 PolarHBondContact NE-CE1 2.91Å; R839-H1092 PolarHBondContact NE-ND1 3.05Å; R839-H1092 VanDerWaalsContact NE-ND1 3.16Å
840	A	90.1	Very high	93.9	Very high	59 Å²	59	47.8 Å²	47.8	49%	0.488	24%	0.237	S	C	.	.	S	Bend	trans	-108.9	138.9	175.9	0	0	0	0	0	110.6	N843	A840-N843 HydrophobicContact CB-CB 4.03Å; A840-N843 WeakPolarHBondContact O-CB 3.45Å; A840-N843 PolarHBondContact O-N 3.49Å
841	V	88.9	Confident	93.9	Very high	46 Å²	46	47.9 Å²	47.9	28%	0.279	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	141.9	-179.9	178.8	0	0	0	0	110	R637 E640 N843	R637-V841 HydrophobicContact CG-CG1 4.22Å; E640-V841 HydrophobicContact CG-CB 4.06Å; E640-V841 HydrophobicContact CG-CG1 4.15Å; E640-V841 HydrophobicContact CG-CG2 4.04Å; V841-N843 PolarHBondContact O-N 3.06Å; V841-N843 VanDerWaalsContact O-N 3.08Å
842	R	84.9	Confident	93.9	Very high	180 Å²	180	47.9 Å²	47.9	68%	0.679	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	-3.7	-168.9	-62.6	179.7	179.2	176	-0.5	116.7	G638	G638-R842 VanDerWaalsContact O-CZ 3.22Å; G638-R842 PolarHBondContact O-NE 2.86Å; G638-R842 PolarHBondContact O-NH2 2.89Å
843	N	88.9	Confident	93.9	Very high	80 Å²	80	48.1 Å²	48.1	43%	0.428	24%	0.238	S	C	.	.			trans	-69.2	142.3	169.7	-164.2	36.1	0	0	0	110.2	D837 A840 V841	D837-N843 PolarHBondContact O-ND2 2.87Å; A840-N843 HydrophobicContact CB-CB 4.03Å; A840-N843 WeakPolarHBondContact O-CB 3.45Å; A840-N843 PolarHBondContact O-N 3.49Å; V841-N843 PolarHBondContact O-N 3.06Å; V841-N843 VanDerWaalsContact O-N 3.08Å
844	I	89.3	Confident	93.8	Very high	83 Å²	83	48.2 Å²	48.2	43%	0.426	24%	0.239	S	C	.	.			trans	-124.2	114	173.6	-58	178.5	0	0	0	106.3
845	P	92.3	Very high	93.9	Very high	18 Å²	18	48.9 Å²	48.9	12%	0.117	24%	0.242	C	C	.	.			trans	-73.6	172.5	179.8	35.9	-41	0	0	0	111.6	N838 D847 E848	N838-P845 HydrophobicContact CB-CB 4.33Å; N838-P845 HydrophobicContact CB-CG 3.93Å; P845-D847 VanDerWaalsContact CG-O 3.26Å; P845-D847 WeakPolarHBondContact CG-O 3.46Å; P845-D847 PolarHBondContact O-N 2.97Å; P845-E848 HydrophobicContact CG-CB 3.86Å
846	E	88.4	Confident	93.9	Very high	194 Å²	194	47 Å²	47	91%	0.907	23%	0.234	S	C	*	.	S	Bend	trans	-62.1	-27.4	174.6	-62.4	-171.1	166.4	0	0	113.6
847	D	92	Very high	94.1	Very high	35 Å²	35	44.6 Å²	44.6	19%	0.187	22%	0.222	C	C	.	.	S	Bend	trans	-148.3	137.2	-179.7	-163.4	1.6	0	0	0	109.5	P845 I1110 L1111 T1119	P845-D847 VanDerWaalsContact CG-O 3.26Å; P845-D847 WeakPolarHBondContact CG-O 3.46Å; P845-D847 PolarHBondContact O-N 2.97Å; D847-I1110 WeakPolarHBondContact OD2-CG2 3.25Å; D847-L1111 HydrophobicContact CB-CD1 4.45Å; D847-L1111 WeakPolarHBondContact OD2-CA 3.37Å; D847-L1111 VanDerWaalsContact OD2-CB 3.23Å; D847-L1111 WeakPolarHBondContact OD2-CB 3.38Å; D847-L1111 PolarHBondContact OD2-N 3.17Å; D847-T1119 VanDerWaalsContact O-CG2 3.27Å; D847-T1119 WeakPolarHBondContact O-CG2 3.44Å
848	E	94.8	Very high	94.3	Very high	27 Å²	27	42.2 Å²	42.2	13%	0.126	21%	0.209	C	C	.	.			trans	-149.7	149.6	178.9	68.8	-173.7	140.4	0	0	111.5	R636 P845 L850 I1110	R636-E848 IonicContact CZ-OE1 2.78Å; R636-E848 VanDerWaalsContact NH1-CD 3.3Å; R636-E848 IonicContact NH1-OE1 2.89Å; R636-E848 PolarHBondContact NH1-OE1 3Å; R636-E848 IonicContact NH1-OE2 2.7Å; R636-E848 PolarHBondContact NH1-OE2 3.4Å; R636-E848 IonicContact NH2-OE1 3.9Å; R636-E848 PolarHBondContact NH2-OE1 3.43Å; P845-E848 HydrophobicContact CG-CB 3.86Å; E848-L850 HydrophobicContact CG-CD2 3.91Å; E848-L850 HydrophobicContact CG-CG 4.46Å; E848-I1110 VanDerWaalsContact C-CD1 3.48Å
849	Q	97.4	Very high	94.4	Very high	8 Å²	8	42.2 Å²	42.2	4%	0.037	21%	0.211	C	C	.	.			trans	-98.4	119.5	171.6	173.4	171.7	93.2	0	0	110.5	F812 T1107 T1108 I1110 R1120	F812-Q849 PolarHBondContact O-NE2 2.82Å; Q849-T1107 PolarHBondContact NE2-OG1 3.38Å; Q849-T1108 PolarHBondContact NE2-O 2.98Å; Q849-I1110 HydrophobicContact CB-CD1 3.67Å; Q849-I1110 HydrophobicContact CB-CG1 4.13Å; Q849-R1120 HydrophobicContact CB-CB 4.05Å; Q849-R1120 WeakPolarHBondContact O-CD 3.27Å
850	L	98.3	Very high	94.5	Very high	13 Å²	13	46.3 Å²	46.3	7%	0.068	24%	0.236	C	C	.	.			trans	-90.2	157.6	174.5	-52	178.6	0	0	0	110.6	A631 V634 E848 A1087 A1089 T1107 T1108	A631-L850 HydrophobicContact CB-CD1 3.94Å; V634-L850 HydrophobicContact CB-CD1 4.4Å; V634-L850 HydrophobicContact CG1-CD1 3.9Å; V634-L850 HydrophobicContact CG1-CD2 3.68Å; V634-L850 HydrophobicContact CG1-CG 4.42Å; V634-L850 HydrophobicContact CG2-CD1 3.57Å; E848-L850 HydrophobicContact CG-CD2 3.91Å; E848-L850 HydrophobicContact CG-CG 4.46Å; L850-A1087 HydrophobicContact CB-CB 4.09Å; L850-A1087 HydrophobicContact CD1-CB 4.15Å; L850-A1089 HydrophobicContact CD2-CB 3.63Å; L850-T1107 VanDerWaalsContact O-CA 3.23Å; L850-T1107 WeakPolarHBondContact O-CA 3.47Å; L850-T1107 WeakPolarHBondContact O-CB 3.45Å; L850-T1108 HydrophobicContact CB-CG2 4.03Å; L850-T1108 HydrophobicContact CD1-CG2 4.45Å; L850-T1108 HydrophobicContact CG-CG2 4.47Å; L850-T1108 PolarHBondContact N-OG1 3.32Å; L850-T1108 PolarHBondContact O-N 3.44Å; L850-T1108 VanDerWaalsContact O-N 3.11Å
851	H	98.9	Very high	94.8	Very high	8 Å²	8	48.5 Å²	48.5	4%	0.037	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.6	168.2	-176	96.3	0	0	0	108.7	A1087 V1088 P1090 L1096 E1098	H851-A1087 CarbonylContact O-C 3.35Å; H851-A1087 WeakPolarHBondContact O-CA 3.41Å; H851-A1087 WeakPolarHBondContact O-CB 3.38Å; H851-V1088 HydrophobicContact CB-CG2 3.92Å; H851-V1088 PolarHBondContact N-O 2.81Å; H851-V1088 PolarHBondContact O-N 2.67Å; H851-P1090 HydrophobicContact CB-CG 4.32Å; H851-L1096 HydrophobicContact CB-CD1 4.21Å; H851-E1098 IonicContact CD2-OE2 3.72Å; H851-E1098 IonicContact CE1-OE1 2.6Å; H851-E1098 PolarHBondContact CE1-OE1 2.8Å; H851-E1098 IonicContact CE1-OE2 3.38Å; H851-E1098 VanDerWaalsContact NE2-CD 3.25Å; H851-E1098 IonicContact NE2-OE1 3.67Å; H851-E1098 PolarHBondContact NE2-OE1 3.14Å; H851-E1098 IonicContact NE2-OE2 3.93Å; H851-E1098 PolarHBondContact NE2-OE2 3.44Å
852	V	98.8	Very high	95.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	140.4	-164.3	-167.9	0	0	0	0	111.1	I630 P854 V1086 A1087 H1105 A1106 T1108	I630-V852 WeakPolarHBondContact O-CG1 3.43Å; V852-P854 HydrophobicContact CG1-CG 4.13Å; V852-P854 WeakPolarHBondContact O-CD 3.27Å; V852-V1086 CarbonylContact C-O 3.57Å; V852-V1086 WeakPolarHBondContact CA-O 3.32Å; V852-V1086 WeakPolarHBondContact CG1-O 3.31Å; V852-A1087 HydrophobicContact CB-CB 4.41Å; V852-A1087 HydrophobicContact CG1-CB 4.41Å; V852-A1087 HydrophobicContact CG2-CB 3.94Å; V852-H1105 CarbonylContact O-C 3.56Å; V852-H1105 VanDerWaalsContact O-CA 3.24Å; V852-H1105 WeakPolarHBondContact O-CA 3.41Å; V852-A1106 HydrophobicContact CB-CB 4.36Å; V852-A1106 PolarHBondContact N-O 2.91Å; V852-A1106 PolarHBondContact O-N 2.74Å; V852-T1108 HydrophobicContact CG2-CG2 3.91Å
853	L	98.8	Very high	95.6	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	90.8	166.9	-59.2	179.8	0	0	0	108.9	L647 I663 L664 L855 Y856 V1086 H1105	L647-L853 HydrophobicContact CD1-CD1 4Å; I663-L853 HydrophobicContact CD1-CD1 3.74Å; I663-L853 HydrophobicContact CG1-CD1 4.37Å; L664-L853 HydrophobicContact CD1-CD1 4.19Å; L853-L855 PolarHBondContact O-N 3.23Å; L853-L855 VanDerWaalsContact O-N 3.1Å; L853-Y856 HydrophobicContact CB-CD2 3.78Å; L853-Y856 HydrophobicContact CB-CE2 4.45Å; L853-Y856 HydrophobicContact CB-CG 4.48Å; L853-Y856 PolarHBondContact O-N 3.05Å; L853-V1086 PolarHBondContact N-O 3.08Å; L853-H1105 HydrophobicContact CD2-CB 4.01Å
854	P	98.3	Very high	96	Very high	2 Å²	2	42 Å²	42	1%	0.013	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-9.3	-164.4	-22.8	36.2	0	0	0	116.1	E621 G622 A816 V852 G1084 L1104 A1106	E621-P854 WeakPolarHBondContact CA-O 3.45Å; E621-P854 HydrophobicContact CG-CB 3.96Å; G622-P854 PolarHBondContact N-O 2.9Å; A816-P854 HydrophobicContact CB-CG 4.3Å; V852-P854 HydrophobicContact CG1-CG 4.13Å; V852-P854 WeakPolarHBondContact O-CD 3.27Å; P854-G1084 CarbonylContact O-C 3.58Å; P854-G1084 VanDerWaalsContact O-CA 3.27Å; P854-G1084 WeakPolarHBondContact O-CA 3.39Å; P854-L1104 WeakPolarHBondContact CD-O 3.18Å; P854-A1106 HydrophobicContact CG-CB 4.12Å
855	L	98.4	Very high	96.2	Very high	16 Å²	16	39.9 Å²	39.9	8%	0.084	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	9.8	-178.7	-56.8	177.6	0	0	0	113.7	Y617 T618 E621 L853 L1104	Y617-L855 HydrophobicContact CD2-CB 4.09Å; Y617-L855 HydrophobicContact CE2-CB 3.71Å; Y617-L855 HydrophobicContact CE2-CD1 3.8Å; Y617-L855 HydrophobicContact CE2-CG 4.39Å; T618-L855 PolarHBondContact N-O 2.77Å; T618-L855 PolarHBondContact OG1-O 3.03Å; E621-L855 HydrophobicContact CB-CD2 3.91Å; E621-L855 HydrophobicContact CG-CD2 4.5Å; L853-L855 PolarHBondContact O-N 3.23Å; L853-L855 VanDerWaalsContact O-N 3.1Å; L855-L1104 HydrophobicContact CD1-CB 3.62Å; L855-L1104 HydrophobicContact CD1-CD2 3.91Å; L855-L1104 HydrophobicContact CD1-CG 4.4Å; L855-L1104 HydrophobicContact CD2-CD2 3.86Å; L855-L1104 HydrophobicContact CG-CB 3.98Å; L855-L1104 HydrophobicContact CG-CD2 3.71Å; L855-L1104 HydrophobicContact CG-CG 4.48Å
856	Y	98.6	Very high	96.5	Very high	1 Å²	1	43.9 Å²	43.9	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	143.3	-173.4	-70.8	-93	0	0	0	111.9	V615 V616 Y617 R649 I663 L853 G1084 G1085 V1086 E1103	V615-Y856 HydrophobicContact CB-CD1 4Å; V615-Y856 HydrophobicContact CG2-CD1 3.67Å; V615-Y856 HydrophobicContact CG2-CE1 4.07Å; V615-Y856 HydrophobicContact CG2-CG 4.45Å; V616-Y856 CarbonylContact O-C 3.51Å; V616-Y856 VanDerWaalsContact O-CA 3.3Å; V616-Y856 WeakPolarHBondContact O-CA 3.49Å; Y617-Y856 HydrophobicContact CD2-CD2 4.5Å; Y617-Y856 HydrophobicContact CD2-CE1 4.07Å; Y617-Y856 AromaticContact CD2-CE2 3.99Å; Y617-Y856 HydrophobicContact CD2-CE2 3.99Å; Y617-Y856 AromaticContact CD2-CZ 3.75Å; Y617-Y856 HydrophobicContact CG-CE1 4.42Å; R649-Y856 HydrophobicContact CB-CE1 4.4Å; R649-Y856 HydrophobicContact CG-CE1 4.36Å; I663-Y856 HydrophobicContact CD1-CD1 4.09Å; I663-Y856 HydrophobicContact CD1-CD2 4.49Å; I663-Y856 HydrophobicContact CD1-CE1 3.58Å; I663-Y856 HydrophobicContact CD1-CE2 4.02Å; L853-Y856 HydrophobicContact CB-CD2 3.78Å; L853-Y856 HydrophobicContact CB-CE2 4.45Å; L853-Y856 HydrophobicContact CB-CG 4.48Å; L853-Y856 PolarHBondContact O-N 3.05Å; Y856-G1084 CarbonylContact O-C 3.57Å; Y856-G1084 WeakPolarHBondContact O-CA 3.36Å; Y856-G1085 PolarHBondContact O-N 3.46Å; Y856-V1086 WeakPolarHBondContact O-CG2 3.01Å; Y856-V1086 PolarHBondContact O-N 2.87Å; Y856-E1103 VanDerWaalsContact CE2-OE2 3.25Å; Y856-E1103 WeakPolarHBondContact CE2-OE2 3.32Å; Y856-E1103 PolarHBondContact OH-OE1 3.46Å; Y856-E1103 PolarHBondContact OH-OE2 2.84Å
857	K	97.6	Very high	96.9	Very high	38 Å²	38	37 Å²	37	17%	0.165	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	160.8	162.3	71.3	179.3	-175.4	-177.3	0	111.5	V615 V616 T618 W633 E1081 D1082 V1086	V615-K857 WeakPolarHBondContact CA-O 3.35Å; V616-K857 HydrophobicContact CB-CG 3.97Å; V616-K857 PolarHBondContact N-O 2.84Å; V616-K857 PolarHBondContact O-N 2.99Å; T618-K857 HydrophobicContact CG2-CB 4.33Å; T618-K857 HydrophobicContact CG2-CD 3.99Å; T618-K857 HydrophobicContact CG2-CG 3.79Å; W633-K857 HydrophobicContact CE3-CB 4.45Å; W633-K857 HydrophobicContact CH2-CB 3.46Å; W633-K857 VanDerWaalsContact CH2-CB 3.46Å; W633-K857 HydrophobicContact CZ2-CB 4.23Å; W633-K857 HydrophobicContact CZ3-CB 3.6Å; K857-E1081 WeakPolarHBondContact CD-O 3.44Å; K857-D1082 IonicContact NZ-OD1 2.89Å; K857-D1082 PolarHBondContact NZ-OD1 3.36Å; K857-V1086 VanDerWaalsContact C-CG2 3.47Å
858	I	97.3	Very high	97.2	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.062	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	147.2	171.7	-62.7	-66.4	0	0	0	109.3	V615 W633 I635 L879 V1086	V615-I858 HydrophobicContact CG1-CD1 4.38Å; W633-I858 HydrophobicContact CB-CD1 4.22Å; W633-I858 HydrophobicContact CB-CG1 3.51Å; W633-I858 HydrophobicContact CD2-CB 4.37Å; W633-I858 HydrophobicContact CD2-CG1 3.85Å; W633-I858 HydrophobicContact CE3-CG1 4.43Å; W633-I858 HydrophobicContact CG-CB 4.22Å; W633-I858 HydrophobicContact CG-CG1 3.4Å; I635-I858 HydrophobicContact CD1-CD1 3.94Å; I635-I858 HydrophobicContact CG1-CD1 4.12Å; I858-L879 HydrophobicContact CD1-CD1 4.06Å; I858-L879 HydrophobicContact CG1-CD1 4.09Å; I858-L879 HydrophobicContact CG2-CD2 3.89Å; I858-V1086 HydrophobicContact CD1-CB 4.49Å; I858-V1086 HydrophobicContact CD1-CG1 4.03Å; I858-V1086 HydrophobicContact CD1-CG2 3.69Å; I858-V1086 HydrophobicContact CG1-CG2 3.88Å
859	S	96.9	Very high	97.2	Very high	22 Å²	22	41 Å²	41	15%	0.154	21%	0.213	C	C	.	.			trans	-77.4	146.3	167.8	-171.1	0	0	0	0	111.6	V614 K861 Q870	V614-S859 VanDerWaalsContact O-CB 3.29Å; V614-S859 WeakPolarHBondContact O-CB 3.36Å; V614-S859 PolarHBondContact O-N 2.78Å; S859-K861 PolarHBondContact O-N 3.34Å; S859-K861 VanDerWaalsContact O-N 3.13Å; S859-Q870 WeakPolarHBondContact O-CG 3.44Å; S859-Q870 PolarHBondContact O-NE2 3.48Å
860	D	96	Very high	97.2	Very high	126 Å²	126	40.9 Å²	40.9	67%	0.674	21%	0.212	S	C	*	.	S	Bend	trans	-69.1	-6.8	176	-45.4	-73.2	0	0	0	113.5	Q870	D860-Q870 WeakPolarHBondContact O-CB 3.41Å
861	K	96.5	Very high	97.1	Very high	105 Å²	105	47.2 Å²	47.2	46%	0.457	24%	0.236	S	C	.	.	S	Bend	trans	-117.9	150.3	179.1	-70.1	175.3	170.6	-164.8	0	110.9	S859 G865 Q866 V867 Q870	S859-K861 PolarHBondContact O-N 3.34Å; S859-K861 VanDerWaalsContact O-N 3.13Å; K861-G865 VanDerWaalsContact CD-O 3.26Å; K861-G865 WeakPolarHBondContact CD-O 3.23Å; K861-G865 WeakPolarHBondContact CG-O 3.21Å; K861-Q866 WeakPolarHBondContact CA-O 3.29Å; K861-V867 HydrophobicContact CG-CG2 3.75Å; K861-Q870 PolarHBondContact O-NE2 3.28Å
862	D	95.8	Very high	97	Very high	14 Å²	14	49 Å²	49	8%	0.075	25%	0.251	C	S	.	.			trans	-77.7	-176.5	168.4	72.9	8.4	0	0	0	112.6	F864 G865 Q866 G869	D862-F864 PolarHBondContact O-N 3.46Å; D862-F864 WeakPolarHBondContact OD1-CA 3.41Å; D862-F864 WeakPolarHBondContact OD1-CB 3.45Å; D862-F864 PolarHBondContact OD1-N 3.31Å; D862-G865 PolarHBondContact O-N 3.36Å; D862-G865 PolarHBondContact OD1-N 3.33Å; D862-G865 VanDerWaalsContact OD1-N 3.12Å; D862-Q866 PolarHBondContact N-O 3.4Å; D862-Q866 PolarHBondContact OD1-N 3.4Å; D862-G869 WeakPolarHBondContact OD2-CA 3.45Å
863	E	95.1	Very high	96.9	Very high	28 Å²	28	50.4 Å²	50.4	13%	0.131	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.8	177.8	55	180	133.6	0	0	115.3	V592 R596 V612	V592-E863 HydrophobicContact CG1-CB 3.94Å; R596-E863 IonicContact CZ-OE1 3.6Å; R596-E863 IonicContact CZ-OE2 2.68Å; R596-E863 IonicContact NE-OE2 3.49Å; R596-E863 PolarHBondContact NE-OE2 3.35Å; R596-E863 IonicContact NH2-OE1 3.18Å; R596-E863 PolarHBondContact NH2-OE1 2.9Å; R596-E863 IonicContact NH2-OE2 2.89Å; R596-E863 PolarHBondContact NH2-OE2 3.01Å; V612-E863 HydrophobicContact CB-CB 3.88Å; V612-E863 HydrophobicContact CB-CG 4.48Å; V612-E863 VanDerWaalsContact CB-OE2 3.3Å; V612-E863 WeakPolarHBondContact CB-OE2 3.31Å; V612-E863 WeakPolarHBondContact CG2-OE2 3.42Å; V612-E863 PolarHBondContact N-OE1 2.81Å; V612-E863 PolarHBondContact N-OE2 2.66Å; V612-E863 WeakPolarHBondContact O-CB 3.48Å
864	F	95.9	Very high	96.8	Very high	129 Å²	129	52.5 Å²	52.5	57%	0.566	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	2.6	174.6	-51.7	-67.9	0	0	0	112.1	D862 Q866	D862-F864 PolarHBondContact O-N 3.46Å; D862-F864 WeakPolarHBondContact OD1-CA 3.41Å; D862-F864 WeakPolarHBondContact OD1-CB 3.45Å; D862-F864 PolarHBondContact OD1-N 3.31Å; F864-Q866 VanDerWaalsContact C-N 3.35Å; F864-Q866 HydrophobicContact CB-CG 4.23Å
865	G	95.2	Very high	96.7	Very high	37 Å²	37	61.6 Å²	61.6	38%	0.381	30%	0.302	S	S	.	.	S	Bend	trans	80.7	11	-178.1	0	0	0	0	0	114.5	K861 D862	K861-G865 VanDerWaalsContact CD-O 3.26Å; K861-G865 WeakPolarHBondContact CD-O 3.23Å; K861-G865 WeakPolarHBondContact CG-O 3.21Å; D862-G865 PolarHBondContact O-N 3.36Å; D862-G865 PolarHBondContact OD1-N 3.33Å; D862-G865 VanDerWaalsContact OD1-N 3.12Å
866	Q	97.1	Very high	96.5	Very high	103 Å²	103	64.2 Å²	64.2	48%	0.481	32%	0.322	S	S	.	.			trans	-93.7	135.9	-175.3	-56.8	-177.1	19.5	0	0	111.2	K861 D862 F864	K861-Q866 WeakPolarHBondContact CA-O 3.29Å; D862-Q866 PolarHBondContact N-O 3.4Å; D862-Q866 PolarHBondContact OD1-N 3.4Å; F864-Q866 VanDerWaalsContact C-N 3.35Å; F864-Q866 HydrophobicContact CB-CG 4.23Å
867	V	97.5	Very high	96.2	Very high	50 Å²	50	65.7 Å²	65.7	30%	0.303	34%	0.338	S	S	.	.	H	α-helix	trans	-80.8	-35	177.2	175.6	0	0	0	0	109.6	K861 G869 Q870 W871	K861-V867 HydrophobicContact CG-CG2 3.75Å; V867-G869 PolarHBondContact O-N 3.29Å; V867-Q870 WeakPolarHBondContact O-CB 3.29Å; V867-Q870 PolarHBondContact O-N 3.35Å; V867-Q870 VanDerWaalsContact O-N 3.17Å; V867-W871 VanDerWaalsContact O-CD1 3.25Å; V867-W871 PolarHBondContact O-N 3.32Å
868	E	97.2	Very high	96.1	Very high	130 Å²	130	64.3 Å²	64.3	61%	0.607	33%	0.333	S	S	*	.	H	α-helix	trans	-63.4	-39.5	-179.7	-64.8	63.5	-142.1	0	0	111.8	W871 A872	E868-W871 CarbonylContact O-C 3.58Å; E868-W871 PolarHBondContact O-N 2.92Å; E868-A872 WeakPolarHBondContact O-CB 3.47Å; E868-A872 PolarHBondContact O-N 3.26Å
869	G	96	Very high	96.1	Very high	15 Å²	15	63.8 Å²	63.8	16%	0.155	33%	0.33	C	S	.	.	H	α-helix	trans	-68.2	-36.4	174	0	0	0	0	0	112.7	D862 V867 A872 K873	D862-G869 WeakPolarHBondContact OD2-CA 3.45Å; V867-G869 PolarHBondContact O-N 3.29Å; G869-A872 WeakPolarHBondContact O-CB 3.25Å; G869-A872 PolarHBondContact O-N 3.41Å; G869-K873 PolarHBondContact O-N 3.42Å
870	Q	97.2	Very high	96	Very high	5 Å²	5	66.4 Å²	66.4	2%	0.023	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-45.8	172.1	-153.3	68.6	-19.7	0	0	110.9	S859 D860 K861 V867 A872 K873 I874	S859-Q870 WeakPolarHBondContact O-CG 3.44Å; S859-Q870 PolarHBondContact O-NE2 3.48Å; D860-Q870 WeakPolarHBondContact O-CB 3.41Å; K861-Q870 PolarHBondContact O-NE2 3.28Å; V867-Q870 WeakPolarHBondContact O-CB 3.29Å; V867-Q870 PolarHBondContact O-N 3.35Å; V867-Q870 VanDerWaalsContact O-N 3.17Å; Q870-A872 VanDerWaalsContact C-N 3.3Å; Q870-A872 PolarHBondContact O-N 3.1Å; Q870-K873 PolarHBondContact O-N 3.46Å; Q870-I874 WeakPolarHBondContact O-CG1 3.17Å; Q870-I874 PolarHBondContact O-N 3.46Å
871	W	96.8	Very high	96	Very high	147 Å²	147	63.8 Å²	63.8	56%	0.557	33%	0.328	S	S	*	.	H	α-helix	trans	-65.8	-25.6	172.1	-78.2	106.1	0	0	0	114.2	V867 E868 I874 R875	V867-W871 VanDerWaalsContact O-CD1 3.25Å; V867-W871 PolarHBondContact O-N 3.32Å; E868-W871 CarbonylContact O-C 3.58Å; E868-W871 PolarHBondContact O-N 2.92Å; W871-I874 HydrophobicContact CD2-CD1 4.33Å; W871-I874 HydrophobicContact CE3-CB 4.37Å; W871-I874 HydrophobicContact CE3-CD1 4.01Å; W871-I874 HydrophobicContact CE3-CG2 4.31Å; W871-I874 HydrophobicContact CZ3-CD1 4.25Å; W871-I874 HydrophobicContact CZ3-CG2 4.37Å; W871-R875 WeakPolarHBondContact O-CB 3.41Å; W871-R875 VanDerWaalsContact O-CG 3.27Å; W871-R875 WeakPolarHBondContact O-CG 3.42Å; W871-R875 PolarHBondContact O-N 3.03Å; W871-R875 PolarHBondContact O-NE 3.16Å
872	A	96.6	Very high	95.9	Very high	44 Å²	44	60.9 Å²	60.9	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-70	-40.9	171.5	0	0	0	0	0	111.4	E868 G869 Q870 I874 R875 S876	E868-A872 WeakPolarHBondContact O-CB 3.47Å; E868-A872 PolarHBondContact O-N 3.26Å; G869-A872 WeakPolarHBondContact O-CB 3.25Å; G869-A872 PolarHBondContact O-N 3.41Å; Q870-A872 VanDerWaalsContact C-N 3.3Å; Q870-A872 PolarHBondContact O-N 3.1Å; A872-I874 VanDerWaalsContact C-N 3.33Å; A872-I874 PolarHBondContact O-N 3.32Å; A872-R875 PolarHBondContact O-N 2.94Å; A872-S876 WeakPolarHBondContact O-CB 3.37Å; A872-S876 PolarHBondContact O-N 3.15Å; A872-S876 PolarHBondContact O-OG 2.99Å
873	K	96.5	Very high	95.4	Very high	31 Å²	31	64.3 Å²	64.3	14%	0.135	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-34.2	173.4	-70.2	-179.3	-67.4	174.2	0	112.6	E613 G869 Q870 S876 G877 A878 L879	E613-K873 WeakPolarHBondContact OE1-CD 3.41Å; E613-K873 IonicContact OE1-NZ 3.56Å; E613-K873 PolarHBondContact OE1-NZ 2.74Å; E613-K873 IonicContact OE2-NZ 3.18Å; E613-K873 PolarHBondContact OE2-NZ 2.9Å; G869-K873 PolarHBondContact O-N 3.42Å; Q870-K873 PolarHBondContact O-N 3.46Å; K873-S876 WeakPolarHBondContact CA-OG 3.35Å; K873-S876 PolarHBondContact O-OG 3.45Å; K873-G877 PolarHBondContact O-N 3.45Å; K873-A878 HydrophobicContact CB-CB 4.39Å; K873-A878 PolarHBondContact O-N 2.6Å; K873-A878 VanDerWaalsContact O-N 3.1Å; K873-L879 HydrophobicContact CB-CB 4.12Å; K873-L879 PolarHBondContact O-N 3.08Å
874	I	96.3	Very high	94.8	Very high	48 Å²	48	65.4 Å²	65.4	25%	0.246	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-53.7	171.8	-64.3	169.2	0	0	0	111	Q870 W871 A872 S876 G877 L879 V881	Q870-I874 WeakPolarHBondContact O-CG1 3.17Å; Q870-I874 PolarHBondContact O-N 3.46Å; W871-I874 HydrophobicContact CD2-CD1 4.33Å; W871-I874 HydrophobicContact CE3-CB 4.37Å; W871-I874 HydrophobicContact CE3-CD1 4.01Å; W871-I874 HydrophobicContact CE3-CG2 4.31Å; W871-I874 HydrophobicContact CZ3-CD1 4.25Å; W871-I874 HydrophobicContact CZ3-CG2 4.37Å; A872-I874 VanDerWaalsContact C-N 3.33Å; A872-I874 PolarHBondContact O-N 3.32Å; I874-S876 PolarHBondContact O-N 3.42Å; I874-G877 PolarHBondContact O-N 3.28Å; I874-G877 VanDerWaalsContact O-N 3.08Å; I874-L879 WeakPolarHBondContact CA-O 3.32Å; I874-L879 HydrophobicContact CD1-CD2 4.39Å; I874-L879 HydrophobicContact CG1-CB 4.37Å; I874-L879 HydrophobicContact CG1-CD2 3.83Å; I874-L879 HydrophobicContact CG1-CG 4.1Å; I874-V881 HydrophobicContact CD1-CG2 3.97Å; I874-V881 HydrophobicContact CG1-CG2 4.03Å; I874-V881 HydrophobicContact CG2-CG2 4.2Å
875	R	96.3	Very high	93.5	Very high	193 Å²	193	62.4 Å²	62.4	73%	0.728	34%	0.34	S	S	*	.	H	α-helix	trans	-63.3	-25.7	-178.4	-73.7	177.7	-67.9	172	-0.5	114.1	W871 A872	W871-R875 WeakPolarHBondContact O-CB 3.41Å; W871-R875 VanDerWaalsContact O-CG 3.27Å; W871-R875 WeakPolarHBondContact O-CG 3.42Å; W871-R875 PolarHBondContact O-N 3.03Å; W871-R875 PolarHBondContact O-NE 3.16Å; A872-R875 PolarHBondContact O-N 2.94Å
876	S	94.3	Very high	92.1	Very high	71 Å²	71	65.2 Å²	65.2	50%	0.497	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.2	176.4	56.4	0	0	0	0	114.4	A872 K873 I874 A878	A872-S876 WeakPolarHBondContact O-CB 3.37Å; A872-S876 PolarHBondContact O-N 3.15Å; A872-S876 PolarHBondContact O-OG 2.99Å; K873-S876 WeakPolarHBondContact CA-OG 3.35Å; K873-S876 PolarHBondContact O-OG 3.45Å; I874-S876 PolarHBondContact O-N 3.42Å; S876-A878 PolarHBondContact O-N 3.18Å
877	G	93	Very high	90.6	Very high	32 Å²	32	65.2 Å²	65.2	33%	0.33	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	1.8	-177.8	0	0	0	0	0	115.3	K873 I874 L879	K873-G877 PolarHBondContact O-N 3.45Å; I874-G877 PolarHBondContact O-N 3.28Å; I874-G877 VanDerWaalsContact O-N 3.08Å; G877-L879 PolarHBondContact O-N 3.44Å
878	A	94.9	Very high	89	Confident	8 Å²	8	68 Å²	68	7%	0.066	36%	0.357	C	S	.	.	S	Bend	trans	-66.2	-20	171.4	0	0	0	0	0	112.4	R611 R636 K873 S876	R611-A878 PolarHBondContact NH2-O 2.97Å; R636-A878 PolarHBondContact N-O 2.89Å; R636-A878 VanDerWaalsContact O-O 3.1Å; K873-A878 HydrophobicContact CB-CB 4.39Å; K873-A878 PolarHBondContact O-N 2.6Å; K873-A878 VanDerWaalsContact O-N 3.1Å; S876-A878 PolarHBondContact O-N 3.18Å
879	L	96.9	Very high	87.9	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	106.6	165.6	172.1	60.6	0	0	0	108.7	W633 I635 I858 K873 I874 G877	W633-L879 HydrophobicContact CB-CD1 4.19Å; I635-L879 HydrophobicContact CG1-CD1 4.1Å; I858-L879 HydrophobicContact CD1-CD1 4.06Å; I858-L879 HydrophobicContact CG1-CD1 4.09Å; I858-L879 HydrophobicContact CG2-CD2 3.89Å; K873-L879 HydrophobicContact CB-CB 4.12Å; K873-L879 PolarHBondContact O-N 3.08Å; I874-L879 WeakPolarHBondContact CA-O 3.32Å; I874-L879 HydrophobicContact CD1-CD2 4.39Å; I874-L879 HydrophobicContact CG1-CB 4.37Å; I874-L879 HydrophobicContact CG1-CD2 3.83Å; I874-L879 HydrophobicContact CG1-CG 4.1Å; G877-L879 PolarHBondContact O-N 3.44Å
880	H	95.8	Very high	86.8	Confident	76 Å²	76	68.7 Å²	68.7	35%	0.352	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	112.3	178.7	-163.6	126.1	0	0	0	109.6	W633 V634	W633-H880 CarbonylContact C-O 3.48Å; W633-H880 WeakPolarHBondContact CA-O 3.35Å; V634-H880 HydrophobicContact CB-CB 4.2Å; V634-H880 PolarHBondContact N-O 3.27Å; V634-H880 PolarHBondContact O-N 3.35Å
881	V	95.3	Very high	86	Confident	71 Å²	71	69.6 Å²	69.6	43%	0.43	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	119.8	170.4	-171.6	0	0	0	0	108.1	I874	I874-V881 HydrophobicContact CD1-CG2 3.97Å; I874-V881 HydrophobicContact CG1-CG2 4.03Å; I874-V881 HydrophobicContact CG2-CG2 4.2Å
882	L	93.4	Very high	85	Confident	44 Å²	44	65.2 Å²	65.2	23%	0.23	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-87	155	-179.9	-65	170.1	0	0	0	110.9	A631 K632 V634 F1078	A631-L882 HydrophobicContact CB-CD1 3.87Å; A631-L882 VanDerWaalsContact O-CD1 3.31Å; A631-L882 WeakPolarHBondContact O-CD1 3.34Å; K632-L882 WeakPolarHBondContact O-CB 3.34Å; K632-L882 PolarHBondContact O-N 3.13Å; V634-L882 HydrophobicContact CG2-CD1 3.64Å; V634-L882 HydrophobicContact CG2-CD2 4.5Å; V634-L882 HydrophobicContact CG2-CG 4.08Å; L882-F1078 HydrophobicContact CB-CE1 4.12Å; L882-F1078 HydrophobicContact CB-CZ 4.42Å; L882-F1078 VanDerWaalsContact O-CE1 3.23Å; L882-F1078 WeakPolarHBondContact O-CE1 3.3Å
883	S	86.3	Confident	84.1	Confident	87 Å²	87	66 Å²	66	61%	0.608	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-98.7	162.6	165.8	66.1	0	0	0	0	110.8
884	S	82.9	Confident	83.2	Confident	50 Å²	50	70.8 Å²	70.8	35%	0.35	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-58.5	147.1	166.3	51.9	0	0	0	0	111.3
885	F	68.1	Low	82.5	Confident	66 Å²	66	72 Å²	72	29%	0.289	38%	0.384	S	S	.	.			trans	-142.7	142.2	168.1	48.5	-104.3	0	0	0	109.5	R887 S1074	F885-R887 HydrophobicContact CD2-CG 3.75Å; F885-R887 HydrophobicContact CE2-CG 3.97Å; F885-S1074 PolarHBondContact N-OG 3.24Å; F885-S1074 PolarHBondContact O-OG 2.93Å
886	P	64.9	Low	81.9	Confident	96 Å²	96	65.4 Å²	65.4	62%	0.623	37%	0.366	S	S	*	.			trans	-76.5	134.4	161.5	31.3	-31.2	0	0	0	109.2	W1071	P886-W1071 HydrophobicContact CB-CE3 4.25Å; P886-W1071 HydrophobicContact CB-CZ3 4.45Å
887	R	67	Low	81.4	Confident	104 Å²	104	65.4 Å²	65.4	39%	0.392	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.5	166.4	-82.9	179.7	-162.9	-168.3	5.4	109.7	F885 V889 S1072	F885-R887 HydrophobicContact CD2-CG 3.75Å; F885-R887 HydrophobicContact CE2-CG 3.97Å; R887-V889 HydrophobicContact CB-CG2 4.35Å; R887-V889 PolarHBondContact O-N 3.01Å; R887-S1072 PolarHBondContact N-O 3.42Å; R887-S1072 PolarHBondContact O-N 3.18Å; R887-S1072 VanDerWaalsContact O-O 3.11Å
888	E	63.4	Low	80.8	Confident	107 Å²	107	66.2 Å²	66.2	50%	0.5	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	125	164.3	-173.5	168.9	-131.3	0	0	108.4	W1071	E888-W1071 HydrophobicContact CB-CE3 4.32Å; E888-W1071 HydrophobicContact CB-CH2 4.04Å; E888-W1071 HydrophobicContact CB-CZ2 4.3Å; E888-W1071 HydrophobicContact CB-CZ3 4.05Å
889	V	73.3	Confident	79.9	Confident	28 Å²	28	69 Å²	69	17%	0.17	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	129.8	-176.9	174.9	0	0	0	0	109	R887 L891 V1070 S1072	R887-V889 HydrophobicContact CB-CG2 4.35Å; R887-V889 PolarHBondContact O-N 3.01Å; V889-L891 HydrophobicContact CG1-CD2 4.27Å; V889-V1070 CarbonylContact C-O 3.56Å; V889-V1070 PolarHBondContact N-O 2.87Å; V889-V1070 PolarHBondContact O-N 3.49Å; V889-S1072 VanDerWaalsContact CG2-CB 3.49Å
890	R	73.9	Confident	79	Confident	133 Å²	133	78.6 Å²	78.6	50%	0.502	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	129	175.5	-68	-173.8	171.4	132.7	4.9	110.1	A707 L711 E1069	A707-R890 HydrophobicContact CB-CB 3.89Å; A707-R890 WeakPolarHBondContact CB-O 3.47Å; A707-R890 PolarHBondContact N-O 3.46Å; A707-R890 VanDerWaalsContact N-O 3.08Å; L711-R890 HydrophobicContact CD1-CB 4.41Å; R890-E1069 HydrophobicContact CG-CG 4.31Å; R890-E1069 IonicContact CZ-OE1 2.81Å; R890-E1069 IonicContact NE-OE1 2.77Å; R890-E1069 PolarHBondContact NE-OE1 2.8Å; R890-E1069 IonicContact NH2-OE1 3.22Å; R890-E1069 PolarHBondContact NH2-OE1 2.91Å
891	L	79.6	Confident	78.3	Confident	24 Å²	24	80 Å²	80	13%	0.126	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	148.4	171.6	-59.9	-176.7	0	0	0	110.6	Q626 V889 E1068 V1070	Q626-L891 HydrophobicContact CG-CD2 4.47Å; Q626-L891 VanDerWaalsContact OE1-CD1 3.29Å; V889-L891 HydrophobicContact CG1-CD2 4.27Å; L891-E1068 PolarHBondContact N-O 3.05Å; L891-E1068 VanDerWaalsContact N-O 3.15Å; L891-V1070 HydrophobicContact CD1-CB 3.79Å; L891-V1070 HydrophobicContact CD1-CG1 3.98Å; L891-V1070 HydrophobicContact CD1-CG2 3.82Å; L891-V1070 HydrophobicContact CG-CB 4.1Å; L891-V1070 HydrophobicContact CG-CG2 4.24Å
892	L	77.2	Confident	77.7	Confident	54 Å²	54	80.8 Å²	80.8	28%	0.283	42%	0.423	S	S	.	.			trans	-82.4	128.4	171.7	-63	169.9	0	0	0	109.3	T705 L711 E894 V896	T705-L892 WeakPolarHBondContact O-CB 3.33Å; T705-L892 WeakPolarHBondContact O-CG 3.31Å; T705-L892 PolarHBondContact O-N 3.48Å; L711-L892 HydrophobicContact CD2-CD2 3.6Å; L711-L892 HydrophobicContact CD2-CG 4.44Å; L892-E894 WeakPolarHBondContact CB-O 3.2Å; L892-E894 PolarHBondContact O-N 2.64Å; L892-E894 VanDerWaalsContact O-N 3.16Å; L892-V896 HydrophobicContact CD1-CG2 3.41Å; L892-V896 VanDerWaalsContact CD1-CG2 3.41Å
893	A	75.9	Confident	77.1	Confident	60 Å²	60	87.5 Å²	87.5	50%	0.496	45%	0.445	S	S	.	.	S	Bend	trans	-63.7	-16.8	179.1	0	0	0	0	0	114.4	K1066	A893-K1066 WeakPolarHBondContact CB-O 3.17Å
894	E	78.4	Confident	76.9	Confident	132 Å²	132	88.5 Å²	88.5	62%	0.617	44%	0.44	S	S	*	.	S	Bend	trans	-126.2	138.7	165.4	-74.5	-165.5	-173.4	0	0	110.5	L892 V896	L892-E894 WeakPolarHBondContact CB-O 3.2Å; L892-E894 PolarHBondContact O-N 2.64Å; L892-E894 VanDerWaalsContact O-N 3.16Å; E894-V896 PolarHBondContact O-N 3.41Å
895	P	82.6	Confident	77.2	Confident	73 Å²	73	89.6 Å²	89.6	47%	0.474	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-52.8	128.1	165.8	-30.2	37.5	0	0	0	112.5	D703 R704 T705 K897	D703-P895 WeakPolarHBondContact O-CB 3.42Å; R704-P895 WeakPolarHBondContact O-CA 3.32Å; T705-P895 HydrophobicContact CG2-CB 4.43Å; T705-P895 HydrophobicContact CG2-CG 3.92Å; P895-K897 PolarHBondContact O-N 2.95Å
896	V	82.2	Confident	78.1	Confident	56 Å²	56	89.2 Å²	89.2	34%	0.339	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-52.3	124.8	179.6	177.4	0	0	0	0	109.5	L700 R704 L892 E894	L700-V896 HydrophobicContact CD1-CB 3.68Å; L700-V896 HydrophobicContact CD1-CG1 4.12Å; L700-V896 HydrophobicContact CD1-CG2 3.74Å; L700-V896 HydrophobicContact CD2-CG2 4.41Å; R704-V896 PolarHBondContact NH1-O 2.9Å; R704-V896 PolarHBondContact NH2-O 2.87Å; R704-V896 PolarHBondContact O-N 3.23Å; L892-V896 HydrophobicContact CD1-CG2 3.41Å; L892-V896 VanDerWaalsContact CD1-CG2 3.41Å; E894-V896 PolarHBondContact O-N 3.41Å
897	K	83.6	Confident	79.2	Confident	70 Å²	70	93.6 Å²	93.6	30%	0.304	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-63.4	151.3	-176.6	-62.6	-176.2	-179.4	-170.4	0	111.5	R704 P895 K901 I902 E905	R704-K897 PolarHBondContact NH2-O 3.19Å; P895-K897 PolarHBondContact O-N 2.95Å; K897-K901 HydrophobicContact CB-CD 4.38Å; K897-K901 HydrophobicContact CD-CD 4.44Å; K897-K901 HydrophobicContact CG-CD 4.25Å; K897-I902 HydrophobicContact CB-CD1 4.11Å; K897-I902 HydrophobicContact CB-CG1 3.69Å; K897-E905 WeakPolarHBondContact CD-OE2 3.37Å; K897-E905 IonicContact NZ-OE1 2.65Å; K897-E905 PolarHBondContact NZ-OE1 2.99Å; K897-E905 IonicContact NZ-OE2 3.13Å; K897-E905 PolarHBondContact NZ-OE2 2.92Å
898	S	80.7	Confident	80.3	Confident	49 Å²	49	93.2 Å²	93.2	34%	0.343	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-80.9	151.6	175.1	72	0	0	0	0	110.6	R900 K901 I902	S898-R900 PolarHBondContact O-N 2.98Å; S898-R900 VanDerWaalsContact O-N 3.11Å; S898-K901 WeakPolarHBondContact O-CA 3.43Å; S898-K901 PolarHBondContact O-N 3.46Å; S898-K901 WeakPolarHBondContact OG-CB 3.4Å; S898-K901 PolarHBondContact OG-N 2.92Å; S898-I902 WeakPolarHBondContact O-CG1 3.38Å; S898-I902 PolarHBondContact O-N 2.9Å
899	A	77.2	Confident	81.6	Confident	68 Å²	68	94.6 Å²	94.6	56%	0.562	46%	0.463	S	S	*	.	H	α-helix	trans	-57.1	-29.2	177.7	0	0	0	0	0	113.1	R903	A899-R903 WeakPolarHBondContact O-CB 3.2Å; A899-R903 VanDerWaalsContact O-CG 3.25Å; A899-R903 WeakPolarHBondContact O-CG 3.47Å; A899-R903 PolarHBondContact O-N 3.08Å; A899-R903 VanDerWaalsContact O-N 3.08Å
900	R	77.2	Confident	82.4	Confident	202 Å²	202	96 Å²	96	76%	0.762	48%	0.478	S	S	*	.	H	α-helix	trans	-66.8	-48.1	170.8	-177.6	177.2	175.1	176	-0.7	111.6	S898 R903 Q904	S898-R900 PolarHBondContact O-N 2.98Å; S898-R900 VanDerWaalsContact O-N 3.11Å; R900-R903 PolarHBondContact O-N 3.27Å; R900-Q904 WeakPolarHBondContact O-CB 3.42Å; R900-Q904 PolarHBondContact O-N 2.83Å
901	K	81.4	Confident	83.1	Confident	105 Å²	105	95.5 Å²	95.5	46%	0.457	48%	0.481	S	S	.	.	H	α-helix	trans	-61.6	-46.5	177.3	-175.6	171.5	177.3	178.8	0	111.1	K897 S898 R903 Q904 E905	K897-K901 HydrophobicContact CB-CD 4.38Å; K897-K901 HydrophobicContact CD-CD 4.44Å; K897-K901 HydrophobicContact CG-CD 4.25Å; S898-K901 WeakPolarHBondContact O-CA 3.43Å; S898-K901 PolarHBondContact O-N 3.46Å; S898-K901 WeakPolarHBondContact OG-CB 3.4Å; S898-K901 PolarHBondContact OG-N 2.92Å; K901-R903 PolarHBondContact O-N 2.87Å; K901-Q904 PolarHBondContact O-N 2.65Å; K901-Q904 VanDerWaalsContact O-N 3.13Å; K901-E905 WeakPolarHBondContact CE-OE1 3.36Å; K901-E905 HydrophobicContact CG-CG 4.4Å; K901-E905 WeakPolarHBondContact CG-OE1 3.34Å; K901-E905 WeakPolarHBondContact O-CG 3.38Å; K901-E905 PolarHBondContact O-N 2.75Å
902	I	82.4	Confident	83.5	Confident	89 Å²	89	97.1 Å²	97.1	46%	0.456	50%	0.497	S	S	.	.	H	α-helix	trans	-58.9	-47.2	177	-62.9	166.9	0	0	0	111.1	K897 S898 Q904 E905 A906	K897-I902 HydrophobicContact CB-CD1 4.11Å; K897-I902 HydrophobicContact CB-CG1 3.69Å; S898-I902 WeakPolarHBondContact O-CG1 3.38Å; S898-I902 PolarHBondContact O-N 2.9Å; I902-Q904 VanDerWaalsContact C-N 3.31Å; I902-Q904 PolarHBondContact O-N 3.39Å; I902-E905 PolarHBondContact O-N 2.81Å; I902-A906 VanDerWaalsContact O-CB 3.31Å; I902-A906 WeakPolarHBondContact O-CB 3.21Å; I902-A906 PolarHBondContact O-N 3.47Å
903	R	80.3	Confident	84.1	Confident	184 Å²	184	97.7 Å²	97.7	69%	0.694	50%	0.499	S	S	*	.	H	α-helix	trans	-65.6	-31.4	176.7	-73.6	174.9	-178.8	-174.3	1.3	113	A899 R900 K901 R907	A899-R903 WeakPolarHBondContact O-CB 3.2Å; A899-R903 VanDerWaalsContact O-CG 3.25Å; A899-R903 WeakPolarHBondContact O-CG 3.47Å; A899-R903 PolarHBondContact O-N 3.08Å; A899-R903 VanDerWaalsContact O-N 3.08Å; R900-R903 PolarHBondContact O-N 3.27Å; K901-R903 PolarHBondContact O-N 2.87Å; R903-R907 WeakPolarHBondContact O-CB 3.42Å; R903-R907 VanDerWaalsContact O-CG 3.25Å; R903-R907 WeakPolarHBondContact O-CG 3.24Å; R903-R907 PolarHBondContact O-N 2.85Å; R903-R907 VanDerWaalsContact O-N 3.08Å
904	Q	82.3	Confident	84.7	Confident	108 Å²	108	101.9 Å²	101.9	51%	0.505	51%	0.506	S	S	.	.	H	α-helix	trans	-73.8	-45.5	176.3	-175.7	170.2	-13.4	0	0	111.5	R900 K901 I902 A906 R907 L908	R900-Q904 WeakPolarHBondContact O-CB 3.42Å; R900-Q904 PolarHBondContact O-N 2.83Å; K901-Q904 PolarHBondContact O-N 2.65Å; K901-Q904 VanDerWaalsContact O-N 3.13Å; I902-Q904 VanDerWaalsContact C-N 3.31Å; I902-Q904 PolarHBondContact O-N 3.39Å; Q904-A906 PolarHBondContact O-N 3.34Å; Q904-R907 PolarHBondContact O-N 2.7Å; Q904-L908 HydrophobicContact CG-CD1 4.22Å; Q904-L908 WeakPolarHBondContact O-CG 3.42Å; Q904-L908 PolarHBondContact O-N 3.17Å
905	E	88.7	Confident	84.8	Confident	73 Å²	73	101.1 Å²	101.1	34%	0.341	50%	0.503	S	S	.	.	H	α-helix	trans	-59.2	-44.2	173.1	-71.2	176.3	-173.9	0	0	111.2	K897 K901 I902 R907 L908 K909	K897-E905 WeakPolarHBondContact CD-OE2 3.37Å; K897-E905 IonicContact NZ-OE1 2.65Å; K897-E905 PolarHBondContact NZ-OE1 2.99Å; K897-E905 IonicContact NZ-OE2 3.13Å; K897-E905 PolarHBondContact NZ-OE2 2.92Å; K901-E905 WeakPolarHBondContact CE-OE1 3.36Å; K901-E905 HydrophobicContact CG-CG 4.4Å; K901-E905 WeakPolarHBondContact CG-OE1 3.34Å; K901-E905 WeakPolarHBondContact O-CG 3.38Å; K901-E905 PolarHBondContact O-N 2.75Å; I902-E905 PolarHBondContact O-N 2.81Å; E905-R907 PolarHBondContact O-N 2.83Å; E905-L908 PolarHBondContact O-N 2.85Å; E905-K909 WeakPolarHBondContact O-CB 3.39Å; E905-K909 PolarHBondContact O-N 2.91Å
906	A	87.9	Confident	84.7	Confident	58 Å²	58	104.1 Å²	104.1	48%	0.479	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-39.3	175.6	0	0	0	0	0	113.1	I902 Q904 K909 A910	I902-A906 VanDerWaalsContact O-CB 3.31Å; I902-A906 WeakPolarHBondContact O-CB 3.21Å; I902-A906 PolarHBondContact O-N 3.47Å; Q904-A906 PolarHBondContact O-N 3.34Å; A906-K909 PolarHBondContact O-N 2.95Å; A906-A910 WeakPolarHBondContact O-CB 3.34Å; A906-A910 PolarHBondContact O-N 3.38Å
907	R	88.4	Confident	84.6	Confident	189 Å²	189	108.5 Å²	108.5	71%	0.713	53%	0.526	S	S	*	.	H	α-helix	trans	-65.4	-43.8	174	-79.8	172.3	174.2	-170.4	-3.5	112.1	R903 Q904 E905 A910 Q911	R903-R907 WeakPolarHBondContact O-CB 3.42Å; R903-R907 VanDerWaalsContact O-CG 3.25Å; R903-R907 WeakPolarHBondContact O-CG 3.24Å; R903-R907 PolarHBondContact O-N 2.85Å; R903-R907 VanDerWaalsContact O-N 3.08Å; Q904-R907 PolarHBondContact O-N 2.7Å; E905-R907 PolarHBondContact O-N 2.83Å; R907-A910 PolarHBondContact O-N 2.85Å; R907-Q911 WeakPolarHBondContact O-CB 3.47Å; R907-Q911 WeakPolarHBondContact O-CG 3.34Å; R907-Q911 PolarHBondContact O-N 2.89Å
908	L	90.1	Very high	84.1	Confident	96 Å²	96	112.1 Å²	112.1	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-64.1	-40.9	176.6	-71.3	168.7	0	0	0	111.3	Q904 E905 Q911 A912	Q904-L908 HydrophobicContact CG-CD1 4.22Å; Q904-L908 WeakPolarHBondContact O-CG 3.42Å; Q904-L908 PolarHBondContact O-N 3.17Å; E905-L908 PolarHBondContact O-N 2.85Å; L908-Q911 PolarHBondContact O-N 3.37Å; L908-A912 WeakPolarHBondContact O-CB 3.41Å; L908-A912 PolarHBondContact O-N 2.93Å
909	K	90.7	Very high	83.4	Confident	135 Å²	135	116.2 Å²	116.2	59%	0.587	56%	0.559	S	S	*	*	H	α-helix	trans	-62.7	-47	174	-172.1	174.5	-171.2	-85.6	0	111.9	E905 A906 Q911 A912 E913	E905-K909 WeakPolarHBondContact O-CB 3.39Å; E905-K909 PolarHBondContact O-N 2.91Å; A906-K909 PolarHBondContact O-N 2.95Å; K909-Q911 VanDerWaalsContact C-N 3.28Å; K909-Q911 PolarHBondContact O-N 2.77Å; K909-A912 PolarHBondContact O-N 3.02Å; K909-E913 WeakPolarHBondContact CG-OE1 3.23Å; K909-E913 IonicContact NZ-OE1 2.7Å; K909-E913 PolarHBondContact NZ-OE1 2.88Å; K909-E913 WeakPolarHBondContact O-CG 3.3Å; K909-E913 PolarHBondContact O-N 3.11Å
910	A	89.6	Confident	82.3	Confident	59 Å²	59	116 Å²	116	49%	0.488	56%	0.563	S	S	.	*	H	α-helix	trans	-63.6	-31.8	176.1	0	0	0	0	0	113	A906 R907 K914	A906-A910 WeakPolarHBondContact O-CB 3.34Å; A906-A910 PolarHBondContact O-N 3.38Å; R907-A910 PolarHBondContact O-N 2.85Å; A910-K914 VanDerWaalsContact O-CB 3.3Å; A910-K914 WeakPolarHBondContact O-CB 3.5Å; A910-K914 PolarHBondContact O-N 2.84Å; A910-K914 VanDerWaalsContact O-N 3.15Å
911	Q	88.8	Confident	81.2	Confident	122 Å²	122	114.1 Å²	114.1	57%	0.57	57%	0.565	S	S	*	*	H	α-helix	trans	-70	-44.1	171.2	-76.3	174.9	-20.4	0	0	111.8	R907 L908 K909 K914 M915	R907-Q911 WeakPolarHBondContact O-CB 3.47Å; R907-Q911 WeakPolarHBondContact O-CG 3.34Å; R907-Q911 PolarHBondContact O-N 2.89Å; L908-Q911 PolarHBondContact O-N 3.37Å; K909-Q911 VanDerWaalsContact C-N 3.28Å; K909-Q911 PolarHBondContact O-N 2.77Å; Q911-K914 PolarHBondContact O-N 2.93Å; Q911-M915 WeakPolarHBondContact O-CG 3.45Å; Q911-M915 PolarHBondContact O-N 2.87Å
912	A	88.7	Confident	79.7	Confident	57 Å²	57	114.2 Å²	114.2	47%	0.471	58%	0.579	S	S	.	*	H	α-helix	trans	-59.9	-50	175.8	0	0	0	0	0	111.5	L908 K909 K914 M915 E916	L908-A912 WeakPolarHBondContact O-CB 3.41Å; L908-A912 PolarHBondContact O-N 2.93Å; K909-A912 PolarHBondContact O-N 3.02Å; A912-K914 PolarHBondContact O-N 3.3Å; A912-M915 PolarHBondContact O-N 3.08Å; A912-E916 WeakPolarHBondContact O-CB 3.46Å; A912-E916 PolarHBondContact O-N 2.82Å
913	E	89.6	Confident	77.7	Confident	67 Å²	67	115.4 Å²	115.4	31%	0.313	60%	0.595	S	S	.	*	H	α-helix	trans	-58.3	-33.2	174.9	-70.6	175.9	-157.5	0	0	112.5	K909 K917	K909-E913 WeakPolarHBondContact CG-OE1 3.23Å; K909-E913 IonicContact NZ-OE1 2.7Å; K909-E913 PolarHBondContact NZ-OE1 2.88Å; K909-E913 WeakPolarHBondContact O-CG 3.3Å; K909-E913 PolarHBondContact O-N 3.11Å; E913-K917 WeakPolarHBondContact O-CB 3.33Å; E913-K917 WeakPolarHBondContact O-CD 3.46Å; E913-K917 WeakPolarHBondContact O-CG 3.32Å; E913-K917 PolarHBondContact O-N 2.95Å; E913-K917 VanDerWaalsContact O-N 3.1Å
914	K	87.1	Confident	76.1	Confident	147 Å²	147	114.8 Å²	114.8	64%	0.639	61%	0.605	S	S	*	*	H	α-helix	trans	-76.2	-24.9	176	-170.6	171.1	-176.8	175.9	0	113.1	A910 Q911 A912 K918	A910-K914 VanDerWaalsContact O-CB 3.3Å; A910-K914 WeakPolarHBondContact O-CB 3.5Å; A910-K914 PolarHBondContact O-N 2.84Å; A910-K914 VanDerWaalsContact O-N 3.15Å; Q911-K914 PolarHBondContact O-N 2.93Å; A912-K914 PolarHBondContact O-N 3.3Å; K914-K918 WeakPolarHBondContact O-CG 3.47Å
915	M	80.8	Confident	74.3	Confident	116 Å²	116	116.3 Å²	116.3	57%	0.571	62%	0.621	S	S	*	*	H	α-helix	trans	-82	-41.4	172.9	-67.7	-67.2	-77.7	0	0	111.3	Q911 A912 K917 K918 L919	Q911-M915 WeakPolarHBondContact O-CG 3.45Å; Q911-M915 PolarHBondContact O-N 2.87Å; A912-M915 PolarHBondContact O-N 3.08Å; M915-K917 PolarHBondContact O-N 3.18Å; M915-K918 WeakPolarHBondContact O-CB 3.42Å; M915-K918 PolarHBondContact O-N 3.17Å; M915-L919 WeakPolarHBondContact O-CG 3.47Å; M915-L919 PolarHBondContact O-N 2.9Å
916	E	81.1	Confident	72.2	Confident	137 Å²	137	119 Å²	119	64%	0.64	65%	0.645	S	S	*	*	H	α-helix	trans	-58.6	-46.7	174	-173.5	175.8	-159.6	0	0	111.4	A912 K918 L919 G920	A912-E916 WeakPolarHBondContact O-CB 3.46Å; A912-E916 PolarHBondContact O-N 2.82Å; E916-K918 PolarHBondContact O-N 3.35Å; E916-L919 PolarHBondContact O-N 3.16Å; E916-G920 PolarHBondContact O-N 2.86Å
917	K	79.8	Confident	69.6	Low	147 Å²	147	120 Å²	120	64%	0.639	66%	0.661	S	S	*	*	H	α-helix	trans	-64.4	-17.2	174.1	-73.1	167	-176	162.2	0	114.5	E913 M915	E913-K917 WeakPolarHBondContact O-CB 3.33Å; E913-K917 WeakPolarHBondContact O-CD 3.46Å; E913-K917 WeakPolarHBondContact O-CG 3.32Å; E913-K917 PolarHBondContact O-N 2.95Å; E913-K917 VanDerWaalsContact O-N 3.1Å; M915-K917 PolarHBondContact O-N 3.18Å
918	K	73.8	Confident	67.2	Low	147 Å²	147	120.8 Å²	120.8	64%	0.639	67%	0.67	S	S	*	*	H	α-helix	trans	-85.2	-34.9	170.1	-77.3	179.9	169.9	-164.2	0	112.4	K914 M915 E916	K914-K918 WeakPolarHBondContact O-CG 3.47Å; M915-K918 WeakPolarHBondContact O-CB 3.42Å; M915-K918 PolarHBondContact O-N 3.17Å; E916-K918 PolarHBondContact O-N 3.35Å
919	L	65.3	Low	64.4	Low	135 Å²	135	123.4 Å²	123.4	71%	0.707	69%	0.689	S	S	*	*	H	α-helix	trans	-79.1	-25.5	-179.7	-69.9	165.2	0	0	0	113	M915 E916 M921	M915-L919 WeakPolarHBondContact O-CG 3.47Å; M915-L919 PolarHBondContact O-N 2.9Å; E916-L919 PolarHBondContact O-N 3.16Å; L919-M921 PolarHBondContact O-N 2.81Å
920	G	55.1	Low	61.7	Low	63 Å²	63	124.5 Å²	124.5	65%	0.649	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-2.6	176.4	0	0	0	0	0	115.9	E916 S922	E916-G920 PolarHBondContact O-N 2.86Å; G920-S922 VanDerWaalsContact C-N 3.34Å; G920-S922 PolarHBondContact O-N 3.15Å
921	M	53.5	Low	58.7	Low	163 Å²	163	127.5 Å²	127.5	80%	0.803	71%	0.712	S	S	*	*			trans	-92.7	31.2	-171.1	-155.6	73.8	77.8	0	0	113.8	L919	L919-M921 PolarHBondContact O-N 2.81Å
922	S	49.8	Very low	55.7	Low	106 Å²	106	127.7 Å²	127.7	74%	0.741	71%	0.712	S	S	*	*			trans	-142.6	68	-175.2	66.9	0	0	0	0	114.4	G920	G920-S922 VanDerWaalsContact C-N 3.34Å; G920-S922 PolarHBondContact O-N 3.15Å
923	S	40.9	Very low	52.9	Low	114 Å²	114	131.3 Å²	131.3	80%	0.797	73%	0.729	S	S	*	*			trans	-143.1	88.7	167.7	63.6	0	0	0	0	112.9
924	L	46.4	Very low	50.5	Low	172 Å²	172	132.9 Å²	132.9	90%	0.901	75%	0.745	S	S	*	*			trans	2.4	130.6	161.9	-59.9	169.4	0	0	0	120.3
925	T	43.8	Very low	47.6	Very low	139 Å²	139	132.4 Å²	132.4	85%	0.853	75%	0.749	S	S	*	*			trans	-83.1	143.9	161.2	50.1	0	0	0	0	113.2
926	P	45.3	Very low	45.1	Very low	130 Å²	130	136.3 Å²	136.3	84%	0.844	76%	0.763	S	S	*	*				-129.7	168.9	128.1	37.9	-29.7	0	0	0	110.7
927	G	32.6	Very low	42.5	Very low	79 Å²	79	133.6 Å²	133.6	81%	0.814	77%	0.772	S	S	*	*			cis	-174	149	-4.3	0	0	0	0	0	108
928	K	37.7	Very low	40	Very low	205 Å²	205	132.2 Å²	132.2	89%	0.891	78%	0.781	S	S	*	*			trans	-117.3	119.8	-160.7	-173.6	-178.5	-177.5	-178.8	0	112.8
929	V	31.3	Very low	37.9	Very low	151 Å²	151	132.1 Å²	132.1	92%	0.915	79%	0.793	S	S	*	*			trans	-133	151.6	167.9	-176.4	0	0	0	0	109
930	K	34.3	Very low	36.1	Very low	159 Å²	159	130.5 Å²	130.5	69%	0.691	80%	0.799	S	S	*	*			trans	-138.9	138.3	-166	-173.4	-153.2	-165.7	-160.4	0	110.4	E932	K930-E932 HydrophobicContact CD-CG 4.3Å; K930-E932 WeakPolarHBondContact CE-OE1 3.45Å; K930-E932 HydrophobicContact CG-CG 4.36Å; K930-E932 IonicContact NZ-OE1 2.58Å; K930-E932 PolarHBondContact NZ-OE1 3.02Å
931	S	26.1	Very low	34.9	Very low	122 Å²	122	136.6 Å²	136.6	85%	0.853	81%	0.81	S	S	*	*			trans	-150.2	160.5	159.6	52.5	0	0	0	0	108.9
932	E	25.8	Very low	33.7	Very low	125 Å²	125	135.6 Å²	135.6	58%	0.584	81%	0.807	S	S	*	*			trans	-133.6	127.2	-146.5	-60.8	-176.5	117.5	0	0	116	K930	K930-E932 HydrophobicContact CD-CG 4.3Å; K930-E932 WeakPolarHBondContact CE-OE1 3.45Å; K930-E932 HydrophobicContact CG-CG 4.36Å; K930-E932 IonicContact NZ-OE1 2.58Å; K930-E932 PolarHBondContact NZ-OE1 3.02Å
933	T	30.8	Very low	32.6	Very low	133 Å²	133	137.9 Å²	137.9	82%	0.816	81%	0.809	S	S	*	*			trans	65.2	171.9	139.4	63.9	0	0	0	0	117.9
934	P	38.2	Very low	32.1	Very low	100 Å²	100	139 Å²	139	65%	0.649	81%	0.805	S	S	*	*			cis	-133.8	168.6	3.7	42.8	-27	0	0	0	117.4
935	N	26.6	Very low	31.2	Very low	137 Å²	137	141.8 Å²	141.8	73%	0.733	80%	0.804	S	S	*	*			trans	49.8	143.4	143.9	-65.7	-27.1	0	0	0	121
936	K	28.6	Very low	30.4	Very low	198 Å²	198	140.9 Å²	140.9	86%	0.861	80%	0.798	S	S	*	*			cis	-160.6	144.6	-0.6	-119.9	172.2	-175.7	-179.7	0	107.8
937	G	26.4	Very low	29.5	Very low	81 Å²	81	143.9 Å²	143.9	84%	0.835	80%	0.798	S	S	*	*			trans	178.9	122.7	172.4	0	0	0	0	0	111.5
938	S	27.9	Very low	29.2	Very low	117 Å²	117	147 Å²	147	82%	0.818	80%	0.796	S	S	*	*			trans	-131	118.4	-163.3	55.2	0	0	0	0	113.9
939	T	28.4	Very low	28.7	Very low	146 Å²	146	143.8 Å²	143.8	90%	0.896	79%	0.787	S	S	*	*			trans	-143.5	145.2	156.7	-42.8	0	0	0	0	108.3
940	A	29	Very low	28.4	Very low	100 Å²	100	146.5 Å²	146.5	83%	0.826	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.3	147.9	-161.7	0	0	0	0	0	114.6
941	H	29.9	Very low	28.1	Very low	192 Å²	192	146.8 Å²	146.8	89%	0.889	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-101.3	135.5	175.5	-114.3	-82.9	0	0	0	112.6
942	L	27.6	Very low	28	Very low	142 Å²	142	146.4 Å²	146.4	74%	0.743	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79	135.6	177.2	179	69	0	0	0	111.7	I944	L942-I944 HydrophobicContact CD1-CD1 4.13Å; L942-I944 HydrophobicContact CD1-CG1 4.14Å
943	I	27.8	Very low	28.1	Very low	153 Å²	153	147.2 Å²	147.2	79%	0.785	80%	0.801	S	S	*	*			trans	-134.2	113.4	162.2	-59.4	-179.2	0	0	0	109.3
944	I	28.5	Very low	27.8	Very low	139 Å²	139	146.3 Å²	146.3	71%	0.713	80%	0.8	S	S	*	*			trans	-128.6	142.8	166.1	-68.9	-179.3	0	0	0	108	L942	L942-I944 HydrophobicContact CD1-CD1 4.13Å; L942-I944 HydrophobicContact CD1-CG1 4.14Å
945	R	29	Very low	27.5	Very low	230 Å²	230	146.3 Å²	146.3	87%	0.868	80%	0.802	S	S	*	*			trans	-111.6	106.6	-171.8	-64.8	168.7	69.9	-171.2	4.8	111.9
946	T	27	Very low	27.4	Very low	120 Å²	120	143.9 Å²	143.9	74%	0.736	80%	0.795	S	S	*	*			trans	-152.4	123.6	161.1	26.2	0	0	0	0	107.2
947	F	26.9	Very low	27.4	Very low	193 Å²	193	139.1 Å²	139.1	85%	0.846	79%	0.787	S	S	*	*				49.3	107.2	80	-89	-83.3	0	0	0	113.5
948	L	25.8	Very low	27.6	Very low	145 Å²	145	137.2 Å²	137.2	76%	0.759	76%	0.761	S	S	*	*				175.7	162.9	110.4	-91.9	175	0	0	0	112.5
949	L	27.5	Very low	28.2	Very low	137 Å²	137	136 Å²	136	72%	0.717	75%	0.75	S	S	*	*			trans	43.8	127.2	149.4	-67	162.2	0	0	0	121.3
950	F	23.9	Very low	28	Very low	207 Å²	207	131.3 Å²	131.3	91%	0.908	73%	0.73	S	S	*	*			trans	-105.9	115.3	146.2	-92.2	-85.1	0	0	0	109.8
951	H	27.7	Very low	28.1	Very low	166 Å²	166	132 Å²	132	77%	0.769	74%	0.736	S	S	*	*			trans	-124.5	126.9	158.3	-112.1	-92.6	0	0	0	107.1
952	S	24.2	Very low	27.9	Very low	114 Å²	114	126 Å²	126	80%	0.797	73%	0.727	S	S	*	*			trans	-92	128.1	176.7	-61.2	0	0	0	0	110.4
953	V	27.8	Very low	27.9	Very low	142 Å²	142	127.3 Å²	127.3	86%	0.861	73%	0.732	S	S	*	*			trans	-144.2	140.8	169.5	-105.5	0	0	0	0	109.3
954	S	25.6	Very low	27.9	Very low	114 Å²	114	124.6 Å²	124.6	80%	0.797	73%	0.733	S	S	*	*			trans	-167.7	142.6	175.4	-175.1	0	0	0	0	110.6
955	S	31	Very low	27.8	Very low	99 Å²	99	123 Å²	123	69%	0.692	73%	0.734	S	S	*	*			cis	-168.2	143.9	-19.6	-82.6	0	0	0	0	109.9
956	C	24.4	Very low	27.7	Very low	87 Å²	87	120.5 Å²	120.5	59%	0.588	73%	0.732	S	S	*	*			trans	-169	153.7	145.3	46.4	0	0	0	0	110.4	I198	I198-C956 HydrophobicContact CD1-CB 3.4Å; I198-C956 VanDerWaalsContact CD1-CB 3.4Å; I198-C956 HydrophobicContact CG1-CB 3.67Å
957	S	28.1	Very low	27.7	Very low	97 Å²	97	124.5 Å²	124.5	68%	0.678	73%	0.734	S	S	*	*			trans	-124.5	-124.9	-174.2	-63.4	0	0	0	0	113.4	Q199	Q199-S957 VanDerWaalsContact CG-C 3.45Å; Q199-S957 WeakPolarHBondContact CG-O 3.08Å
958	S	30.9	Very low	27.5	Very low	41 Å²	41	122 Å²	122	29%	0.287	73%	0.725	S	S	.	*			cis	-161.9	-156.5	-2.1	-43.5	0	0	0	0	106.3	Q199 C200 S201	Q199-S958 VanDerWaalsContact CD-OG 3.29Å; Q199-S958 PolarHBondContact OE1-OG 2.81Å; C200-S958 PolarHBondContact SG-O 3.38Å; S201-S958 PolarHBondContact OG-O 2.88Å
959	P	41.8	Very low	27.6	Very low	93 Å²	93	121 Å²	121	60%	0.604	72%	0.724	S	S	*	*				-116.3	-174.8	-52.3	38.5	-25.7	0	0	0	113.1	C200	C200-P959 VanDerWaalsContact SG-CD 3.57Å
960	G	24.5	Very low	27.4	Very low	46 Å²	46	122.2 Å²	122.2	47%	0.474	73%	0.731	S	S	.	*			trans	104.6	116	170.3	0	0	0	0	0	114.7
961	A	29.4	Very low	28.7	Very low	115 Å²	115	117.8 Å²	117.8	95%	0.95	72%	0.723	S	S	*	*			cis	64	130.5	38.5	0	0	0	0	0	113.7
962	G	26.1	Very low	28.8	Very low	67 Å²	67	115.3 Å²	115.3	69%	0.691	72%	0.724	S	S	*	*			cis	177.8	150.4	-7.1	0	0	0	0	0	108.1
963	I	29	Very low	29.1	Very low	168 Å²	168	113.8 Å²	113.8	86%	0.862	71%	0.714	S	S	*	*				157.9	148.1	84	-88.2	159.2	0	0	0	108.1
964	A	27	Very low	29.4	Very low	96 Å²	96	114.2 Å²	114.2	79%	0.793	71%	0.706	S	S	*	*			trans	59.1	160.9	160.1	0	0	0	0	0	121.4
965	S	27.2	Very low	29.7	Very low	105 Å²	105	117 Å²	117	73%	0.734	71%	0.706	S	S	*	*			cis	-169.6	171.3	-33.3	-164.3	0	0	0	0	111.4
966	Q	25.1	Very low	29.6	Very low	178 Å²	178	117.3 Å²	117.3	83%	0.832	71%	0.708	S	S	*	*			trans	59.9	110.4	166.3	-56	-174.4	-8.8	0	0	118.8
967	R	27.3	Very low	30	Very low	205 Å²	205	119.5 Å²	119.5	77%	0.774	72%	0.718	S	S	*	*			cis	80.1	113.1	46.4	-168.3	173.9	176.3	147	15	116.1
968	E	23.8	Very low	30.1	Very low	140 Å²	140	119.4 Å²	119.4	65%	0.654	72%	0.718	S	S	*	*			trans	70.9	156.5	154.1	-76.5	165.5	176.6	0	0	121.2
969	V	26.4	Very low	30.1	Very low	124 Å²	124	123.4 Å²	123.4	75%	0.752	74%	0.736	S	S	*	*			cis	-179.1	169.4	-33.7	123.4	0	0	0	0	111.9
970	L	25.3	Very low	29.7	Very low	163 Å²	163	125.3 Å²	125.3	85%	0.853	74%	0.74	S	S	*	*			trans	86.3	161.9	169.1	-75.7	162.3	0	0	0	120.4
971	P	49.9	Very low	30	Very low	114 Å²	114	130.6 Å²	130.6	74%	0.74	75%	0.753	S	S	*	*			trans	-142.2	-142.1	-146.2	47.1	-25.3	0	0	0	116.8
972	S	29.9	Very low	30	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	74%	0.741	S	S	*	*			trans	94.5	153.3	171.3	-95.7	0	0	0	0	118.6
973	S	31.1	Very low	30.1	Very low	82 Å²	82	136.7 Å²	136.7	57%	0.573	74%	0.739	S	S	*	*			cis	-160.2	177.4	3.9	36	0	0	0	0	115.3
974	H	33.7	Very low	30.3	Very low	151 Å²	151	133.9 Å²	133.9	70%	0.699	72%	0.722	S	S	*	*			trans	85.2	152	169.8	-49.1	-75.3	0	0	0	116.8
975	H	31.3	Very low	30.6	Very low	171 Å²	171	135.6 Å²	135.6	79%	0.792	72%	0.718	S	S	*	*			cis	-153.2	-161.5	-18.8	-105.4	-40.7	0	0	0	108.4
976	S	28.6	Very low	30.8	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	71%	0.71	S	S	*	*			cis	-159.4	-160	15.4	-161.3	0	0	0	0	112.2
977	V	33	Very low	31.2	Very low	133 Å²	133	132.1 Å²	132.1	81%	0.806	72%	0.715	S	S	*	*			trans	-140.2	-179.3	-175	-62.1	0	0	0	0	112.6
978	S	30.3	Very low	31.2	Very low	96 Å²	96	126.6 Å²	126.6	67%	0.671	71%	0.713	S	S	*	*			cis	-163.5	-171.1	10.8	-155.8	0	0	0	0	114.4
979	N	31.7	Very low	31.5	Very low	125 Å²	125	126.2 Å²	126.2	67%	0.668	72%	0.72	S	S	*	*			trans	75	178.5	157.1	-71.7	-5.1	0	0	0	122.4
980	L	32.7	Very low	31.6	Very low	132 Å²	132	123.5 Å²	123.5	69%	0.691	72%	0.717	S	S	*	*				-107.5	146.3	-113	-115.7	76.5	0	0	0	120.7
981	Q	31.1	Very low	31.7	Very low	157 Å²	157	126 Å²	126	73%	0.734	72%	0.717	S	S	*	*			trans	68.1	152.7	130.4	-110.5	179	29.5	0	0	129.2
982	F	28.6	Very low	30.6	Very low	158 Å²	158	128.7 Å²	128.7	69%	0.693	72%	0.719	S	S	*	*			trans	98.8	177	158.6	-93.8	-93.9	0	0	0	124.6
983	K	30.2	Very low	30.5	Very low	153 Å²	153	129.9 Å²	129.9	67%	0.665	72%	0.722	S	S	*	*			trans	-132.9	152.5	-131.3	-83	-172.2	165.2	-165.2	0	121.5
984	H	31.6	Very low	30.4	Very low	109 Å²	109	130.7 Å²	130.7	51%	0.505	73%	0.733	S	S	.	*			trans	84	142.2	136.8	-94.9	-102.6	0	0	0	127.8	N223	N223-H984 PolarHBondContact ND2-N 3.34Å
985	N	33.8	Very low	30	Very low	132 Å²	132	126.3 Å²	126.3	71%	0.706	73%	0.729	S	S	*	*			trans	74.7	160.7	158.7	-59.7	-2.8	0	0	0	120.7
986	G	31.4	Very low	30	Very low	54 Å²	54	121.8 Å²	121.8	56%	0.557	72%	0.722	S	S	*	*			cis	157.5	157.4	-15.3	0	0	0	0	0	117
987	V	32.5	Very low	30.1	Very low	155 Å²	155	121 Å²	121	94%	0.939	71%	0.713	S	S	*	*			trans	78.4	154.3	160.6	-176.6	0	0	0	0	116.9
988	A	29.2	Very low	30	Very low	90 Å²	90	122.5 Å²	122.5	74%	0.744	71%	0.713	S	S	*	*			cis	-155.6	-177.6	12.5	0	0	0	0	0	117.9
989	V	29.9	Very low	30	Very low	131 Å²	131	123.2 Å²	123.2	79%	0.794	72%	0.717	S	S	*	*			trans	-19.6	153.4	159.5	-179.7	0	0	0	0	120.7	Y991	V989-Y991 HydrophobicContact CG1-CD2 4.1Å; V989-Y991 HydrophobicContact CG1-CE2 3.96Å
990	G	27.1	Very low	29.8	Very low	67 Å²	67	120.8 Å²	120.8	69%	0.691	72%	0.722	S	S	*	*			cis	160.1	179.2	-5.6	0	0	0	0	0	116.9
991	Y	27.2	Very low	29.7	Very low	217 Å²	217	121.3 Å²	121.3	85%	0.851	73%	0.725	S	S	*	*			trans	85.4	163.1	165.8	-62.7	-76.8	0	0	0	123.6	V989	V989-Y991 HydrophobicContact CG1-CD2 4.1Å; V989-Y991 HydrophobicContact CG1-CE2 3.96Å
992	H	27.6	Very low	29.7	Very low	169 Å²	169	118.2 Å²	118.2	78%	0.782	72%	0.717	S	S	*	*			trans	-104.1	170	-159	-52.2	-112.9	0	0	0	116.1
993	T	27.9	Very low	30.3	Very low	139 Å²	139	115.7 Å²	115.7	85%	0.853	72%	0.716	S	S	*	*				166.2	161.3	113.5	-66.2	0	0	0	0	114.1
994	A	28.5	Very low	30	Very low	99 Å²	99	110.5 Å²	110.5	82%	0.818	70%	0.702	S	S	*	*			trans	-75.3	177.3	176.7	0	0	0	0	0	114.1
995	G	26.6	Very low	29.8	Very low	59 Å²	59	109.3 Å²	109.3	61%	0.608	71%	0.706	S	S	*	*			cis	156.7	-167.3	-2.1	0	0	0	0	0	113.4
996	A	29.5	Very low	29.4	Very low	77 Å²	77	104.4 Å²	104.4	64%	0.636	69%	0.686	S	S	*	*			trans	70.5	144	160	0	0	0	0	0	122.8	N1	N1-A996 PolarHBondContact N-O 2.63Å
997	T	30.8	Very low	29.3	Very low	90 Å²	90	108.6 Å²	108.6	55%	0.552	69%	0.692	S	S	*	*			trans	60.9	152.2	143.6	51.8	0	0	0	0	122.9	N1	N1-T997 PolarHBondContact N-O 3.48Å; N1-T997 PolarHBondContact O-OG1 2.66Å
998	M	32.2	Very low	29.2	Very low	164 Å²	164	109.1 Å²	109.1	81%	0.808	68%	0.684	S	S	*	*			cis	-172.4	163	-28.4	-115.1	-57.6	-176.8	0	0	112.2
999	S	30.3	Very low	29	Very low	110 Å²	110	108.4 Å²	108.4	77%	0.769	69%	0.685	S	S	*	*			trans	62.2	130.8	149.5	-57.8	0	0	0	0	126.8
1000	G	27.1	Very low	28.9	Very low	75 Å²	75	107.5 Å²	107.5	77%	0.773	69%	0.691	S	S	*	*			trans	86.5	163.8	138.2	0	0	0	0	0	121.7
1001	L	30.7	Very low	28.9	Very low	143 Å²	143	111.6 Å²	111.6	75%	0.749	70%	0.696	S	S	*	*				-170.5	117	-53.5	-113.7	175.8	0	0	0	112.7
1002	T	30.6	Very low	28.9	Very low	92 Å²	92	109.3 Å²	109.3	56%	0.564	70%	0.698	S	S	*	*			trans	44.4	-172.9	159.7	38.8	0	0	0	0	120.3
1003	P	41	Very low	28.9	Very low	104 Å²	104	107.3 Å²	107.3	68%	0.675	69%	0.689	S	S	*	*			cis	-130.1	-166.9	-15.2	40.1	-20.7	0	0	0	115.3
1004	A	25.2	Very low	28.9	Very low	44 Å²	44	110.4 Å²	110.4	36%	0.364	69%	0.685	S	S	.	*				145.9	104.8	121.7	0	0	0	0	0	122	Q438 C439 N440	Q438-A1004 CarbonylContact C-O 3.55Å; Q438-A1004 VanDerWaalsContact O-O 3.06Å; C439-A1004 VanDerWaalsContact C-C 3.46Å; C439-A1004 CarbonylContact C-O 3.56Å; C439-A1004 PolarHBondContact N-O 3.29Å; C439-A1004 CarbonylContact O-C 3.51Å; N440-A1004 CarbonylContact O-C 3.52Å; N440-A1004 VanDerWaalsContact O-C 3.25Å; N440-A1004 WeakPolarHBondContact O-CA 3.35Å; N440-A1004 PolarHBondContact O-N 3.47Å
1005	S	27.6	Very low	29	Very low	85 Å²	85	112.8 Å²	112.8	59%	0.594	68%	0.683	S	S	*	*			trans	40.2	117.5	139.9	60.4	0	0	0	0	126.7	Q438 C439 N440	Q438-S1005 CarbonylContact C-O 3.51Å; Q438-S1005 VanDerWaalsContact CA-O 3.3Å; Q438-S1005 WeakPolarHBondContact CA-O 3.3Å; C439-S1005 VanDerWaalsContact CA-C 3.5Å; C439-S1005 PolarHBondContact N-O 3.11Å; N440-S1005 VanDerWaalsContact N-CA 3.3Å; N440-S1005 VanDerWaalsContact N-N 3.11Å; N440-S1005 PolarHBondContact O-N 3.46Å
1006	G	24.8	Very low	30.2	Very low	28 Å²	28	115.1 Å²	115.1	29%	0.289	69%	0.687	S	S	.	*			trans	95.1	132	141.6	0	0	0	0	0	122.8	Q438 C439	Q438-G1006 WeakPolarHBondContact CG-O 3.16Å; C439-G1006 PolarHBondContact N-O 3.19Å
1007	E	29.3	Very low	30.8	Very low	143 Å²	143	117.5 Å²	117.5	67%	0.668	70%	0.696	S	S	*	*				56.2	157.3	123.8	-57.2	-155	109.4	0	0	123.9	Q438	Q438-E1007 WeakPolarHBondContact CG-O 3.23Å; Q438-E1007 PolarHBondContact NE2-O 2.97Å
1008	Q	30.7	Very low	30.5	Very low	165 Å²	165	121 Å²	121	77%	0.771	71%	0.706	S	S	*	*			cis	-158.4	172.1	-1.6	-131.5	179.9	50.9	0	0	112.2
1009	G	24.9	Very low	30.2	Very low	75 Å²	75	119 Å²	119	77%	0.773	70%	0.699	S	S	*	*			trans	111	137.4	162.4	0	0	0	0	0	115.7
1010	A	26.8	Very low	29.9	Very low	112 Å²	112	120.5 Å²	120.5	93%	0.926	70%	0.697	S	S	*	*			cis	-142.7	173.9	-2.8	0	0	0	0	0	111.1
1011	L	27.9	Very low	29.9	Very low	153 Å²	153	123.8 Å²	123.8	80%	0.801	70%	0.697	S	S	*	*			trans	-137.8	143.5	-164.3	173.3	151.2	0	0	0	113.2
1012	L	26	Very low	29.5	Very low	170 Å²	170	122.8 Å²	122.8	89%	0.89	69%	0.693	S	S	*	*			trans	-152.3	157	156.4	-142.2	99.3	0	0	0	111.9
1013	E	28.4	Very low	29.2	Very low	126 Å²	126	124.3 Å²	124.3	59%	0.589	70%	0.698	S	S	*	*			trans	-97.4	144.1	-171.8	-86.4	-167.3	105.4	0	0	113.2
1014	R	28.5	Very low	28.3	Very low	204 Å²	204	128.5 Å²	128.5	77%	0.77	71%	0.705	S	S	*	*				69.8	139.5	86.7	-134.5	-178.3	-174.1	176.8	4.7	111.4
1015	I	29.4	Very low	29.1	Very low	149 Å²	149	131.1 Å²	131.1	76%	0.764	72%	0.719	S	S	*	*			cis	-140.9	-145.9	25.1	-24	-178.5	0	0	0	111.3
1016	P	52.5	Low	28.8	Very low	108 Å²	108	135.3 Å²	135.3	70%	0.701	73%	0.727	S	S	*	*			trans	-115.2	-166.2	-151.9	42.1	-20.9	0	0	0	115.2
1017	P	41.4	Very low	28.8	Very low	128 Å²	128	142.8 Å²	142.8	83%	0.831	75%	0.751	S	S	*	*				-148.2	-162.7	106.7	41.5	-25.4	0	0	0	115.5
1018	Q	25.6	Very low	28.5	Very low	163 Å²	163	140 Å²	140	76%	0.762	75%	0.753	S	S	*	*			trans	-115.6	174.6	-176.8	-61.7	175.9	-19.5	0	0	113.3
1019	N	26.3	Very low	28.5	Very low	123 Å²	123	139.8 Å²	139.8	66%	0.658	75%	0.752	S	S	*	*			trans	109.4	128.6	136.9	-72.5	-39.6	0	0	0	123
1020	L	24	Very low	28.9	Very low	140 Å²	140	142 Å²	142	73%	0.733	75%	0.752	S	S	*	*			trans	55.4	116	131.6	-61.5	169	0	0	0	122.6
1021	N	25.3	Very low	28.8	Very low	144 Å²	144	140.8 Å²	140.8	77%	0.77	74%	0.737	S	S	*	*				160.2	173.3	123.8	-89.8	-19.6	0	0	0	110.2
1022	N	24.2	Very low	28.9	Very low	122 Å²	122	141.2 Å²	141.2	65%	0.652	74%	0.735	S	S	*	*				-172.4	160.5	-56.7	-111.5	-23.3	0	0	0	106.8
1023	D	23.5	Very low	28.7	Very low	125 Å²	125	140.4 Å²	140.4	67%	0.668	73%	0.729	S	S	*	*			trans	56.2	113.8	158.9	-58.3	-44.1	0	0	0	122.4
1024	F	23	Very low	28.6	Very low	191 Å²	191	141.6 Å²	141.6	84%	0.838	73%	0.734	S	S	*	*				34.2	158.7	104.5	-72.8	-66.1	0	0	0	121.7
1025	P	40.6	Very low	28.3	Very low	100 Å²	100	136.8 Å²	136.8	65%	0.649	74%	0.738	S	S	*	*			cis	-143.4	174.8	-10.6	37.8	-17.1	0	0	0	117.9
1026	F	22.4	Very low	28	Very low	172 Å²	172	137.1 Å²	137.1	75%	0.754	74%	0.736	S	S	*	*			trans	61.9	134.7	137.7	-91	-135.5	0	0	0	124.9
1027	K	23.1	Very low	26.5	Very low	185 Å²	185	143.9 Å²	143.9	80%	0.804	75%	0.748	S	S	*	*			trans	68.7	156.1	144.7	-72.9	-177.8	176.8	178	0	118.7
1028	A	24.4	Very low	25.7	Very low	85 Å²	85	143.2 Å²	143.2	70%	0.702	74%	0.742	S	S	*	*			cis	-166.3	174.5	-21.4	0	0	0	0	0	110.8
1029	E	29.6	Very low	25.7	Very low	160 Å²	160	141.1 Å²	141.1	75%	0.748	75%	0.745	S	S	*	*			trans	-4.5	138.5	148.5	-82.3	-80	157.3	0	0	117.8	S1031	E1029-S1031 PolarHBondContact OE2-N 3.21Å
1030	P	34.4	Very low	25.7	Very low	121 Å²	121	141 Å²	141	79%	0.786	75%	0.753	S	S	*	*				-142.8	134.4	82.9	36.9	-21.5	0	0	0	117.7
1031	S	24.4	Very low	25.7	Very low	88 Å²	88	137.4 Å²	137.4	62%	0.615	75%	0.751	S	S	*	*				40.3	159.1	107.5	-164.4	0	0	0	0	122.3	E1029	E1029-S1031 PolarHBondContact OE2-N 3.21Å
1032	E	28.9	Very low	25.7	Very low	162 Å²	162	136.4 Å²	136.4	76%	0.757	75%	0.754	S	S	*	*			trans	89.1	142.4	164.9	-56.3	-144.8	141.1	0	0	117.8
1033	M	23	Very low	25.9	Very low	152 Å²	152	141 Å²	141	75%	0.749	76%	0.762	S	S	*	*			cis	-149.9	175.3	-4.8	-123	-65.3	169.6	0	0	113.1
1034	H	25.1	Very low	25.9	Very low	151 Å²	151	145.9 Å²	145.9	70%	0.699	77%	0.771	S	S	*	*			trans	-73.8	153.5	-176.7	-95.3	-138	0	0	0	115.7
1035	A	23.1	Very low	26.1	Very low	103 Å²	103	142.7 Å²	142.7	85%	0.851	77%	0.771	S	S	*	*			trans	-143.4	145.6	138	0	0	0	0	0	110.5
1036	Q	22.8	Very low	25.4	Very low	156 Å²	156	143.3 Å²	143.3	73%	0.729	78%	0.776	S	S	*	*			trans	-131.3	170.1	178.1	-74	179.6	-39.8	0	0	109.8
1037	W	21.8	Very low	25.6	Very low	250 Å²	250	145 Å²	145	95%	0.947	78%	0.778	S	S	*	*			trans	-161.1	115.2	130.4	-97.1	13.5	0	0	0	111.4
1038	T	23.7	Very low	25.7	Very low	115 Å²	115	147 Å²	147	71%	0.706	78%	0.78	S	S	*	*			trans	39.4	114.3	132.2	56.1	0	0	0	0	120.5
1039	S	25.8	Very low	25.7	Very low	118 Å²	118	146.3 Å²	146.3	83%	0.825	78%	0.782	S	S	*	*				74.9	140	67.8	-169.4	0	0	0	0	113.3
1040	S	25.7	Very low	25.7	Very low	120 Å²	120	148.1 Å²	148.1	84%	0.839	79%	0.79	S	S	*	*			cis	-127.8	-148.2	18.5	68.9	0	0	0	0	112.4
1041	G	24.5	Very low	25.2	Very low	66 Å²	66	147.7 Å²	147.7	68%	0.68	79%	0.79	S	S	*	*			cis	-173.5	-164.7	13	0	0	0	0	0	113.1
1042	C	26.1	Very low	25.7	Very low	122 Å²	122	150.7 Å²	150.7	82%	0.824	80%	0.798	S	S	*	*			trans	-160.8	151.5	-168.6	172.7	0	0	0	0	114.9
1043	R	27.5	Very low	25.9	Very low	220 Å²	220	148 Å²	148	83%	0.83	80%	0.795	S	S	*	*			trans	-175.5	141.1	143.6	-104.5	163.1	-134	-93.7	6.1	117.8
1044	R	24.6	Very low	26.1	Very low	227 Å²	227	148.5 Å²	148.5	86%	0.857	80%	0.799	S	S	*	*			trans	85.9	154.3	143.7	-77.6	-179.8	173.9	168.5	-0.9	123.1
1045	C	25.8	Very low	26.4	Very low	123 Å²	123	150 Å²	150	83%	0.831	81%	0.807	S	S	*	*			trans	-110.4	-172.9	-173.2	-45	0	0	0	0	110.1
1046	C	27.5	Very low	26.5	Very low	114 Å²	114	151.2 Å²	151.2	77%	0.77	80%	0.804	S	S	*	*			cis	-172.5	147.8	13.8	-161.6	0	0	0	0	112.1
1047	R	24.7	Very low	27.1	Very low	207 Å²	207	149.2 Å²	149.2	78%	0.781	81%	0.805	S	S	*	*			trans	146.6	126.2	131.8	-83.2	-174.6	171.9	-162.8	0.8	118.7
1048	R	26.1	Very low	27.8	Very low	227 Å²	227	143 Å²	143	86%	0.857	80%	0.797	S	S	*	*			trans	70.2	137.4	137.1	-66.6	-175	173.7	-159.6	-2.2	124.2
1049	G	25.4	Very low	28.2	Very low	71 Å²	71	145.4 Å²	145.4	73%	0.732	80%	0.804	S	S	*	*			trans	114.4	108.5	164.5	0	0	0	0	0	113.3
1050	Q	27.9	Very low	28.5	Very low	198 Å²	198	148.1 Å²	148.1	93%	0.925	80%	0.804	S	S	*	*				60.1	133.9	67.2	-63.8	-166.3	19.6	0	0	114.7
1051	S	25.4	Very low	28.9	Very low	111 Å²	111	150.8 Å²	150.8	78%	0.776	80%	0.803	S	S	*	*			cis	-162.4	177.2	-11	61.7	0	0	0	0	112.1
1052	L	34.2	Very low	29.5	Very low	152 Å²	152	153.5 Å²	153.5	80%	0.796	81%	0.808	S	S	*	*			trans	-73.1	143.4	-170.8	-84.1	164.6	0	0	0	116
1053	P	33.4	Very low	29.8	Very low	106 Å²	106	155.9 Å²	155.9	69%	0.688	81%	0.808	S	S	*	*				-134	171.3	110.7	40.3	-31.3	0	0	0	111.6
1054	L	26.3	Very low	30.4	Very low	161 Å²	161	154.4 Å²	154.4	84%	0.843	81%	0.81	S	S	*	*			cis	-147.4	-153.1	-10.5	-149.8	70.2	0	0	0	109.2
1055	Q	32.1	Very low	31.3	Very low	182 Å²	182	147.3 Å²	147.3	85%	0.85	80%	0.8	S	S	*	*			trans	-159.4	142.5	165.4	-122.2	179.3	-6.7	0	0	111.5
1056	T	25	Very low	32.1	Very low	130 Å²	130	150.6 Å²	150.6	80%	0.798	80%	0.8	S	S	*	*			trans	-119.5	153	162.9	37.9	0	0	0	0	109.6
1057	P	36.5	Very low	33.6	Very low	114 Å²	114	151.4 Å²	151.4	74%	0.74	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-75.7	152	-175.4	31.7	-35.5	0	0	0	112.4
1058	P	35	Very low	35.6	Very low	120 Å²	120	147.8 Å²	147.8	78%	0.779	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-70.3	153.5	170.3	31.5	-34.8	0	0	0	111.2
1059	L	31.9	Very low	37.6	Very low	165 Å²	165	141.6 Å²	141.6	86%	0.864	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-65.3	143.3	162.5	-107.4	66	0	0	0	109.6
1060	E	33.7	Very low	40	Very low	175 Å²	175	140 Å²	140	82%	0.818	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-74.8	126.2	162.6	-66.7	-175	121.5	0	0	108.9
1061	E	33.8	Very low	42.1	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-67.5	147.4	163.1	-70.4	-169.5	139.4	0	0	109.7	Q1063	E1061-Q1063 PolarHBondContact O-N 3.34Å
1062	P	36.4	Very low	44.6	Very low	123 Å²	123	133.1 Å²	133.1	80%	0.799	69%	0.691	S	S	*	*			trans	-62.1	115.8	176.8	26.4	-33.9	0	0	0	109.6	Q1064	P1062-Q1064 PolarHBondContact O-N 3.17Å; P1062-Q1064 VanDerWaalsContact O-N 3.17Å
1063	Q	32.5	Very low	46.8	Very low	173 Å²	173	128.7 Å²	128.7	81%	0.808	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-54.8	122.1	179.9	-63.2	178.9	7.6	0	0	109.7	E1061 A1065	E1061-Q1063 PolarHBondContact O-N 3.34Å; Q1063-A1065 PolarHBondContact O-N 3.2Å
1064	Q	40.5	Very low	49.1	Very low	188 Å²	188	123.7 Å²	123.7	88%	0.879	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-56	125.7	167.8	-79.5	-177.9	-27	0	0	108.3	P1062 K1066	P1062-Q1064 PolarHBondContact O-N 3.17Å; P1062-Q1064 VanDerWaalsContact O-N 3.17Å; Q1064-K1066 PolarHBondContact O-N 2.81Å
1065	A	42.7	Very low	51.9	Low	79 Å²	79	121.6 Å²	121.6	65%	0.653	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-55.9	116.5	176.3	0	0	0	0	0	108.6	Q1063 Q1067	Q1063-A1065 PolarHBondContact O-N 3.2Å; A1065-Q1067 PolarHBondContact O-N 3.41Å; A1065-Q1067 VanDerWaalsContact O-N 3.16Å
1066	K	44.2	Very low	54.4	Low	191 Å²	191	116.8 Å²	116.8	83%	0.83	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-61	121.4	179.7	-75.4	-173.1	174.4	-175.2	0	108.5	A893 Q1064	A893-K1066 WeakPolarHBondContact CB-O 3.17Å; Q1064-K1066 PolarHBondContact O-N 2.81Å
1067	Q	58.9	Low	57.4	Low	131 Å²	131	110.7 Å²	110.7	61%	0.612	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-70.1	141.5	170.6	-62.8	169.4	19.5	0	0	107.9	A1065	A1065-Q1067 PolarHBondContact O-N 3.41Å; A1065-Q1067 VanDerWaalsContact O-N 3.16Å
1068	E	65.4	Low	59.9	Low	132 Å²	132	107.4 Å²	107.4	62%	0.617	54%	0.536	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	116.7	-179.7	-155.6	161.9	-159.9	0	0	108.3	L891 V1070	L891-E1068 PolarHBondContact N-O 3.05Å; L891-E1068 VanDerWaalsContact N-O 3.15Å; E1068-V1070 HydrophobicContact CB-CG2 4.14Å; E1068-V1070 HydrophobicContact CG-CG2 3.82Å
1069	E	69.4	Low	62.6	Low	97 Å²	97	108.2 Å²	108.2	45%	0.453	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	110.6	174.7	-59.3	-169.5	118.9	0	0	106.8	R890	R890-E1069 HydrophobicContact CG-CG 4.31Å; R890-E1069 IonicContact CZ-OE1 2.81Å; R890-E1069 IonicContact NE-OE1 2.77Å; R890-E1069 PolarHBondContact NE-OE1 2.8Å; R890-E1069 IonicContact NH2-OE1 3.22Å; R890-E1069 PolarHBondContact NH2-OE1 2.91Å
1070	V	75.8	Confident	65.5	Low	36 Å²	36	102.8 Å²	102.8	22%	0.218	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.5	-168.7	177.2	0	0	0	0	109.3	V889 L891 E1068 S1072	V889-V1070 CarbonylContact C-O 3.56Å; V889-V1070 PolarHBondContact N-O 2.87Å; V889-V1070 PolarHBondContact O-N 3.49Å; L891-V1070 HydrophobicContact CD1-CB 3.79Å; L891-V1070 HydrophobicContact CD1-CG1 3.98Å; L891-V1070 HydrophobicContact CD1-CG2 3.82Å; L891-V1070 HydrophobicContact CG-CB 4.1Å; L891-V1070 HydrophobicContact CG-CG2 4.24Å; E1068-V1070 HydrophobicContact CB-CG2 4.14Å; E1068-V1070 HydrophobicContact CG-CG2 3.82Å; V1070-S1072 PolarHBondContact O-N 3.07Å
1071	W	70.5	Confident	68.3	Low	160 Å²	160	101.9 Å²	101.9	61%	0.606	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	121.2	175.5	-70.5	89.1	0	0	0	109.9	P886 E888	P886-W1071 HydrophobicContact CB-CE3 4.25Å; P886-W1071 HydrophobicContact CB-CZ3 4.45Å; E888-W1071 HydrophobicContact CB-CE3 4.32Å; E888-W1071 HydrophobicContact CB-CH2 4.04Å; E888-W1071 HydrophobicContact CB-CZ2 4.3Å; E888-W1071 HydrophobicContact CB-CZ3 4.05Å
1072	S	78.1	Confident	71.2	Confident	6 Å²	6	96.7 Å²	96.7	4%	0.042	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	110.7	165.7	-170.8	0	0	0	0	108	S624 R887 V889 V1070	S624-S1072 WeakPolarHBondContact CB-OG 3.28Å; S624-S1072 PolarHBondContact OG-OG 2.95Å; R887-S1072 PolarHBondContact N-O 3.42Å; R887-S1072 PolarHBondContact O-N 3.18Å; R887-S1072 VanDerWaalsContact O-O 3.11Å; V889-S1072 VanDerWaalsContact CG2-CB 3.49Å; V1070-S1072 PolarHBondContact O-N 3.07Å
1073	D	80.1	Confident	74	Confident	58 Å²	58	92 Å²	92	31%	0.31	45%	0.446	S	S	.	.			trans	-74.2	165	162.3	71.3	93.6	0	0	0	110.9	S624 S625 E1075 H1076	S624-D1073 WeakPolarHBondContact CB-O 3.41Å; S625-D1073 WeakPolarHBondContact CB-OD2 3.25Å; S625-D1073 PolarHBondContact N-O 2.87Å; S625-D1073 PolarHBondContact OG-N 3.09Å; S625-D1073 PolarHBondContact OG-O 3.09Å; S625-D1073 PolarHBondContact OG-OD2 3.03Å; D1073-E1075 PolarHBondContact OD1-N 3.02Å; D1073-H1076 IonicContact OD1-CE1 3.97Å; D1073-H1076 PolarHBondContact OD1-CE1 3.02Å; D1073-H1076 IonicContact OD1-ND1 2.91Å; D1073-H1076 PolarHBondContact OD1-ND1 3.21Å
1074	S	83.4	Confident	77.1	Confident	2 Å²	2	83.7 Å²	83.7	1%	0.014	41%	0.407	C	S	.	.			trans	-126.9	-0.4	162	55.8	0	0	0	0	111.6	F885 H1076 N1077 F1078	F885-S1074 PolarHBondContact N-OG 3.24Å; F885-S1074 PolarHBondContact O-OG 2.93Å; S1074-H1076 VanDerWaalsContact C-N 3.34Å; S1074-H1076 PolarHBondContact O-N 3.03Å; S1074-N1077 VanDerWaalsContact O-CB 3.25Å; S1074-N1077 WeakPolarHBondContact O-CB 3.43Å; S1074-N1077 PolarHBondContact O-N 2.87Å; S1074-N1077 PolarHBondContact O-ND2 3.41Å; S1074-F1078 WeakPolarHBondContact O-CD2 3.37Å
1075	E	84.3	Confident	79.8	Confident	117 Å²	117	74.8 Å²	74.8	55%	0.547	37%	0.366	S	S	.	.	H	α-helix	trans	-55.3	-44.3	-163	-174.3	172.3	-161.9	0	0	113.2	D1073 N1077 F1078 L1079	D1073-E1075 PolarHBondContact OD1-N 3.02Å; E1075-N1077 PolarHBondContact O-N 3.39Å; E1075-N1077 VanDerWaalsContact O-N 3.1Å; E1075-F1078 PolarHBondContact O-N 3.09Å; E1075-L1079 HydrophobicContact CG-CD1 4.21Å; E1075-L1079 HydrophobicContact CG-CG 4.45Å; E1075-L1079 PolarHBondContact O-N 2.72Å
1076	H	85.2	Confident	82.5	Confident	81 Å²	81	71 Å²	71	38%	0.375	33%	0.334	S	S	.	.	H	α-helix	trans	-57.1	-26.3	177.2	65.9	-88	0	0	0	114.1	D1073 S1074 F1078	D1073-H1076 IonicContact OD1-CE1 3.97Å; D1073-H1076 PolarHBondContact OD1-CE1 3.02Å; D1073-H1076 IonicContact OD1-ND1 2.91Å; D1073-H1076 PolarHBondContact OD1-ND1 3.21Å; S1074-H1076 VanDerWaalsContact C-N 3.34Å; S1074-H1076 PolarHBondContact O-N 3.03Å; H1076-F1078 VanDerWaalsContact C-N 3.34Å
1077	N	86.6	Confident	85	Confident	2 Å²	2	62 Å²	62	1%	0.011	30%	0.295	C	S	.	.	H	α-helix	trans	-74.3	-25	176.2	-61.6	-99.3	0	0	0	112.9	G622 K623 I630 K632 S1074 E1075 I1083	G622-N1077 WeakPolarHBondContact CA-OD1 3.31Å; K623-N1077 PolarHBondContact N-OD1 2.86Å; K623-N1077 PolarHBondContact O-ND2 3.09Å; K623-N1077 PolarHBondContact O-OD1 2.89Å; I630-N1077 HydrophobicContact CD1-CB 3.52Å; I630-N1077 WeakPolarHBondContact CD1-OD1 3.46Å; K632-N1077 WeakPolarHBondContact CD-O 3.18Å; K632-N1077 WeakPolarHBondContact CE-O 3.5Å; K632-N1077 PolarHBondContact NZ-O 3.33Å; S1074-N1077 VanDerWaalsContact O-CB 3.25Å; S1074-N1077 WeakPolarHBondContact O-CB 3.43Å; S1074-N1077 PolarHBondContact O-N 2.87Å; S1074-N1077 PolarHBondContact O-ND2 3.41Å; E1075-N1077 PolarHBondContact O-N 3.39Å; E1075-N1077 VanDerWaalsContact O-N 3.1Å; N1077-I1083 HydrophobicContact CB-CG2 3.84Å; N1077-I1083 WeakPolarHBondContact OD1-CG2 3.44Å
1078	F	89.6	Confident	86.9	Confident	45 Å²	45	55.8 Å²	55.8	20%	0.197	27%	0.267	C	S	.	.	H	α-helix	trans	-96.5	-14.4	-179.3	-66	-95.3	0	0	0	112.4	K632 L882 S1074 E1075 H1076	K632-F1078 HydrophobicContact CB-CE1 4.15Å; K632-F1078 HydrophobicContact CG-CD1 4.22Å; K632-F1078 HydrophobicContact CG-CE1 3.79Å; K632-F1078 HydrophobicContact CG-CE2 4.4Å; K632-F1078 HydrophobicContact CG-CZ 3.9Å; L882-F1078 HydrophobicContact CB-CE1 4.12Å; L882-F1078 HydrophobicContact CB-CZ 4.42Å; L882-F1078 VanDerWaalsContact O-CE1 3.23Å; L882-F1078 WeakPolarHBondContact O-CE1 3.3Å; S1074-F1078 WeakPolarHBondContact O-CD2 3.37Å; E1075-F1078 PolarHBondContact O-N 3.09Å; H1076-F1078 VanDerWaalsContact C-N 3.34Å
1079	L	91.1	Very high	88.5	Confident	136 Å²	136	50.1 Å²	50.1	71%	0.712	24%	0.242	S	C	*	.	H	α-helix	trans	-81.1	-25.1	171.5	-64.9	175.2	0	0	0	113.3	E1075	E1075-L1079 HydrophobicContact CG-CD1 4.21Å; E1075-L1079 HydrophobicContact CG-CG 4.45Å; E1075-L1079 PolarHBondContact O-N 2.72Å
1080	D	92.9	Very high	89.8	Confident	52 Å²	52	45.8 Å²	45.8	28%	0.278	22%	0.222	S	C	.	.	S	Bend	trans	-103.4	112.5	173.3	-175	-27.3	0	0	0	109.5	K620 K632 D1082 I1083	K620-D1080 IonicContact NZ-OD1 3.43Å; K620-D1080 PolarHBondContact NZ-OD1 2.95Å; K620-D1080 IonicContact NZ-OD2 2.92Å; K620-D1080 PolarHBondContact NZ-OD2 3.22Å; K632-D1080 PolarHBondContact NZ-O 3.08Å; D1080-D1082 VanDerWaalsContact C-N 3.26Å; D1080-D1082 PolarHBondContact O-N 3.22Å; D1080-D1082 WeakPolarHBondContact OD1-CB 3.47Å; D1080-D1082 PolarHBondContact OD1-N 3.36Å; D1080-I1083 HydrophobicContact CB-CB 4.33Å; D1080-I1083 HydrophobicContact CB-CD1 3.77Å; D1080-I1083 HydrophobicContact CB-CG1 3.81Å; D1080-I1083 PolarHBondContact O-N 3.17Å; D1080-I1083 PolarHBondContact OD1-N 3.4Å
1081	E	92.6	Very high	90.9	Very high	156 Å²	156	45.3 Å²	45.3	73%	0.729	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.8	-178.3	-64.8	-173	162.9	0	0	113.1	K857	K857-E1081 WeakPolarHBondContact CD-O 3.44Å
1082	D	94.8	Very high	92.2	Very high	66 Å²	66	38.7 Å²	38.7	35%	0.353	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.4	178.7	-64.2	-39.2	0	0	0	113.4	T618 K620 K857 D1080 G1084	T618-D1082 WeakPolarHBondContact CB-O 3.31Å; T618-D1082 HydrophobicContact CG2-CB 4.34Å; T618-D1082 VanDerWaalsContact CG2-O 3.3Å; T618-D1082 WeakPolarHBondContact CG2-O 3.21Å; T618-D1082 PolarHBondContact OG1-O 3.24Å; K620-D1082 HydrophobicContact CD-CB 3.73Å; K620-D1082 IonicContact NZ-OD2 3.82Å; K857-D1082 IonicContact NZ-OD1 2.89Å; K857-D1082 PolarHBondContact NZ-OD1 3.36Å; D1080-D1082 VanDerWaalsContact C-N 3.26Å; D1080-D1082 PolarHBondContact O-N 3.22Å; D1080-D1082 WeakPolarHBondContact OD1-CB 3.47Å; D1080-D1082 PolarHBondContact OD1-N 3.36Å; D1082-G1084 PolarHBondContact O-N 3.43Å
1083	I	95.9	Very high	93.1	Very high	23 Å²	23	38.5 Å²	38.5	12%	0.118	20%	0.196	C	C	.	.	S	Bend	trans	-61.4	124.4	170.4	-74.9	178.9	0	0	0	108.3	K620 K632 N1077 D1080	K620-I1083 HydrophobicContact CB-CG1 4.08Å; K620-I1083 HydrophobicContact CD-CG1 4.03Å; K632-I1083 HydrophobicContact CD-CG2 4.35Å; K632-I1083 VanDerWaalsContact CD-O 3.26Å; K632-I1083 WeakPolarHBondContact CD-O 3.49Å; K632-I1083 WeakPolarHBondContact CE-O 3.4Å; K632-I1083 PolarHBondContact NZ-O 2.79Å; N1077-I1083 HydrophobicContact CB-CG2 3.84Å; N1077-I1083 WeakPolarHBondContact OD1-CG2 3.44Å; D1080-I1083 HydrophobicContact CB-CB 4.33Å; D1080-I1083 HydrophobicContact CB-CD1 3.77Å; D1080-I1083 HydrophobicContact CB-CG1 3.81Å; D1080-I1083 PolarHBondContact O-N 3.17Å; D1080-I1083 PolarHBondContact OD1-N 3.4Å
1084	G	96.7	Very high	94	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.			trans	-73.8	-179.8	-176.2	0	0	0	0	0	113.6	K620 G622 K632 P854 Y856 D1082	K620-G1084 PolarHBondContact O-N 3.37Å; G622-G1084 VanDerWaalsContact CA-O 3.22Å; G622-G1084 WeakPolarHBondContact CA-O 3.47Å; K632-G1084 WeakPolarHBondContact CD-O 3.18Å; P854-G1084 CarbonylContact O-C 3.58Å; P854-G1084 VanDerWaalsContact O-CA 3.27Å; P854-G1084 WeakPolarHBondContact O-CA 3.39Å; Y856-G1084 CarbonylContact O-C 3.57Å; Y856-G1084 WeakPolarHBondContact O-CA 3.36Å; D1082-G1084 PolarHBondContact O-N 3.43Å
1085	G	97.4	Very high	94.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.			trans	147.5	32.8	-177.6	0	0	0	0	0	113.9	K632 W633 Y856 A1087	K632-G1085 PolarHBondContact N-O 2.91Å; W633-G1085 PolarHBondContact N-O 3.39Å; Y856-G1085 PolarHBondContact O-N 3.46Å; G1085-A1087 PolarHBondContact O-N 3.14Å
1086	V	98.6	Very high	95.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	126.5	169.4	171.5	0	0	0	0	108.9	V615 W633 I635 L647 V852 L853 Y856 K857 I858	V615-V1086 HydrophobicContact CG1-CG1 4.17Å; V615-V1086 HydrophobicContact CG1-CG2 4.16Å; W633-V1086 HydrophobicContact CE3-CG2 4.22Å; I635-V1086 HydrophobicContact CD1-CG1 3.97Å; L647-V1086 HydrophobicContact CD1-CG1 4.44Å; V852-V1086 CarbonylContact C-O 3.57Å; V852-V1086 WeakPolarHBondContact CA-O 3.32Å; V852-V1086 WeakPolarHBondContact CG1-O 3.31Å; L853-V1086 PolarHBondContact N-O 3.08Å; Y856-V1086 WeakPolarHBondContact O-CG2 3.01Å; Y856-V1086 PolarHBondContact O-N 2.87Å; K857-V1086 VanDerWaalsContact C-CG2 3.47Å; I858-V1086 HydrophobicContact CD1-CB 4.49Å; I858-V1086 HydrophobicContact CD1-CG1 4.03Å; I858-V1086 HydrophobicContact CD1-CG2 3.69Å; I858-V1086 HydrophobicContact CG1-CG2 3.88Å
1087	A	98.6	Very high	96.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.008	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.4	174	0	0	0	0	0	111.6	A631 W633 V634 I635 L850 H851 V852 G1085	A631-A1087 HydrophobicContact CB-CB 3.69Å; W633-A1087 WeakPolarHBondContact O-CA 3.41Å; W633-A1087 WeakPolarHBondContact O-CB 3.46Å; W633-A1087 PolarHBondContact O-N 3.28Å; V634-A1087 WeakPolarHBondContact CA-O 3.3Å; I635-A1087 PolarHBondContact N-O 3.4Å; L850-A1087 HydrophobicContact CB-CB 4.09Å; L850-A1087 HydrophobicContact CD1-CB 4.15Å; H851-A1087 CarbonylContact O-C 3.35Å; H851-A1087 WeakPolarHBondContact O-CA 3.41Å; H851-A1087 WeakPolarHBondContact O-CB 3.38Å; V852-A1087 HydrophobicContact CB-CB 4.41Å; V852-A1087 HydrophobicContact CG1-CB 4.41Å; V852-A1087 HydrophobicContact CG2-CB 3.94Å; G1085-A1087 PolarHBondContact O-N 3.14Å
1088	V	98.6	Very high	96.7	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.012	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	151.8	164.1	-63.5	0	0	0	0	108.9	I635 L645 L647 L666 H851 P1090 L1096	I635-V1088 HydrophobicContact CB-CG1 4.25Å; I635-V1088 HydrophobicContact CD1-CG1 4.45Å; L645-V1088 HydrophobicContact CD2-CG1 3.91Å; L647-V1088 HydrophobicContact CD1-CG1 4.21Å; L666-V1088 HydrophobicContact CD2-CB 4.27Å; L666-V1088 HydrophobicContact CD2-CG2 4.48Å; H851-V1088 HydrophobicContact CB-CG2 3.92Å; H851-V1088 PolarHBondContact N-O 2.81Å; H851-V1088 PolarHBondContact O-N 2.67Å; V1088-P1090 HydrophobicContact CG2-CG 4.08Å; V1088-P1090 WeakPolarHBondContact O-CD 3.47Å; V1088-L1096 HydrophobicContact CG2-CD1 3.91Å
1089	A	98.2	Very high	97.1	Very high	13 Å²	13	24.3 Å²	24.3	11%	0.107	13%	0.128	C	C	.	.			trans	-108.3	88.3	171.2	0	0	0	0	0	109.8	V634 I635 R636 W668 L850 S1091	V634-A1089 HydrophobicContact CG1-CB 3.97Å; I635-A1089 PolarHBondContact O-N 3.23Å; I635-A1089 VanDerWaalsContact O-N 3.1Å; R636-A1089 HydrophobicContact CG-CB 4.27Å; W668-A1089 VanDerWaalsContact CZ3-O 3.29Å; W668-A1089 WeakPolarHBondContact CZ3-O 3.43Å; L850-A1089 HydrophobicContact CD2-CB 3.63Å; A1089-S1091 PolarHBondContact O-N 3.39Å
1090	P	97.7	Very high	97.5	Very high	5 Å²	5	17.9 Å²	17.9	3%	0.032	10%	0.095	C	C	.	.	P	Polyproline II helix	trans	-71.9	128.1	-173.8	-13.5	29.7	0	0	0	111.2	L666 T832 H851 V1088 S1094 L1096	L666-P1090 HydrophobicContact CD1-CB 4.27Å; T832-P1090 HydrophobicContact CG2-CB 4.12Å; T832-P1090 WeakPolarHBondContact CG2-O 3.18Å; H851-P1090 HydrophobicContact CB-CG 4.32Å; V1088-P1090 HydrophobicContact CG2-CG 4.08Å; V1088-P1090 WeakPolarHBondContact O-CD 3.47Å; P1090-S1094 VanDerWaalsContact CB-OG 3.3Å; P1090-S1094 WeakPolarHBondContact CB-OG 3.48Å; P1090-L1096 HydrophobicContact CG-CD1 4.3Å
1091	S	97	Very high	97.7	Very high	27 Å²	27	18.1 Å²	18.1	19%	0.189	9%	0.092	C	C	.	.	P	Polyproline II helix	trans	-75.5	170.5	-178.5	60.7	0	0	0	0	113.3	W668 A1089 G1093 S1094	W668-S1091 PolarHBondContact O-OG 3.03Å; A1089-S1091 PolarHBondContact O-N 3.39Å; S1091-G1093 PolarHBondContact O-N 3.32Å; S1091-S1094 PolarHBondContact N-OG 3.44Å; S1091-S1094 VanDerWaalsContact N-OG 3.09Å; S1091-S1094 VanDerWaalsContact O-CB 3.3Å; S1091-S1094 WeakPolarHBondContact O-CB 3.28Å; S1091-S1094 PolarHBondContact O-N 2.86Å; S1091-S1094 VanDerWaalsContact O-N 3.12Å; S1091-S1094 PolarHBondContact O-OG 3.18Å
1092	H	98.3	Very high	97.9	Very high	20 Å²	20	14.2 Å²	14.2	9%	0.093	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	129.1	167.8	-154.7	86.8	0	0	0	111.7	A676 D677 T834 R839 S1094	A676-H1092 VanDerWaalsContact C-NE2 3.25Å; A676-H1092 VanDerWaalsContact CB-CD2 3.41Å; A676-H1092 WeakPolarHBondContact CB-CD2 3.33Å; A676-H1092 WeakPolarHBondContact CB-NE2 2.94Å; D677-H1092 PolarHBondContact N-NE2 3.12Å; D677-H1092 IonicContact OD1-CE1 3.41Å; D677-H1092 IonicContact OD1-NE2 2.67Å; T834-H1092 PolarHBondContact N-ND1 2.86Å; T834-H1092 PolarHBondContact O-CE1 3.49Å; T834-H1092 VanDerWaalsContact O-CE1 3.29Å; T834-H1092 PolarHBondContact O-ND1 3.44Å; T834-H1092 VanDerWaalsContact OG1-CB 3.26Å; T834-H1092 WeakPolarHBondContact OG1-CB 3.48Å; T834-H1092 PolarHBondContact OG1-ND1 3.15Å; R839-H1092 HydrophobicContact CB-CB 4.36Å; R839-H1092 HydrophobicContact CG-CB 4.01Å; R839-H1092 PolarHBondContact NE-CE1 2.91Å; R839-H1092 PolarHBondContact NE-ND1 3.05Å; R839-H1092 VanDerWaalsContact NE-ND1 3.16Å; H1092-S1094 PolarHBondContact O-N 3.37Å
1093	G	98.3	Very high	98.1	Very high	2 Å²	2	11.1 Å²	11.1	2%	0.021	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	7.3	179.8	0	0	0	0	0	115.2	G670 I671 T832 S1091	G670-G1093 PolarHBondContact N-O 2.85Å; G670-G1093 VanDerWaalsContact N-O 3.14Å; I671-G1093 PolarHBondContact N-O 3.28Å; T832-G1093 PolarHBondContact O-N 3.14Å; S1091-G1093 PolarHBondContact O-N 3.32Å
1094	S	98.7	Very high	98.2	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	147.1	177.4	67.2	0	0	0	0	112.7	A667 T832 P1090 S1091 H1092	A667-S1094 CarbonylContact O-C 3.57Å; A667-S1094 VanDerWaalsContact O-CA 3.23Å; A667-S1094 WeakPolarHBondContact O-CA 3.45Å; A667-S1094 WeakPolarHBondContact O-CB 3.27Å; T832-S1094 PolarHBondContact N-O 2.86Å; P1090-S1094 VanDerWaalsContact CB-OG 3.3Å; P1090-S1094 WeakPolarHBondContact CB-OG 3.48Å; S1091-S1094 PolarHBondContact N-OG 3.44Å; S1091-S1094 VanDerWaalsContact N-OG 3.09Å; S1091-S1094 VanDerWaalsContact O-CB 3.3Å; S1091-S1094 WeakPolarHBondContact O-CB 3.28Å; S1091-S1094 PolarHBondContact O-N 2.86Å; S1091-S1094 VanDerWaalsContact O-N 3.12Å; S1091-S1094 PolarHBondContact O-OG 3.18Å; H1092-S1094 PolarHBondContact O-N 3.37Å
1095	I	98.9	Very high	98.3	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.01	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	115.2	-177.5	-57.4	-56	0	0	0	109.7	L666 A667 I671 L768 L771 V829 V830 C831 I1097	L666-I1095 WeakPolarHBondContact CA-O 3.22Å; A667-I1095 PolarHBondContact N-O 2.89Å; A667-I1095 PolarHBondContact O-N 2.8Å; I671-I1095 HydrophobicContact CG2-CD1 4.22Å; L768-I1095 HydrophobicContact CD2-CD1 3.33Å; L768-I1095 HydrophobicContact CD2-CG1 3.75Å; L768-I1095 HydrophobicContact CD2-CG2 4.4Å; L771-I1095 HydrophobicContact CD2-CB 4.13Å; L771-I1095 HydrophobicContact CD2-CG1 4.03Å; L771-I1095 HydrophobicContact CD2-CG2 4.3Å; V829-I1095 HydrophobicContact CG1-CG2 3.58Å; V830-I1095 WeakPolarHBondContact O-CA 3.4Å; C831-I1095 HydrophobicContact CB-CD1 3.42Å; C831-I1095 VanDerWaalsContact CB-CD1 3.42Å; I1095-I1097 HydrophobicContact CG2-CG1 4.41Å
1096	L	98.9	Very high	98.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.9	177.2	-173	159.4	0	0	0	109.7	L664 I665 L666 V829 V830 H851 V1088 P1090 E1098	L664-L1096 HydrophobicContact CD1-CD1 4.1Å; L664-L1096 HydrophobicContact CD1-CD2 4.03Å; L664-L1096 HydrophobicContact CD1-CG 4.12Å; L664-L1096 HydrophobicContact CD2-CG 4.16Å; L664-L1096 HydrophobicContact CG-CD2 4.12Å; L664-L1096 HydrophobicContact CG-CG 4.1Å; I665-L1096 CarbonylContact O-C 3.58Å; I665-L1096 WeakPolarHBondContact O-CA 3.45Å; L666-L1096 HydrophobicContact CD1-CB 3.99Å; V829-L1096 CarbonylContact C-O 3.41Å; V829-L1096 WeakPolarHBondContact CA-O 3.39Å; V830-L1096 HydrophobicContact CB-CB 4.25Å; V830-L1096 PolarHBondContact N-O 2.9Å; V830-L1096 PolarHBondContact O-N 3.41Å; H851-L1096 HydrophobicContact CB-CD1 4.21Å; V1088-L1096 HydrophobicContact CG2-CD1 3.91Å; P1090-L1096 HydrophobicContact CG-CD1 4.3Å; L1096-E1098 HydrophobicContact CD2-CB 3.95Å; L1096-E1098 HydrophobicContact CD2-CG 3.73Å
1097	I	98.9	Very high	98.3	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.3	178.6	-48.4	174.6	0	0	0	108.5	L586 L664 I665 Y772 L775 A776 S827 T828 V829 I1095	L586-I1097 HydrophobicContact CD2-CG2 3.92Å; L664-I1097 CarbonylContact C-O 3.44Å; L664-I1097 WeakPolarHBondContact CA-O 3.25Å; I665-I1097 HydrophobicContact CB-CB 4.31Å; I665-I1097 PolarHBondContact N-O 3.46Å; I665-I1097 PolarHBondContact O-N 3.47Å; Y772-I1097 HydrophobicContact CD2-CD1 4.14Å; Y772-I1097 HydrophobicContact CD2-CG2 4.14Å; Y772-I1097 HydrophobicContact CE2-CG2 3.94Å; L775-I1097 HydrophobicContact CB-CD1 3.78Å; L775-I1097 HydrophobicContact CD1-CD1 3.91Å; A776-I1097 HydrophobicContact CB-CG2 4.32Å; S827-I1097 WeakPolarHBondContact OG-CG2 3.27Å; T828-I1097 WeakPolarHBondContact O-CA 3.43Å; V829-I1097 HydrophobicContact CG2-CG1 4.35Å; V829-I1097 HydrophobicContact CG2-CG2 4.36Å; I1095-I1097 HydrophobicContact CG2-CG1 4.41Å
1098	E	98.8	Very high	98.3	Very high	2 Å²	2	13 Å²	13	1%	0.009	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156.8	-177.9	66.8	176	-176.5	0	0	112.6	L664 S827 T828 H851 L1096 A1100 H1105	L664-E1098 HydrophobicContact CB-CB 4.5Å; L664-E1098 HydrophobicContact CD1-CB 4.5Å; L664-E1098 HydrophobicContact CG-CB 4.38Å; S827-E1098 VanDerWaalsContact CB-O 3.32Å; S827-E1098 WeakPolarHBondContact CB-O 3.33Å; T828-E1098 PolarHBondContact N-O 3.44Å; T828-E1098 PolarHBondContact O-N 3.27Å; T828-E1098 VanDerWaalsContact O-N 3.09Å; H851-E1098 IonicContact CD2-OE2 3.72Å; H851-E1098 IonicContact CE1-OE1 2.6Å; H851-E1098 PolarHBondContact CE1-OE1 2.8Å; H851-E1098 IonicContact CE1-OE2 3.38Å; H851-E1098 VanDerWaalsContact NE2-CD 3.25Å; H851-E1098 IonicContact NE2-OE1 3.67Å; H851-E1098 PolarHBondContact NE2-OE1 3.14Å; H851-E1098 IonicContact NE2-OE2 3.93Å; H851-E1098 PolarHBondContact NE2-OE2 3.44Å; L1096-E1098 HydrophobicContact CD2-CB 3.95Å; L1096-E1098 HydrophobicContact CD2-CG 3.73Å; E1098-A1100 HydrophobicContact CG-CB 4.2Å; E1098-A1100 PolarHBondContact O-N 3.4Å; E1098-H1105 IonicContact OE1-CD2 3.52Å; E1098-H1105 PolarHBondContact OE1-CD2 3.41Å; E1098-H1105 IonicContact OE1-CG 3.99Å
1099	C	98.6	Very high	98.1	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.014	7%	0.072	C	C	.	.			trans	-83.6	66.6	172	-162.9	0	0	0	0	111.1	Y583 H585 R1101 R1102 E1103	Y583-C1099 HydrophobicContact CD1-CB 4.41Å; Y583-C1099 HydrophobicContact CD2-CB 4.12Å; Y583-C1099 HydrophobicContact CE1-CB 3.88Å; Y583-C1099 HydrophobicContact CE2-CB 3.57Å; Y583-C1099 HydrophobicContact CG-CB 4.5Å; Y583-C1099 VanDerWaalsContact CZ-CB 3.42Å; H585-C1099 PolarHBondContact CE1-SG 2.66Å; H585-C1099 PolarHBondContact NE2-SG 2.91Å; C1099-R1101 PolarHBondContact O-N 3.33Å; C1099-R1102 HydrophobicContact CB-CB 4.45Å; C1099-R1102 PolarHBondContact O-N 3.08Å; C1099-E1103 PolarHBondContact O-N 2.7Å
1100	A	98.3	Very high	97.9	Very high	1 Å²	1	14 Å²	14	1%	0.008	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-15.5	-179.9	0	0	0	0	0	114.8	K818 D819 T828 E1098 H1105	K818-A1100 CarbonylContact C-O 3.25Å; K818-A1100 WeakPolarHBondContact CA-O 3.18Å; D819-A1100 PolarHBondContact N-O 2.75Å; T828-A1100 HydrophobicContact CG2-CB 4.42Å; E1098-A1100 HydrophobicContact CG-CB 4.2Å; E1098-A1100 PolarHBondContact O-N 3.4Å; A1100-H1105 PolarHBondContact O-CE1 2.77Å
1101	R	97.9	Very high	97.5	Very high	57 Å²	57	18.7 Å²	18.7	22%	0.215	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-36	171.3	179.9	172.3	178	62.8	7.3	113.5	T820 N822 M823 N824 C1099	T820-R1101 VanDerWaalsContact C-NH1 3.3Å; T820-R1101 PolarHBondContact O-NH1 2.99Å; N822-R1101 HydrophobicContact CB-CB 4.32Å; N822-R1101 WeakPolarHBondContact O-CD 3.1Å; N822-R1101 VanDerWaalsContact O-CZ 3.25Å; N822-R1101 PolarHBondContact O-NE 3.44Å; N822-R1101 PolarHBondContact O-NH1 2.9Å; M823-R1101 WeakPolarHBondContact O-CD 3.5Å; N824-R1101 VanDerWaalsContact OD1-CZ 3.23Å; N824-R1101 PolarHBondContact OD1-NE 3.19Å; N824-R1101 PolarHBondContact OD1-NH2 2.97Å; C1099-R1101 PolarHBondContact O-N 3.33Å
1102	R	97.6	Very high	97.3	Very high	75 Å²	75	25.5 Å²	25.5	28%	0.283	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-36.2	-176.7	-63.9	-62	-81.5	-116.1	17.5	112.2	E576 P581 Y583 K818 C1099	E576-R1102 IonicContact OE1-CZ 3.1Å; E576-R1102 IonicContact OE1-NE 3.58Å; E576-R1102 IonicContact OE1-NH2 2.76Å; E576-R1102 PolarHBondContact OE1-NH2 3.4Å; E576-R1102 IonicContact OE2-NH2 3.38Å; E576-R1102 PolarHBondContact OE2-NH2 3.47Å; P581-R1102 HydrophobicContact CB-CB 4.04Å; P581-R1102 HydrophobicContact CG-CB 4.49Å; Y583-R1102 HydrophobicContact CD1-CB 3.88Å; Y583-R1102 HydrophobicContact CD1-CG 4.03Å; Y583-R1102 HydrophobicContact CE1-CB 3.86Å; Y583-R1102 HydrophobicContact CE1-CG 4.48Å; K818-R1102 WeakPolarHBondContact CD-O 3.25Å; K818-R1102 VanDerWaalsContact CE-O 3.28Å; K818-R1102 WeakPolarHBondContact CE-O 3.12Å; K818-R1102 PolarHBondContact NZ-O 3.09Å; C1099-R1102 HydrophobicContact CB-CB 4.45Å; C1099-R1102 PolarHBondContact O-N 3.08Å
1103	E	97.9	Very high	97.1	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.005	12%	0.12	C	C	.	.	S	Bend	trans	-84.2	139.5	179.3	-64.9	-59.5	167.7	0	0	113.1	P581 Y583 K818 Y856 C1099 H1105	P581-E1103 VanDerWaalsContact CG-OE1 3.23Å; P581-E1103 WeakPolarHBondContact CG-OE1 3.5Å; Y583-E1103 HydrophobicContact CE1-CG 4.25Å; Y583-E1103 VanDerWaalsContact OH-CG 3.27Å; Y583-E1103 WeakPolarHBondContact OH-CG 3.47Å; Y583-E1103 PolarHBondContact OH-OE1 2.87Å; K818-E1103 WeakPolarHBondContact CG-O 3.44Å; Y856-E1103 VanDerWaalsContact CE2-OE2 3.25Å; Y856-E1103 WeakPolarHBondContact CE2-OE2 3.32Å; Y856-E1103 PolarHBondContact OH-OE1 3.46Å; Y856-E1103 PolarHBondContact OH-OE2 2.84Å; C1099-E1103 PolarHBondContact O-N 2.7Å; E1103-H1105 PolarHBondContact O-ND1 3.43Å; E1103-H1105 VanDerWaalsContact O-ND1 3.17Å
1104	L	98.3	Very high	97	Very high	24 Å²	24	27.6 Å²	27.6	13%	0.126	13%	0.132	C	C	.	.			trans	-80.1	120.2	169.3	-169	76.3	0	0	0	107.7	E621 A816 H817 K818 P854 L855	E621-L1104 HydrophobicContact CG-CD2 4.14Å; A816-L1104 HydrophobicContact CB-CD1 4.27Å; A816-L1104 HydrophobicContact CB-CD2 4.07Å; A816-L1104 HydrophobicContact CB-CG 4.12Å; H817-L1104 WeakPolarHBondContact O-CA 3.26Å; K818-L1104 HydrophobicContact CG-CD1 4.02Å; P854-L1104 WeakPolarHBondContact CD-O 3.18Å; L855-L1104 HydrophobicContact CD1-CB 3.62Å; L855-L1104 HydrophobicContact CD1-CD2 3.91Å; L855-L1104 HydrophobicContact CD1-CG 4.4Å; L855-L1104 HydrophobicContact CD2-CD2 3.86Å; L855-L1104 HydrophobicContact CG-CB 3.98Å; L855-L1104 HydrophobicContact CG-CD2 3.71Å; L855-L1104 HydrophobicContact CG-CG 4.48Å
1105	H	98.8	Very high	96.7	Very high	12 Å²	12	29 Å²	29	6%	0.056	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-138.2	154.6	-175.1	64.4	-73.7	0	0	0	111.5	A816 H817 V852 L853 E1098 A1100 E1103	A816-H1105 WeakPolarHBondContact CA-O 3.14Å; H817-H1105 AromaticContact CE1-CD2 3.7Å; H817-H1105 AromaticContact CE1-CE1 3.88Å; H817-H1105 AromaticContact CE1-NE2 3.15Å; H817-H1105 PolarHBondContact CE1-NE2 3.08Å; H817-H1105 PolarHBondContact N-O 3.48Å; H817-H1105 AromaticContact ND1-CD2 3.96Å; H817-H1105 AromaticContact ND1-CE1 3.89Å; H817-H1105 AromaticContact ND1-NE2 3.55Å; H817-H1105 PolarHBondContact ND1-O 2.91Å; H817-H1105 AromaticContact NE2-NE2 3.8Å; H817-H1105 PolarHBondContact O-CE1 3.13Å; H817-H1105 PolarHBondContact O-N 3.25Å; H817-H1105 PolarHBondContact O-ND1 3.41Å; H817-H1105 VanDerWaalsContact O-ND1 3.11Å; V852-H1105 CarbonylContact O-C 3.56Å; V852-H1105 VanDerWaalsContact O-CA 3.24Å; V852-H1105 WeakPolarHBondContact O-CA 3.41Å; L853-H1105 HydrophobicContact CD2-CB 4.01Å; E1098-H1105 IonicContact OE1-CD2 3.52Å; E1098-H1105 PolarHBondContact OE1-CD2 3.41Å; E1098-H1105 IonicContact OE1-CG 3.99Å; A1100-H1105 PolarHBondContact O-CE1 2.77Å; E1103-H1105 PolarHBondContact O-ND1 3.43Å; E1103-H1105 VanDerWaalsContact O-ND1 3.17Å
1106	A	98.7	Very high	96.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	166.7	-175.9	0	0	0	0	0	111.6	P629 A814 A816 V852 P854	P629-A1106 HydrophobicContact CB-CB 3.92Å; P629-A1106 HydrophobicContact CG-CB 3.88Å; A814-A1106 CarbonylContact O-C 2.85Å; A814-A1106 WeakPolarHBondContact O-CA 3.08Å; A814-A1106 VanDerWaalsContact O-CB 3.27Å; A814-A1106 WeakPolarHBondContact O-CB 3.31Å; A816-A1106 HydrophobicContact CB-CB 4.47Å; V852-A1106 HydrophobicContact CB-CB 4.36Å; V852-A1106 PolarHBondContact N-O 2.91Å; V852-A1106 PolarHBondContact O-N 2.74Å; P854-A1106 HydrophobicContact CG-CB 4.12Å
1107	T	98.6	Very high	96.4	Very high	10 Å²	10	38.5 Å²	38.5	6%	0.061	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.2	164.1	61.7	0	0	0	0	110.7	F812 C813 A814 Q849 L850	F812-T1107 PolarHBondContact O-OG1 3.16Å; C813-T1107 PolarHBondContact SG-O 2.93Å; A814-T1107 HydrophobicContact CB-CG2 4.45Å; A814-T1107 WeakPolarHBondContact CB-OG1 3.45Å; A814-T1107 PolarHBondContact N-OG1 3Å; A814-T1107 PolarHBondContact O-N 3.08Å; Q849-T1107 PolarHBondContact NE2-OG1 3.38Å; L850-T1107 VanDerWaalsContact O-CA 3.23Å; L850-T1107 WeakPolarHBondContact O-CA 3.47Å; L850-T1107 WeakPolarHBondContact O-CB 3.45Å
1108	T	96.9	Very high	96.3	Very high	16 Å²	16	38.5 Å²	38.5	10%	0.098	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-70.7	150.6	-176.8	53.3	0	0	0	0	112.7	Q849 L850 V852	Q849-T1108 PolarHBondContact NE2-O 2.98Å; L850-T1108 HydrophobicContact CB-CG2 4.03Å; L850-T1108 HydrophobicContact CD1-CG2 4.45Å; L850-T1108 HydrophobicContact CG-CG2 4.47Å; L850-T1108 PolarHBondContact N-OG1 3.32Å; L850-T1108 PolarHBondContact O-N 3.44Å; L850-T1108 VanDerWaalsContact O-N 3.11Å; V852-T1108 HydrophobicContact CG2-CG2 3.91Å
1109	P	95.1	Very high	96.3	Very high	28 Å²	28	39.2 Å²	39.2	18%	0.182	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-71.4	129.4	169.8	28.6	-32.7	0	0	0	111.4	C708 C813	C708-P1109 HydrophobicContact CB-CB 4.11Å; C813-P1109 HydrophobicContact CB-CB 4.17Å
1110	I	93.8	Very high	96.3	Very high	9 Å²	9	39.3 Å²	39.3	5%	0.046	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-68.2	143.8	166.7	-69	-57.9	0	0	0	109.2	D847 E848 Q849 P1113 T1119	D847-I1110 WeakPolarHBondContact OD2-CG2 3.25Å; E848-I1110 VanDerWaalsContact C-CD1 3.48Å; Q849-I1110 HydrophobicContact CB-CD1 3.67Å; Q849-I1110 HydrophobicContact CB-CG1 4.13Å; I1110-P1113 HydrophobicContact CB-CG 4.13Å; I1110-P1113 HydrophobicContact CG2-CG 4.2Å; I1110-P1113 WeakPolarHBondContact O-CD 3.34Å; I1110-T1119 HydrophobicContact CD1-CG2 3.66Å
1111	L	90.2	Very high	96.3	Very high	103 Å²	103	39.2 Å²	39.2	54%	0.539	18%	0.18	S	C	.	.	S	Bend	trans	-69.3	-35.9	-178.7	-61.2	170.6	0	0	0	112.2	D847	D847-L1111 HydrophobicContact CB-CD1 4.45Å; D847-L1111 WeakPolarHBondContact OD2-CA 3.37Å; D847-L1111 VanDerWaalsContact OD2-CB 3.23Å; D847-L1111 WeakPolarHBondContact OD2-CB 3.38Å; D847-L1111 PolarHBondContact OD2-N 3.17Å
1112	K	91.6	Very high	96.3	Very high	171 Å²	171	36.8 Å²	36.8	74%	0.743	17%	0.171	S	C	*	.	S	Bend	trans	-134.3	71.3	179.4	-63	172.1	-170.9	159.8	0	111.7	N1114	K1112-N1114 PolarHBondContact O-N 3.48Å
1113	P	94.7	Very high	96.4	Very high	15 Å²	15	33.2 Å²	33.2	10%	0.097	16%	0.158	C	C	.	.			trans	-55.9	126.4	-176.1	-25.4	35	0	0	0	112.4	Q709 T715 D811 I1110	Q709-P1113 WeakPolarHBondContact O-CB 3.25Å; T715-P1113 CarbonylContact O-C 3.57Å; T715-P1113 VanDerWaalsContact O-O 3.12Å; T715-P1113 PolarHBondContact OG1-O 3.28Å; D811-P1113 HydrophobicContact CB-CB 4.17Å; I1110-P1113 HydrophobicContact CB-CG 4.13Å; I1110-P1113 HydrophobicContact CG2-CG 4.2Å; I1110-P1113 WeakPolarHBondContact O-CD 3.34Å
1114	N	95.7	Very high	96.5	Very high	50 Å²	50	34.2 Å²	34.2	27%	0.267	16%	0.164	S	C	.	.			trans	-144	84.7	-175.7	-178	28.3	0	0	0	112.8	T715 D811 K1112 R1116 H1117 P1118	T715-N1114 CarbonylContact O-C 3.47Å; T715-N1114 VanDerWaalsContact O-CA 3.26Å; T715-N1114 WeakPolarHBondContact O-CA 3.42Å; T715-N1114 PolarHBondContact O-N 3.4Å; D811-N1114 PolarHBondContact OD2-N 2.84Å; K1112-N1114 PolarHBondContact O-N 3.48Å; N1114-R1116 PolarHBondContact O-N 2.68Å; N1114-R1116 WeakPolarHBondContact OD1-CB 3.4Å; N1114-R1116 PolarHBondContact OD1-N 2.9Å; N1114-H1117 CarbonylContact O-C 3.53Å; N1114-H1117 PolarHBondContact O-N 2.81Å; N1114-P1118 VanDerWaalsContact O-CA 3.3Å; N1114-P1118 WeakPolarHBondContact O-CA 3.42Å; N1114-P1118 VanDerWaalsContact O-N 3.17Å
1115	R	93.6	Very high	96.5	Very high	31 Å²	31	33 Å²	33	12%	0.117	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-3	177	74.9	164.9	-173.9	-91.9	-1.7	116.4	F688 P713 D714 T715 C716 V810	F688-R1115 HydrophobicContact CD2-CG 4.34Å; P713-R1115 VanDerWaalsContact O-CZ 3.23Å; P713-R1115 PolarHBondContact O-NH1 3Å; P713-R1115 PolarHBondContact O-NH2 3.13Å; D714-R1115 PolarHBondContact O-NH2 2.65Å; T715-R1115 PolarHBondContact O-N 3.06Å; C716-R1115 PolarHBondContact O-NH1 2.84Å; C716-R1115 PolarHBondContact SG-NH1 2.59Å; C716-R1115 VanDerWaalsContact SG-NH1 3.44Å; V810-R1115 HydrophobicContact CB-CB 4.49Å; V810-R1115 HydrophobicContact CG1-CB 3.66Å
1116	R	94.4	Very high	96.5	Very high	122 Å²	122	32.7 Å²	32.7	46%	0.46	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-22.4	170.4	-60.1	-176.8	-178.1	-159	-0	113.1	T684 F688 D714 N1114	T684-R1116 VanDerWaalsContact CG2-O 3.25Å; T684-R1116 WeakPolarHBondContact CG2-O 3.32Å; F688-R1116 HydrophobicContact CD1-CG 4.22Å; F688-R1116 HydrophobicContact CD2-CG 3.62Å; F688-R1116 HydrophobicContact CE1-CG 4.13Å; F688-R1116 HydrophobicContact CE2-CG 3.53Å; F688-R1116 VanDerWaalsContact CE2-NE 3.34Å; F688-R1116 HydrophobicContact CG-CG 4Å; F688-R1116 HydrophobicContact CZ-CG 3.82Å; D714-R1116 IonicContact OD2-NH2 2.68Å; D714-R1116 PolarHBondContact OD2-NH2 3.22Å; N1114-R1116 PolarHBondContact O-N 2.68Å; N1114-R1116 WeakPolarHBondContact OD1-CB 3.4Å; N1114-R1116 PolarHBondContact OD1-N 2.9Å
1117	H	96.4	Very high	96.5	Very high	79 Å²	79	32.9 Å²	32.9	37%	0.366	16%	0.157	S	C	.	.	S	Bend	trans	-156.2	73.4	176.1	-175.5	-161.4	0	0	0	107.7	Y680 K835 E836 N1114	Y680-H1117 PolarHBondContact OH-CD2 2.76Å; K835-H1117 VanDerWaalsContact CE-CE1 3.44Å; K835-H1117 WeakPolarHBondContact CE-CE1 3.31Å; E836-H1117 VanDerWaalsContact CD-NE2 3.32Å; E836-H1117 IonicContact OE1-CE1 2.75Å; E836-H1117 PolarHBondContact OE1-CE1 3.12Å; E836-H1117 IonicContact OE1-NE2 3.6Å; E836-H1117 PolarHBondContact OE1-NE2 3.29Å; E836-H1117 VanDerWaalsContact OE1-NE2 3.12Å; E836-H1117 IonicContact OE2-CD2 3.31Å; E836-H1117 IonicContact OE2-CE1 2.59Å; E836-H1117 IonicContact OE2-NE2 2.98Å; E836-H1117 PolarHBondContact OE2-NE2 2.92Å; N1114-H1117 CarbonylContact O-C 3.53Å; N1114-H1117 PolarHBondContact O-N 2.81Å
1118	P	97.4	Very high	96.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.159	C	C	.	.			trans	-76.3	139.1	-162.6	28.9	-35.4	0	0	0	112.3	Y680 T684 V810 D811 N1114 R1120 I1121	Y680-P1118 HydrophobicContact CE2-CG 4.07Å; Y680-P1118 WeakPolarHBondContact CE2-O 3.47Å; Y680-P1118 PolarHBondContact OH-O 2.88Å; T684-P1118 HydrophobicContact CG2-CG 4.43Å; T684-P1118 WeakPolarHBondContact OG1-CD 3.31Å; V810-P1118 HydrophobicContact CG1-CB 3.56Å; V810-P1118 HydrophobicContact CG1-CG 3.78Å; D811-P1118 WeakPolarHBondContact OD1-CB 3.5Å; D811-P1118 WeakPolarHBondContact OD2-CA 3.4Å; N1114-P1118 VanDerWaalsContact O-CA 3.3Å; N1114-P1118 WeakPolarHBondContact O-CA 3.42Å; N1114-P1118 VanDerWaalsContact O-N 3.17Å; P1118-R1120 VanDerWaalsContact C-N 3.26Å; P1118-R1120 PolarHBondContact O-N 3.05Å; P1118-I1121 HydrophobicContact CB-CG1 4.32Å; P1118-I1121 HydrophobicContact CG-CD1 3.89Å; P1118-I1121 HydrophobicContact CG-CG1 3.64Å
1119	T	97.9	Very high	96.4	Very high	17 Å²	17	35.7 Å²	35.7	10%	0.104	17%	0.167	C	C	.	.	S	Bend	trans	-56.3	-42.3	170.4	-55.3	0	0	0	0	111	D811 K835 D847 I1110	D811-T1119 WeakPolarHBondContact OD1-CA 3.33Å; D811-T1119 PolarHBondContact OD1-N 2.88Å; D811-T1119 PolarHBondContact OD2-N 3.4Å; K835-T1119 PolarHBondContact N-O 3.41Å; K835-T1119 VanDerWaalsContact N-O 3.07Å; D847-T1119 VanDerWaalsContact O-CG2 3.27Å; D847-T1119 WeakPolarHBondContact O-CG2 3.44Å; I1110-T1119 HydrophobicContact CD1-CG2 3.66Å
1120	R	98.3	Very high	96.4	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.015	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	133.3	177.8	-173	175.2	176.2	-105.8	2.3	113.1	D811 T832 Q849 P1118 S1122	D811-R1120 PolarHBondContact N-O 2.89Å; D811-R1120 PolarHBondContact OD1-N 2.78Å; T832-R1120 HydrophobicContact CG2-CG 4.02Å; T832-R1120 VanDerWaalsContact CG2-NE 3.29Å; T832-R1120 PolarHBondContact OG1-NH2 3.1Å; Q849-R1120 HydrophobicContact CB-CB 4.05Å; Q849-R1120 WeakPolarHBondContact O-CD 3.27Å; P1118-R1120 VanDerWaalsContact C-N 3.26Å; P1118-R1120 PolarHBondContact O-N 3.05Å; R1120-S1122 PolarHBondContact NH1-OG 3.21Å
1121	I	98.8	Very high	96.5	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	138.1	158.8	-52.3	-179.9	0	0	0	108.2	Y680 L683 C809 V810 L833 P1118 L1123	Y680-I1121 HydrophobicContact CD2-CD1 4.11Å; Y680-I1121 HydrophobicContact CD2-CG1 4.35Å; Y680-I1121 HydrophobicContact CE2-CD1 4.43Å; Y680-I1121 HydrophobicContact CE2-CG1 4.43Å; L683-I1121 HydrophobicContact CB-CD1 4.36Å; C809-I1121 CarbonylContact O-C 3.12Å; C809-I1121 WeakPolarHBondContact O-CA 3.49Å; V810-I1121 HydrophobicContact CG1-CG1 4.31Å; V810-I1121 HydrophobicContact CG2-CG1 4.22Å; V810-I1121 HydrophobicContact CG2-CG2 4.19Å; L833-I1121 HydrophobicContact CB-CB 4.25Å; L833-I1121 PolarHBondContact N-O 3.31Å; L833-I1121 PolarHBondContact O-N 3.07Å; L833-I1121 VanDerWaalsContact O-O 3.12Å; P1118-I1121 HydrophobicContact CB-CG1 4.32Å; P1118-I1121 HydrophobicContact CG-CD1 3.89Å; P1118-I1121 HydrophobicContact CG-CG1 3.64Å; I1121-L1123 HydrophobicContact CG2-CD2 3.8Å; I1121-L1123 HydrophobicContact CG2-CG 4.48Å
1122	S	98.7	Very high	96.8	Very high	5 Å²	5	33.4 Å²	33.4	4%	0.035	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128.9	169	43.1	0	0	0	0	111	A808 C809 C831 R1120	A808-S1122 CarbonylContact C-O 3.18Å; A808-S1122 WeakPolarHBondContact CA-O 3.49Å; C809-S1122 WeakPolarHBondContact CB-OG 3.31Å; C809-S1122 PolarHBondContact N-O 3.21Å; C809-S1122 PolarHBondContact O-N 2.82Å; C809-S1122 PolarHBondContact O-OG 3.4Å; C831-S1122 CarbonylContact O-C 3.55Å; C831-S1122 WeakPolarHBondContact O-CA 3.26Å; R1120-S1122 PolarHBondContact NH1-OG 3.21Å
1123	L	98.9	Very high	96.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	98.8	179.6	-50.1	179.8	0	0	0	107.7	L683 L761 L764 V806 A808 V830 C831 L833 I1121 F1125	L683-L1123 HydrophobicContact CD1-CD1 3.75Å; L683-L1123 HydrophobicContact CD1-CD2 3.69Å; L683-L1123 HydrophobicContact CD1-CG 4.34Å; L761-L1123 HydrophobicContact CD2-CD1 4.23Å; L764-L1123 HydrophobicContact CD2-CD1 3.45Å; L764-L1123 VanDerWaalsContact CD2-CD1 3.45Å; V806-L1123 HydrophobicContact CG2-CB 4.36Å; A808-L1123 HydrophobicContact CB-CD2 3.64Å; V830-L1123 WeakPolarHBondContact CA-O 3.46Å; C831-L1123 HydrophobicContact CB-CB 4.23Å; C831-L1123 PolarHBondContact N-O 3.01Å; C831-L1123 PolarHBondContact O-N 2.81Å; L833-L1123 HydrophobicContact CD1-CD1 4.04Å; L833-L1123 HydrophobicContact CD1-CG 4.45Å; I1121-L1123 HydrophobicContact CG2-CD2 3.8Å; I1121-L1123 HydrophobicContact CG2-CG 4.48Å; L1123-F1125 HydrophobicContact CB-CD2 4.46Å; L1123-F1125 HydrophobicContact CB-CE2 3.85Å; L1123-F1125 WeakPolarHBondContact O-CD2 3.46Å
1124	V	98.9	Very high	96.9	Very high	22 Å²	22	31.6 Å²	31.6	13%	0.133	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	100.3	-171.1	-175.1	0	0	0	0	108.8	V806 T807 T828 V830 Y1126	V806-V1124 CarbonylContact C-O 3.52Å; V806-V1124 VanDerWaalsContact CA-O 3.28Å; V806-V1124 WeakPolarHBondContact CA-O 3.46Å; T807-V1124 PolarHBondContact N-O 3.31Å; T807-V1124 PolarHBondContact O-N 2.93Å; T828-V1124 HydrophobicContact CG2-CG1 3.44Å; T828-V1124 VanDerWaalsContact CG2-CG1 3.44Å; V830-V1124 HydrophobicContact CG1-CG2 4.08Å; V830-V1124 HydrophobicContact CG2-CB 4.47Å; V830-V1124 HydrophobicContact CG2-CG1 4.16Å; V830-V1124 HydrophobicContact CG2-CG2 4.21Å; V1124-Y1126 HydrophobicContact CG1-CD1 4.16Å; V1124-Y1126 VanDerWaalsContact O-CD1 3.23Å; V1124-Y1126 WeakPolarHBondContact O-CD1 3.43Å; V1124-Y1126 VanDerWaalsContact O-CE1 3.24Å; V1124-Y1126 WeakPolarHBondContact O-CE1 3.47Å
1125	F	98.9	Very high	96.8	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	135.2	178.5	-68.5	-94.1	0	0	0	111.5	L764 A765 L768 F803 V806 V829 L1123	L764-F1125 HydrophobicContact CB-CZ 4.29Å; L764-F1125 HydrophobicContact CD2-CE2 3.74Å; L764-F1125 HydrophobicContact CD2-CZ 3.72Å; L764-F1125 HydrophobicContact CG-CE2 4.06Å; L764-F1125 HydrophobicContact CG-CZ 3.84Å; A765-F1125 HydrophobicContact CB-CD1 4.37Å; A765-F1125 HydrophobicContact CB-CE1 3.86Å; L768-F1125 HydrophobicContact CD1-CD2 3.64Å; L768-F1125 HydrophobicContact CD1-CE2 3.51Å; L768-F1125 HydrophobicContact CD1-CG 4.38Å; L768-F1125 HydrophobicContact CD1-CZ 4.16Å; F803-F1125 HydrophobicContact CB-CD1 4.31Å; F803-F1125 HydrophobicContact CD1-CB 3.65Å; F803-F1125 HydrophobicContact CD2-CB 4.4Å; F803-F1125 HydrophobicContact CD2-CD1 4.14Å; F803-F1125 HydrophobicContact CE1-CB 3.88Å; F803-F1125 HydrophobicContact CG-CB 3.93Å; F803-F1125 HydrophobicContact CG-CD1 4.13Å; F803-F1125 HydrophobicContact CG-CG 4.43Å; F803-F1125 HydrophobicContact CZ-CB 4.35Å; V806-F1125 HydrophobicContact CB-CD1 3.7Å; V806-F1125 HydrophobicContact CB-CE1 3.73Å; V806-F1125 HydrophobicContact CB-CG 4.22Å; V806-F1125 HydrophobicContact CB-CZ 4.29Å; V806-F1125 HydrophobicContact CG1-CE1 4.29Å; V806-F1125 HydrophobicContact CG2-CD1 3.75Å; V806-F1125 HydrophobicContact CG2-CD2 3.93Å; V806-F1125 HydrophobicContact CG2-CE1 3.62Å; V806-F1125 HydrophobicContact CG2-CE2 3.81Å; V806-F1125 HydrophobicContact CG2-CG 3.9Å; V806-F1125 HydrophobicContact CG2-CZ 3.66Å; V829-F1125 HydrophobicContact CB-CB 4.42Å; V829-F1125 PolarHBondContact N-O 2.92Å; V829-F1125 PolarHBondContact O-N 2.86Å; L1123-F1125 HydrophobicContact CB-CD2 4.46Å; L1123-F1125 HydrophobicContact CB-CE2 3.85Å; L1123-F1125 WeakPolarHBondContact O-CD2 3.46Å
1126	Y	98.8	Very high	97	Very high	4 Å²	4	30.2 Å²	30.2	2%	0.016	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	166.8	-174.7	50.2	-100.6	0	0	0	112.7	S804 G805 T807 V1124 H1128	S804-Y1126 PolarHBondContact N-O 2.86Å; S804-Y1126 PolarHBondContact OG-O 2.9Å; G805-Y1126 PolarHBondContact N-O 2.91Å; G805-Y1126 VanDerWaalsContact N-O 3.08Å; G805-Y1126 PolarHBondContact O-N 3.3Å; T807-Y1126 PolarHBondContact OG1-OH 2.83Å; V1124-Y1126 HydrophobicContact CG1-CD1 4.16Å; V1124-Y1126 VanDerWaalsContact O-CD1 3.23Å; V1124-Y1126 WeakPolarHBondContact O-CD1 3.43Å; V1124-Y1126 VanDerWaalsContact O-CE1 3.24Å; V1124-Y1126 WeakPolarHBondContact O-CE1 3.47Å; Y1126-H1128 AromaticContact CD2-CD2 3.47Å; Y1126-H1128 VanDerWaalsContact CD2-CD2 3.47Å; Y1126-H1128 WeakPolarHBondContact CD2-CD2 3.47Å; Y1126-H1128 AromaticContact CD2-NE2 3.8Å; Y1126-H1128 AromaticContact CE2-CD2 3.66Å; Y1126-H1128 AromaticContact CE2-NE2 3.58Å
1127	Q	98.6	Very high	97	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.019	15%	0.147	C	C	.	.			trans	-119.2	122.8	165.4	-178.9	167.3	-25.6	0	0	110.5	Q783 P802 S804 N822 M823	Q783-Q1127 VanDerWaalsContact CB-OE1 3.29Å; Q783-Q1127 HydrophobicContact CG-CB 4.14Å; Q783-Q1127 PolarHBondContact O-NE2 3.11Å; Q783-Q1127 PolarHBondContact O-OE1 3.39Å; P802-Q1127 PolarHBondContact O-OE1 3.39Å; S804-Q1127 WeakPolarHBondContact OG-CA 3.46Å; N822-Q1127 CarbonylContact C-O 3.35Å; N822-Q1127 VanDerWaalsContact CA-O 3.31Å; N822-Q1127 WeakPolarHBondContact CA-O 3.44Å; M823-Q1127 HydrophobicContact CG-CB 4.36Å; M823-Q1127 HydrophobicContact CG-CG 4.3Å; M823-Q1127 PolarHBondContact N-O 2.92Å; M823-Q1127 HydrophobicContact SD-CB 4.08Å; M823-Q1127 HydrophobicContact SD-CG 3.65Å; M823-Q1127 PolarHBondContact SD-NE2 2.83Å
1128	H	98.3	Very high	96.9	Very high	20 Å²	20	24.6 Å²	24.6	9%	0.093	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-77.6	151.3	170	-78.2	-157.6	0	0	0	111.4	W726 S804 S821 N822 Y1126 L1131	W726-H1128 HydrophobicContact CB-CB 3.7Å; W726-H1128 PolarHBondContact N-ND1 3.39Å; W726-H1128 VanDerWaalsContact N-ND1 3.1Å; S804-H1128 PolarHBondContact OG-N 3.48Å; S821-H1128 VanDerWaalsContact O-CA 3.31Å; S821-H1128 WeakPolarHBondContact O-CA 3.37Å; S821-H1128 WeakPolarHBondContact O-CB 3.43Å; N822-H1128 PolarHBondContact OD1-CD2 3.32Å; N822-H1128 VanDerWaalsContact OD1-CD2 3.25Å; Y1126-H1128 AromaticContact CD2-CD2 3.47Å; Y1126-H1128 VanDerWaalsContact CD2-CD2 3.47Å; Y1126-H1128 WeakPolarHBondContact CD2-CD2 3.47Å; Y1126-H1128 AromaticContact CD2-NE2 3.8Å; Y1126-H1128 AromaticContact CE2-CD2 3.66Å; Y1126-H1128 AromaticContact CE2-NE2 3.58Å; H1128-L1131 HydrophobicContact CB-CD1 3.74Å; H1128-L1131 HydrophobicContact CB-CG 4.23Å
1129	K	96.1	Very high	96.7	Very high	65 Å²	65	28.3 Å²	28.3	28%	0.283	18%	0.177	S	C	.	.	S	Bend	trans	-56.7	151.3	173.3	70.3	-163.8	179.1	-171.8	0	112.5	W726 S821 M823 L1131	W726-K1129 HydrophobicContact CB-CG 4.45Å; W726-K1129 WeakPolarHBondContact CB-O 3.34Å; W726-K1129 HydrophobicContact CD2-CG 4.38Å; W726-K1129 VanDerWaalsContact CE2-CE 3.46Å; W726-K1129 HydrophobicContact CG-CG 4.04Å; S821-K1129 PolarHBondContact O-N 2.95Å; M823-K1129 HydrophobicContact CB-CB 4.42Å; K1129-L1131 PolarHBondContact O-N 3.5Å
1130	A	94.6	Very high	96.3	Very high	44 Å²	44	32.9 Å²	32.9	36%	0.364	20%	0.198	S	C	.	.	S	Bend	trans	52.1	49.3	176.3	0	0	0	0	0	113.6	G732	G732-A1130 WeakPolarHBondContact CA-O 3.41Å
1131	L	96.3	Very high	95.8	Very high	1 Å²	1	34 Å²	34	1%	0.005	20%	0.203	C	C	.	.			trans	-117.3	37.3	171.2	-65.1	-173	0	0	0	111.1	C724 C733 C793 R794 S804 H1128 K1129	C724-L1131 HydrophobicContact CB-CD1 4.18Å; C733-L1131 VanDerWaalsContact CA-CD2 3.41Å; C733-L1131 HydrophobicContact CB-CD2 3.63Å; C793-L1131 HydrophobicContact CB-CB 4.1Å; C793-L1131 WeakPolarHBondContact CB-O 3.5Å; R794-L1131 PolarHBondContact NH1-O 2.81Å; S804-L1131 VanDerWaalsContact OG-CD1 3.22Å; S804-L1131 WeakPolarHBondContact OG-CD1 3.45Å; H1128-L1131 HydrophobicContact CB-CD1 3.74Å; H1128-L1131 HydrophobicContact CB-CG 4.23Å; K1129-L1131 PolarHBondContact O-N 3.5Å
1132	N	95.7	Very high	95.5	Very high	48 Å²	48	38 Å²	38	26%	0.257	22%	0.224	S	C	.	.			trans	-102.8	-1.2	-173.5	-61.7	0.2	0	0	0	112.3	C786 A789 G790	C786-N1132 HydrophobicContact CB-CB 3.69Å; C786-N1132 WeakPolarHBondContact CB-ND2 3.34Å; C786-N1132 PolarHBondContact SG-ND2 3.29Å; A789-N1132 CarbonylContact C-O 3.6Å; A789-N1132 VanDerWaalsContact C-O 3.25Å; A789-N1132 WeakPolarHBondContact CB-O 3.4Å; G790-N1132 PolarHBondContact N-O 2.87Å
1133	E	93.9	Very high	95.2	Very high	67 Å²	67	40.9 Å²	40.9	31%	0.313	25%	0.248	S	C	.	.	S	Bend	trans	-86.3	137.8	-177.4	-54	-56.6	141.7	0	0	112.5	A789 M1140	A789-E1133 CarbonylContact O-C 3.5Å; E1133-M1140 VanDerWaalsContact CD-CE 3.46Å; E1133-M1140 HydrophobicContact CG-CE 4.16Å; E1133-M1140 WeakPolarHBondContact OE2-CE 3.25Å
1134	P	94.8	Very high	94.8	Very high	80 Å²	80	45 Å²	45	52%	0.519	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-67.8	153.6	177.5	28.1	-35.2	0	0	0	111.2	A789 H1136 G1137	A789-P1134 WeakPolarHBondContact O-CA 3.29Å; A789-P1134 WeakPolarHBondContact O-CB 3.45Å; A789-P1134 WeakPolarHBondContact O-CD 3.35Å; P1134-H1136 PolarHBondContact O-N 3.33Å; P1134-H1136 VanDerWaalsContact O-N 3.12Å; P1134-G1137 PolarHBondContact O-N 2.85Å
1135	G	94.6	Very high	94.4	Very high	39 Å²	39	47.6 Å²	47.6	40%	0.402	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	54.6	34.1	-179.5	0	0	0	0	0	113.4	G1137 M1138	G1135-G1137 PolarHBondContact O-N 3.2Å; G1135-M1138 WeakPolarHBondContact O-CB 3.44Å; G1135-M1138 PolarHBondContact O-N 3.13Å
1136	H	96.6	Very high	94.1	Very high	14 Å²	14	49.8 Å²	49.8	7%	0.065	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	60.4	16.8	-173.3	-55.4	-61.1	0	0	0	115.9	C724 C733 F735 P741 A792 C793 P1134	C724-H1136 PolarHBondContact SG-CE1 3.31Å; C733-H1136 HydrophobicContact CB-CB 3.84Å; C733-H1136 WeakPolarHBondContact CB-O 3.4Å; F735-H1136 HydrophobicContact CB-CB 4.08Å; P741-H1136 VanDerWaalsContact CG-CD2 3.4Å; P741-H1136 WeakPolarHBondContact CG-CD2 3.39Å; P741-H1136 VanDerWaalsContact CG-NE2 3.31Å; P741-H1136 WeakPolarHBondContact CG-NE2 3.46Å; A792-H1136 PolarHBondContact O-CE1 3.16Å; C793-H1136 PolarHBondContact SG-ND1 2.84Å; P1134-H1136 PolarHBondContact O-N 3.33Å; P1134-H1136 VanDerWaalsContact O-N 3.12Å
1137	G	94.9	Very high	93.7	Very high	9 Å²	9	55.2 Å²	55.2	9%	0.093	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	77.4	25.1	-174.8	0	0	0	0	0	114	P1134 G1135 M1140 W1141	P1134-G1137 PolarHBondContact O-N 2.85Å; G1135-G1137 PolarHBondContact O-N 3.2Å; G1137-M1140 WeakPolarHBondContact O-CB 3.23Å; G1137-M1140 PolarHBondContact O-N 3.02Å; G1137-W1141 PolarHBondContact O-N 3.05Å
1138	M	94.1	Very high	93.4	Very high	74 Å²	74	60.4 Å²	60.4	37%	0.365	34%	0.339	S	S	.	.	H	α-helix	trans	-60.6	-51.1	178.8	-173.7	168	66	0	0	112.1	G1135 M1140 W1141 D1142	G1135-M1138 WeakPolarHBondContact O-CB 3.44Å; G1135-M1138 PolarHBondContact O-N 3.13Å; M1138-M1140 VanDerWaalsContact C-N 3.33Å; M1138-M1140 PolarHBondContact O-N 2.84Å; M1138-W1141 WeakPolarHBondContact O-CA 3.48Å; M1138-W1141 WeakPolarHBondContact O-CB 3.21Å; M1138-W1141 PolarHBondContact O-N 3.25Å; M1138-D1142 PolarHBondContact O-N 3.28Å
1139	A	92.4	Very high	93.1	Very high	77 Å²	77	64.6 Å²	64.6	64%	0.636	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-41	177.4	0	0	0	0	0	112.9	W1141 D1142 A1143	A1139-W1141 VanDerWaalsContact C-N 3.3Å; A1139-W1141 PolarHBondContact O-N 2.96Å; A1139-D1142 PolarHBondContact O-N 2.89Å; A1139-A1143 WeakPolarHBondContact O-CB 3.35Å; A1139-A1143 PolarHBondContact O-N 3.36Å
1140	M	89.4	Confident	93	Very high	113 Å²	113	68.7 Å²	68.7	56%	0.557	37%	0.372	S	S	*	.	H	α-helix	trans	-59.5	-36.9	172.7	-93.1	-92.3	-100.4	0	0	112.8	E1133 G1137 M1138 K1144	E1133-M1140 VanDerWaalsContact CD-CE 3.46Å; E1133-M1140 HydrophobicContact CG-CE 4.16Å; E1133-M1140 WeakPolarHBondContact OE2-CE 3.25Å; G1137-M1140 WeakPolarHBondContact O-CB 3.23Å; G1137-M1140 PolarHBondContact O-N 3.02Å; M1138-M1140 VanDerWaalsContact C-N 3.33Å; M1138-M1140 PolarHBondContact O-N 2.84Å; M1140-K1144 VanDerWaalsContact O-CB 3.26Å; M1140-K1144 WeakPolarHBondContact O-CB 3.49Å; M1140-K1144 PolarHBondContact O-N 3.06Å
1141	W	89.8	Confident	92.9	Very high	28 Å²	28	70.6 Å²	70.6	11%	0.106	37%	0.374	C	S	.	.	H	α-helix	trans	-73.2	-45.7	174.6	172.1	-99.4	0	0	0	112.2	F730 A736 R737 G1137 M1138 A1139 K1144 M1145	F730-W1141 HydrophobicContact CB-CE3 4.5Å; F730-W1141 AromaticContact CD1-CD2 3.83Å; F730-W1141 HydrophobicContact CD1-CD2 3.83Å; F730-W1141 AromaticContact CD1-CE3 3.53Å; F730-W1141 HydrophobicContact CD1-CE3 3.53Å; F730-W1141 AromaticContact CD1-CH2 3.95Å; F730-W1141 HydrophobicContact CD1-CH2 3.95Å; F730-W1141 HydrophobicContact CD1-CZ2 4.26Å; F730-W1141 AromaticContact CD1-CZ3 3.6Å; F730-W1141 HydrophobicContact CD1-CZ3 3.6Å; F730-W1141 HydrophobicContact CE1-CD2 4.23Å; F730-W1141 HydrophobicContact CE1-CE3 4.27Å; F730-W1141 HydrophobicContact CE1-CH2 4.07Å; F730-W1141 HydrophobicContact CE1-CZ2 4.06Å; F730-W1141 HydrophobicContact CE1-CZ3 4.19Å; F730-W1141 HydrophobicContact CG-CE3 4.47Å; A736-W1141 HydrophobicContact CB-CB 4.22Å; R737-W1141 HydrophobicContact CG-CG 4.35Å; G1137-W1141 PolarHBondContact O-N 3.05Å; M1138-W1141 WeakPolarHBondContact O-CA 3.48Å; M1138-W1141 WeakPolarHBondContact O-CB 3.21Å; M1138-W1141 PolarHBondContact O-N 3.25Å; A1139-W1141 VanDerWaalsContact C-N 3.3Å; A1139-W1141 PolarHBondContact O-N 2.96Å; W1141-K1144 WeakPolarHBondContact O-CB 3.39Å; W1141-K1144 PolarHBondContact O-N 2.86Å; W1141-M1145 HydrophobicContact CD2-CG 4.08Å; W1141-M1145 HydrophobicContact CH2-CG 4.33Å; W1141-M1145 HydrophobicContact CH2-SD 3.61Å; W1141-M1145 HydrophobicContact CZ2-CE 4.02Å; W1141-M1145 HydrophobicContact CZ2-CG 3.69Å; W1141-M1145 HydrophobicContact CZ2-SD 3.36Å; W1141-M1145 WeakPolarHBondContact CZ2-SD 3.46Å; W1141-M1145 HydrophobicContact CZ3-SD 4.29Å; W1141-M1145 WeakPolarHBondContact O-CG 3.43Å; W1141-M1145 PolarHBondContact O-N 3.28Å
1142	D	92.4	Very high	92.8	Very high	84 Å²	84	76.4 Å²	76.4	45%	0.449	40%	0.395	S	S	.	.	H	α-helix	trans	-66.5	-42.9	-176.4	-64.7	-29.4	0	0	0	111.1	M1138 A1139 K1144 M1145 A1146	M1138-D1142 PolarHBondContact O-N 3.28Å; A1139-D1142 PolarHBondContact O-N 2.89Å; D1142-K1144 VanDerWaalsContact C-N 3.3Å; D1142-K1144 PolarHBondContact O-N 3.15Å; D1142-M1145 PolarHBondContact O-N 3.48Å; D1142-M1145 VanDerWaalsContact O-N 3.1Å; D1142-A1146 PolarHBondContact O-N 2.89Å
1143	A	91.9	Very high	92.7	Very high	65 Å²	65	80.7 Å²	80.7	54%	0.537	41%	0.414	S	S	.	.	H	α-helix	trans	-59.5	-38.3	172	0	0	0	0	0	112.7	A1139 M1145 A1146 K1147	A1139-A1143 WeakPolarHBondContact O-CB 3.35Å; A1139-A1143 PolarHBondContact O-N 3.36Å; A1143-M1145 VanDerWaalsContact C-N 3.33Å; A1143-A1146 PolarHBondContact O-N 2.85Å; A1143-K1147 PolarHBondContact O-N 3.47Å
1144	K	90.6	Very high	92.6	Very high	88 Å²	88	82.2 Å²	82.2	38%	0.383	42%	0.421	S	S	.	.	H	α-helix	trans	-69.2	-29.5	175.9	-179.1	175.8	-174.4	169.1	0	112.8	M1140 W1141 D1142 R1148	M1140-K1144 VanDerWaalsContact O-CB 3.26Å; M1140-K1144 WeakPolarHBondContact O-CB 3.49Å; M1140-K1144 PolarHBondContact O-N 3.06Å; W1141-K1144 WeakPolarHBondContact O-CB 3.39Å; W1141-K1144 PolarHBondContact O-N 2.86Å; D1142-K1144 VanDerWaalsContact C-N 3.3Å; D1142-K1144 PolarHBondContact O-N 3.15Å; K1144-R1148 WeakPolarHBondContact O-CD 3.47Å; K1144-R1148 WeakPolarHBondContact O-CG 3.34Å; K1144-R1148 PolarHBondContact O-N 2.88Å
1145	M	89.1	Confident	92.5	Very high	76 Å²	76	84.1 Å²	84.1	37%	0.374	42%	0.423	S	S	.	.	H	α-helix	trans	-76.8	-42.7	173.1	-66.3	-62.4	-74.9	0	0	111.1	W1141 D1142 A1143 K1147 R1148 E1149	W1141-M1145 HydrophobicContact CD2-CG 4.08Å; W1141-M1145 HydrophobicContact CH2-CG 4.33Å; W1141-M1145 HydrophobicContact CH2-SD 3.61Å; W1141-M1145 HydrophobicContact CZ2-CE 4.02Å; W1141-M1145 HydrophobicContact CZ2-CG 3.69Å; W1141-M1145 HydrophobicContact CZ2-SD 3.36Å; W1141-M1145 WeakPolarHBondContact CZ2-SD 3.46Å; W1141-M1145 HydrophobicContact CZ3-SD 4.29Å; W1141-M1145 WeakPolarHBondContact O-CG 3.43Å; W1141-M1145 PolarHBondContact O-N 3.28Å; D1142-M1145 PolarHBondContact O-N 3.48Å; D1142-M1145 VanDerWaalsContact O-N 3.1Å; A1143-M1145 VanDerWaalsContact C-N 3.33Å; M1145-K1147 VanDerWaalsContact C-N 3.3Å; M1145-K1147 PolarHBondContact O-N 2.7Å; M1145-R1148 CarbonylContact O-C 3.25Å; M1145-R1148 WeakPolarHBondContact O-CA 3.39Å; M1145-R1148 WeakPolarHBondContact O-CB 3.43Å; M1145-R1148 PolarHBondContact O-N 2.84Å; M1145-R1148 VanDerWaalsContact O-N 3.07Å; M1145-E1149 PolarHBondContact O-N 3.18Å
1146	A	92.5	Very high	92.4	Very high	46 Å²	46	84.1 Å²	84.1	38%	0.38	42%	0.42	S	S	.	.	H	α-helix	trans	-62.4	-31.9	173.5	0	0	0	0	0	113.4	D1142 A1143 E1149 R1150	D1142-A1146 PolarHBondContact O-N 2.89Å; A1143-A1146 PolarHBondContact O-N 2.85Å; A1146-E1149 WeakPolarHBondContact O-CB 3.38Å; A1146-E1149 PolarHBondContact O-N 3.36Å; A1146-R1150 PolarHBondContact O-N 3.07Å
1147	K	92.1	Very high	92.1	Very high	118 Å²	118	88.8 Å²	88.8	51%	0.513	44%	0.441	S	S	.	.	H	α-helix	trans	-65.3	-44.6	170	-166.9	175.6	-168.3	-75.6	0	111.7	A1143 M1145 E1149 R1150 E1151	A1143-K1147 PolarHBondContact O-N 3.47Å; M1145-K1147 VanDerWaalsContact C-N 3.3Å; M1145-K1147 PolarHBondContact O-N 2.7Å; K1147-E1149 PolarHBondContact O-N 3Å; K1147-R1150 PolarHBondContact O-N 2.97Å; K1147-E1151 HydrophobicContact CG-CG 4.45Å; K1147-E1151 IonicContact NZ-OE1 3.84Å; K1147-E1151 PolarHBondContact NZ-OE1 3.18Å; K1147-E1151 WeakPolarHBondContact O-CB 3.41Å; K1147-E1151 VanDerWaalsContact O-CG 3.26Å; K1147-E1151 WeakPolarHBondContact O-CG 3.48Å; K1147-E1151 PolarHBondContact O-N 3.23Å
1148	R	90.9	Very high	91.9	Very high	112 Å²	112	96.4 Å²	96.4	42%	0.423	47%	0.467	S	S	.	.	H	α-helix	trans	-70	-16.8	176.6	-73.9	168.1	162	-179.5	-9	114.7	K1144 M1145 E1151 R1152	K1144-R1148 WeakPolarHBondContact O-CD 3.47Å; K1144-R1148 WeakPolarHBondContact O-CG 3.34Å; K1144-R1148 PolarHBondContact O-N 2.88Å; M1145-R1148 CarbonylContact O-C 3.25Å; M1145-R1148 WeakPolarHBondContact O-CA 3.39Å; M1145-R1148 WeakPolarHBondContact O-CB 3.43Å; M1145-R1148 PolarHBondContact O-N 2.84Å; M1145-R1148 VanDerWaalsContact O-N 3.07Å; R1148-E1151 WeakPolarHBondContact CA-OE2 3.32Å; R1148-R1152 WeakPolarHBondContact O-CB 3.5Å; R1148-R1152 PolarHBondContact O-NH2 2.98Å
1149	E	92.7	Very high	91.6	Very high	108 Å²	108	98 Å²	98	51%	0.505	48%	0.476	S	S	.	.	H	α-helix	trans	-72.2	-57	169.9	-156.9	105.2	-91.9	0	0	109.1	M1145 A1146 K1147 E1151 R1152 E1153	M1145-E1149 PolarHBondContact O-N 3.18Å; A1146-E1149 WeakPolarHBondContact O-CB 3.38Å; A1146-E1149 PolarHBondContact O-N 3.36Å; K1147-E1149 PolarHBondContact O-N 3Å; E1149-E1151 PolarHBondContact O-N 2.93Å; E1149-R1152 WeakPolarHBondContact O-CA 3.3Å; E1149-R1152 WeakPolarHBondContact O-CB 3.39Å; E1149-R1152 PolarHBondContact O-N 3.34Å; E1149-R1152 IonicContact OE1-CZ 3.4Å; E1149-R1152 IonicContact OE1-NH1 3.46Å; E1149-R1152 PolarHBondContact OE1-NH1 3.17Å; E1149-R1152 IonicContact OE1-NH2 2.79Å; E1149-E1153 PolarHBondContact O-N 3.39Å
1150	R	93.4	Very high	91.2	Very high	151 Å²	151	103.5 Å²	103.5	57%	0.57	48%	0.481	S	S	*	.	H	α-helix	trans	-59.5	-44.3	177	-70.5	-176.8	-72	174.3	-1.4	112.7	A1146 K1147 R1152 E1153 E1154	A1146-R1150 PolarHBondContact O-N 3.07Å; K1147-R1150 PolarHBondContact O-N 2.97Å; R1150-R1152 PolarHBondContact O-N 3.08Å; R1150-R1152 VanDerWaalsContact O-N 3.15Å; R1150-E1153 PolarHBondContact O-N 3.37Å; R1150-E1153 VanDerWaalsContact O-N 3.08Å; R1150-E1154 WeakPolarHBondContact O-CB 3.35Å; R1150-E1154 WeakPolarHBondContact O-CG 3.3Å; R1150-E1154 PolarHBondContact O-N 3.35Å
1151	E	93.1	Very high	90.6	Very high	85 Å²	85	104.5 Å²	104.5	40%	0.397	49%	0.486	S	S	.	.	H	α-helix	trans	-55.5	-33.5	173.9	-73.9	166.5	170.8	0	0	112.7	K1147 R1148 E1149 E1155	K1147-E1151 HydrophobicContact CG-CG 4.45Å; K1147-E1151 IonicContact NZ-OE1 3.84Å; K1147-E1151 PolarHBondContact NZ-OE1 3.18Å; K1147-E1151 WeakPolarHBondContact O-CB 3.41Å; K1147-E1151 VanDerWaalsContact O-CG 3.26Å; K1147-E1151 WeakPolarHBondContact O-CG 3.48Å; K1147-E1151 PolarHBondContact O-N 3.23Å; R1148-E1151 WeakPolarHBondContact CA-OE2 3.32Å; E1149-E1151 PolarHBondContact O-N 2.93Å; E1151-E1155 VanDerWaalsContact O-CB 3.29Å; E1151-E1155 WeakPolarHBondContact O-CB 3.25Å; E1151-E1155 PolarHBondContact O-N 3.48Å; E1151-E1155 VanDerWaalsContact O-N 3.08Å
1152	R	93.1	Very high	89.4	Confident	122 Å²	122	110.4 Å²	110.4	46%	0.46	51%	0.514	S	S	.	.	H	α-helix	trans	-82.3	-32.6	178	-169.2	-165.9	-43.7	120.1	25.2	112.3	R1148 E1149 R1150 A1156	R1148-R1152 WeakPolarHBondContact O-CB 3.5Å; R1148-R1152 PolarHBondContact O-NH2 2.98Å; E1149-R1152 WeakPolarHBondContact O-CA 3.3Å; E1149-R1152 WeakPolarHBondContact O-CB 3.39Å; E1149-R1152 PolarHBondContact O-N 3.34Å; E1149-R1152 IonicContact OE1-CZ 3.4Å; E1149-R1152 IonicContact OE1-NH1 3.46Å; E1149-R1152 PolarHBondContact OE1-NH1 3.17Å; E1149-R1152 IonicContact OE1-NH2 2.79Å; R1150-R1152 PolarHBondContact O-N 3.08Å; R1150-R1152 VanDerWaalsContact O-N 3.15Å; R1152-A1156 VanDerWaalsContact O-CB 3.23Å; R1152-A1156 WeakPolarHBondContact O-CB 3.35Å; R1152-A1156 PolarHBondContact O-N 3.48Å
1153	E	93.9	Very high	87.8	Confident	139 Å²	139	109.5 Å²	109.5	65%	0.65	53%	0.525	S	S	*	.	H	α-helix	trans	-69	-45.6	174.2	-171.8	163.1	-142.8	0	0	110.6	E1149 R1150 E1155 A1156 E1157	E1149-E1153 PolarHBondContact O-N 3.39Å; R1150-E1153 PolarHBondContact O-N 3.37Å; R1150-E1153 VanDerWaalsContact O-N 3.08Å; E1153-E1155 PolarHBondContact O-N 3.33Å; E1153-A1156 PolarHBondContact O-N 3.05Å; E1153-E1157 WeakPolarHBondContact O-CB 3.23Å; E1153-E1157 PolarHBondContact O-N 2.91Å
1154	E	93.4	Very high	86.1	Confident	99 Å²	99	110.4 Å²	110.4	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-59.4	-42.6	170.3	-69.9	171.9	-137.2	0	0	112.1	R1150 E1157 R1158	R1150-E1154 WeakPolarHBondContact O-CB 3.35Å; R1150-E1154 WeakPolarHBondContact O-CG 3.3Å; R1150-E1154 PolarHBondContact O-N 3.35Å; E1154-E1157 PolarHBondContact O-N 3.29Å; E1154-R1158 WeakPolarHBondContact O-CB 3.43Å; E1154-R1158 VanDerWaalsContact O-CG 3.22Å; E1154-R1158 WeakPolarHBondContact O-CG 3.35Å; E1154-R1158 PolarHBondContact O-N 3.48Å
1155	E	91.6	Very high	84.1	Confident	119 Å²	119	109.9 Å²	109.9	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-64.3	-43.5	174.2	-176.2	177.8	-151.2	0	0	111.5	E1151 E1153 E1157 R1158 L1159	E1151-E1155 VanDerWaalsContact O-CB 3.29Å; E1151-E1155 WeakPolarHBondContact O-CB 3.25Å; E1151-E1155 PolarHBondContact O-N 3.48Å; E1151-E1155 VanDerWaalsContact O-N 3.08Å; E1153-E1155 PolarHBondContact O-N 3.33Å; E1155-E1157 PolarHBondContact O-N 3.06Å; E1155-R1158 PolarHBondContact O-N 3.06Å; E1155-L1159 HydrophobicContact CG-CD1 4.19Å; E1155-L1159 WeakPolarHBondContact O-CB 3.49Å; E1155-L1159 VanDerWaalsContact O-CG 3.29Å; E1155-L1159 WeakPolarHBondContact O-CG 3.45Å; E1155-L1159 PolarHBondContact O-N 3.1Å
1156	A	91.6	Very high	82	Confident	40 Å²	40	109.9 Å²	109.9	33%	0.331	57%	0.567	S	S	.	*	H	α-helix	trans	-67.1	-34	177.1	0	0	0	0	0	112.7	R1152 E1153 R1160	R1152-A1156 VanDerWaalsContact O-CB 3.23Å; R1152-A1156 WeakPolarHBondContact O-CB 3.35Å; R1152-A1156 PolarHBondContact O-N 3.48Å; E1153-A1156 PolarHBondContact O-N 3.05Å; A1156-R1160 WeakPolarHBondContact O-CD 3.42Å; A1156-R1160 WeakPolarHBondContact O-CG 3.4Å; A1156-R1160 PolarHBondContact O-N 3.02Å
1157	E	91.3	Very high	79.6	Confident	112 Å²	112	112.5 Å²	112.5	52%	0.523	59%	0.588	S	S	.	*	H	α-helix	trans	-70.1	-44.8	173.6	-175.6	168.6	-139.3	0	0	111.8	E1153 E1154 E1155 L1159 R1160 M1161	E1153-E1157 WeakPolarHBondContact O-CB 3.23Å; E1153-E1157 PolarHBondContact O-N 2.91Å; E1154-E1157 PolarHBondContact O-N 3.29Å; E1155-E1157 PolarHBondContact O-N 3.06Å; E1157-L1159 VanDerWaalsContact C-N 3.32Å; E1157-L1159 PolarHBondContact O-N 3.04Å; E1157-R1160 WeakPolarHBondContact O-CB 3.38Å; E1157-R1160 PolarHBondContact O-N 3.19Å; E1157-M1161 PolarHBondContact O-N 2.94Å
1158	R	91	Very high	77.3	Confident	169 Å²	169	110.1 Å²	110.1	64%	0.638	60%	0.597	S	S	*	*	H	α-helix	trans	-55.3	-47.6	172.4	-73.1	167.5	-171.4	-119.7	4.4	111.3	E1154 E1155 R1160 M1161 E1162	E1154-R1158 WeakPolarHBondContact O-CB 3.43Å; E1154-R1158 VanDerWaalsContact O-CG 3.22Å; E1154-R1158 WeakPolarHBondContact O-CG 3.35Å; E1154-R1158 PolarHBondContact O-N 3.48Å; E1155-R1158 PolarHBondContact O-N 3.06Å; R1158-R1160 VanDerWaalsContact C-N 3.28Å; R1158-R1160 PolarHBondContact O-N 3.3Å; R1158-M1161 PolarHBondContact O-N 3.34Å; R1158-M1161 VanDerWaalsContact O-N 3.12Å; R1158-E1162 WeakPolarHBondContact O-CG 3.22Å; R1158-E1162 PolarHBondContact O-N 3.25Å
1159	L	87	Confident	75.1	Confident	106 Å²	106	113.5 Å²	113.5	56%	0.555	62%	0.615	S	S	*	*	H	α-helix	trans	-64.9	-28.6	177.4	-69.9	170.3	0	0	0	113.1	E1155 E1157 G1163	E1155-L1159 HydrophobicContact CG-CD1 4.19Å; E1155-L1159 WeakPolarHBondContact O-CB 3.49Å; E1155-L1159 VanDerWaalsContact O-CG 3.29Å; E1155-L1159 WeakPolarHBondContact O-CG 3.45Å; E1155-L1159 PolarHBondContact O-N 3.1Å; E1157-L1159 VanDerWaalsContact C-N 3.32Å; E1157-L1159 PolarHBondContact O-N 3.04Å; L1159-G1163 PolarHBondContact O-N 3.21Å
1160	R	85.4	Confident	72.5	Confident	194 Å²	194	111.5 Å²	111.5	73%	0.732	61%	0.608	S	S	*	*	H	α-helix	trans	-71.6	-37.8	171.2	-73.9	164.8	-179.4	-174	2.2	112.2	A1156 E1157 R1158 S1164	A1156-R1160 WeakPolarHBondContact O-CD 3.42Å; A1156-R1160 WeakPolarHBondContact O-CG 3.4Å; A1156-R1160 PolarHBondContact O-N 3.02Å; E1157-R1160 WeakPolarHBondContact O-CB 3.38Å; E1157-R1160 PolarHBondContact O-N 3.19Å; R1158-R1160 VanDerWaalsContact C-N 3.28Å; R1158-R1160 PolarHBondContact O-N 3.3Å; R1160-S1164 PolarHBondContact O-N 3.04Å; R1160-S1164 PolarHBondContact O-OG 3.33Å
1161	M	75.8	Confident	70.6	Confident	133 Å²	133	111.2 Å²	111.2	66%	0.655	61%	0.607	S	S	*	*	H	α-helix	trans	-73.7	-43.4	176.5	-68.9	-154	177.6	0	0	112.5	E1157 R1158 G1163 S1164	E1157-M1161 PolarHBondContact O-N 2.94Å; R1158-M1161 PolarHBondContact O-N 3.34Å; R1158-M1161 VanDerWaalsContact O-N 3.12Å; M1161-G1163 VanDerWaalsContact C-N 3.32Å; M1161-G1163 PolarHBondContact O-N 3.13Å; M1161-S1164 WeakPolarHBondContact CA-OG 3.35Å; M1161-S1164 PolarHBondContact O-N 3.4Å; M1161-S1164 PolarHBondContact O-OG 3.21Å
1162	E	64.7	Low	68	Low	152 Å²	152	113.6 Å²	113.6	71%	0.71	62%	0.616	S	S	*	*	H	α-helix	trans	-63.7	-39	173.9	-69.8	-178.8	164.2	0	0	111.3	R1158 S1164 G1165	R1158-E1162 WeakPolarHBondContact O-CG 3.22Å; R1158-E1162 PolarHBondContact O-N 3.25Å; E1162-S1164 PolarHBondContact O-N 3.16Å; E1162-G1165 PolarHBondContact O-N 3.31Å
1163	G	58.8	Low	65.4	Low	65 Å²	65	111.1 Å²	111.1	67%	0.67	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-12.7	175.4	0	0	0	0	0	115.7	L1159 M1161	L1159-G1163 PolarHBondContact O-N 3.21Å; M1161-G1163 VanDerWaalsContact C-N 3.32Å; M1161-G1163 PolarHBondContact O-N 3.13Å
1164	S	56	Low	62.4	Low	85 Å²	85	109.6 Å²	109.6	59%	0.594	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-3.5	-178.7	40.4	0	0	0	0	114.8	R1160 M1161 E1162 G1166	R1160-S1164 PolarHBondContact O-N 3.04Å; R1160-S1164 PolarHBondContact O-OG 3.33Å; M1161-S1164 WeakPolarHBondContact CA-OG 3.35Å; M1161-S1164 PolarHBondContact O-N 3.4Å; M1161-S1164 PolarHBondContact O-OG 3.21Å; E1162-S1164 PolarHBondContact O-N 3.16Å; S1164-G1166 PolarHBondContact O-N 3.46Å; S1164-G1166 VanDerWaalsContact O-N 3.15Å
1165	G	48.1	Very low	59.3	Low	77 Å²	77	109 Å²	109	79%	0.794	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-3.7	171.8	0	0	0	0	0	115.5	E1162	E1162-G1165 PolarHBondContact O-N 3.31Å
1166	G	46.1	Very low	56.3	Low	76 Å²	76	107 Å²	107	78%	0.784	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	9.6	-164.7	0	0	0	0	0	118.2	S1164	S1164-G1166 PolarHBondContact O-N 3.46Å; S1164-G1166 VanDerWaalsContact O-N 3.15Å
1167	A	41.6	Very low	53.4	Low	100 Å²	100	116.6 Å²	116.6	83%	0.826	68%	0.679	S	S	*	*			trans	-143.5	102.9	-176.1	0	0	0	0	0	113.6
1168	G	43.9	Very low	50.6	Low	69 Å²	69	119.5 Å²	119.5	71%	0.711	69%	0.692	S	S	*	*			trans	-125.1	139.5	-177.5	0	0	0	0	0	115.3
1169	K	44.7	Very low	47.6	Very low	183 Å²	183	114.8 Å²	114.8	80%	0.796	70%	0.696	S	S	*	*			trans	76.4	148.3	169.9	-46.3	168.1	-177.7	167.6	0	114
1170	N	37.7	Very low	44.9	Very low	66 Å²	66	119.3 Å²	119.3	35%	0.353	72%	0.715	S	S	.	*			cis	-120.3	176.6	18	-62.8	-14.7	0	0	0	113.1	M1194 V1196	N1170-M1194 HydrophobicContact CB-CB 3.9Å; N1170-M1194 HydrophobicContact CB-CE 3.72Å; N1170-M1194 HydrophobicContact CB-CG 3.98Å; N1170-M1194 WeakPolarHBondContact ND2-CE 3.4Å; N1170-V1196 HydrophobicContact CB-CG2 3.49Å; N1170-V1196 VanDerWaalsContact CB-CG2 3.49Å; N1170-V1196 WeakPolarHBondContact OD1-CG2 3.06Å
1171	R	53.1	Low	42.6	Very low	144 Å²	144	119 Å²	119	54%	0.543	72%	0.722	S	S	.	*			trans	-86.3	-161.9	-177.4	-61.8	169.6	66.8	179.2	9.7	112.6	M1194 N1195 P1197	R1171-M1194 CarbonylContact O-C 3.45Å; R1171-N1195 CarbonylContact C-O 3.57Å; R1171-N1195 WeakPolarHBondContact CA-O 3.49Å; R1171-N1195 VanDerWaalsContact CB-O 3.3Å; R1171-N1195 WeakPolarHBondContact CB-O 3.42Å; R1171-N1195 PolarHBondContact N-O 2.71Å; R1171-N1195 PolarHBondContact O-N 3.48Å; R1171-P1197 PolarHBondContact NH1-O 3.08Å
1172	K	39.3	Very low	40.5	Very low	136 Å²	136	120.4 Å²	120.4	59%	0.591	73%	0.732	S	S	*	*				-144.7	-154.3	95	-167.1	-121.5	167	-162.2	0	111.8	S1174 N1195	K1172-S1174 PolarHBondContact NZ-OG 3.04Å; K1172-S1174 VanDerWaalsContact NZ-OG 3.08Å; K1172-N1195 WeakPolarHBondContact CA-O 3.48Å; K1172-N1195 PolarHBondContact N-O 2.82Å
1173	T	38.1	Very low	38.9	Very low	69 Å²	69	121.7 Å²	121.7	42%	0.423	74%	0.738	S	S	.	*			trans	-156.1	125.6	-169.8	49.4	0	0	0	0	112.8	P1197	T1173-P1197 HydrophobicContact CG2-CG 4.1Å
1174	S	30.5	Very low	37.5	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	74%	0.738	S	S	*	*			trans	164.7	131.4	149.4	46.6	0	0	0	0	109.7	K1172	K1172-S1174 PolarHBondContact NZ-OG 3.04Å; K1172-S1174 VanDerWaalsContact NZ-OG 3.08Å
1175	G	28.8	Very low	36.3	Very low	85 Å²	85	128.3 Å²	128.3	88%	0.876	74%	0.743	S	S	*	*			cis	147.4	111.2	-12.9	0	0	0	0	0	113.8
1176	G	29.5	Very low	35.4	Very low	79 Å²	79	133 Å²	133	81%	0.814	74%	0.744	S	S	*	*			trans	122.2	137	157.7	0	0	0	0	0	118
1177	R	29.6	Very low	34.5	Very low	240 Å²	240	135.1 Å²	135.1	91%	0.906	74%	0.742	S	S	*	*			trans	90.1	151.2	158.1	-138.5	166.1	-170.2	166	1.1	119.9
1178	E	33.2	Very low	33.9	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.813	74%	0.74	S	S	*	*			trans	-91.4	163	-166.9	-46.6	100.1	143	0	0	114.6
1179	G	28.4	Very low	33.2	Very low	70 Å²	70	140.8 Å²	140.8	72%	0.722	75%	0.749	S	S	*	*			trans	154.5	92.1	163.3	0	0	0	0	0	116.9
1180	E	30.4	Very low	32.5	Very low	201 Å²	201	135.8 Å²	135.8	94%	0.939	74%	0.743	S	S	*	*			trans	49.8	-168.2	143	-67.7	172.7	153.4	0	0	120.9
1181	E	37.1	Very low	32.1	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	77%	0.771	S	S	*	*			trans	-108.3	-175.2	-154.4	-57.3	179.1	131.9	0	0	113.7
1182	D	30.3	Very low	31.2	Very low	161 Å²	161	149.3 Å²	149.3	86%	0.861	79%	0.789	S	S	*	*			trans	108.5	170.4	167.7	-68.5	-18.7	0	0	0	120
1183	E	30.8	Very low	30.8	Very low	180 Å²	180	149.8 Å²	149.8	84%	0.841	80%	0.803	S	S	*	*			trans	-101.8	161.6	-142.7	-47.9	179.8	111.7	0	0	117.2
1184	D	31.3	Very low	30.5	Very low	127 Å²	127	151.6 Å²	151.6	68%	0.679	81%	0.808	S	S	*	*			trans	85	148.6	136.1	-136.7	7.8	0	0	0	123.5
1185	K	30.6	Very low	30.3	Very low	162 Å²	162	151.1 Å²	151.1	70%	0.704	80%	0.797	S	S	*	*			trans	65	108.3	162	-58.2	-171.3	-177.9	66.2	0	124.1
1186	E	28.6	Very low	30.7	Very low	174 Å²	174	149.8 Å²	149.8	81%	0.813	77%	0.771	S	S	*	*				58.9	136.7	117.2	-124.8	-171.4	156.8	0	0	125.3
1187	T	28.1	Very low	30.7	Very low	121 Å²	121	148.7 Å²	148.7	74%	0.742	75%	0.75	S	S	*	*			trans	89.8	120.8	154	69	0	0	0	0	124
1188	A	28.3	Very low	31.1	Very low	95 Å²	95	143 Å²	143	79%	0.785	74%	0.742	S	S	*	*			trans	72.4	106.8	132	0	0	0	0	0	125.4
1189	E	28.9	Very low	31.1	Very low	193 Å²	193	144.9 Å²	144.9	90%	0.902	74%	0.741	S	S	*	*			trans	74.6	126.1	130	-115.2	-165.8	141.2	0	0	125.9
1190	A	29.9	Very low	31.1	Very low	79 Å²	79	148.3 Å²	148.3	65%	0.653	74%	0.739	S	S	*	*				108.9	121.6	128.5	0	0	0	0	0	123.4
1191	R	30.1	Very low	31.2	Very low	251 Å²	251	142.9 Å²	142.9	95%	0.947	73%	0.728	S	S	*	*			trans	84.8	167.6	151.7	-67.6	176.5	178.2	178.1	0.7	120.2
1192	R	34	Very low	30.7	Very low	242 Å²	242	144 Å²	144	91%	0.913	73%	0.73	S	S	*	*			trans	-131.2	159	-151.7	-54.7	172.9	177.2	170.6	-3.1	113.1
1193	V	29.8	Very low	31.1	Very low	147 Å²	147	142.9 Å²	142.9	89%	0.891	73%	0.73	S	S	*	*				167.5	163.3	127.8	154.6	0	0	0	0	112.4
1194	M	32.8	Very low	31.2	Very low	107 Å²	107	139 Å²	139	53%	0.527	73%	0.728	S	S	.	*			trans	-108.5	154	-158.4	-84.8	152.2	57.7	0	0	116.6	N1170 R1171	N1170-M1194 HydrophobicContact CB-CB 3.9Å; N1170-M1194 HydrophobicContact CB-CE 3.72Å; N1170-M1194 HydrophobicContact CB-CG 3.98Å; N1170-M1194 WeakPolarHBondContact ND2-CE 3.4Å; R1171-M1194 CarbonylContact O-C 3.45Å
1195	N	26.6	Very low	32.1	Very low	98 Å²	98	138.8 Å²	138.8	52%	0.524	73%	0.734	S	S	.	*			trans	-165.2	158.9	133.8	-126.4	-33.2	0	0	0	117.3	R1171 K1172	R1171-N1195 CarbonylContact C-O 3.57Å; R1171-N1195 WeakPolarHBondContact CA-O 3.49Å; R1171-N1195 VanDerWaalsContact CB-O 3.3Å; R1171-N1195 WeakPolarHBondContact CB-O 3.42Å; R1171-N1195 PolarHBondContact N-O 2.71Å; R1171-N1195 PolarHBondContact O-N 3.48Å; K1172-N1195 WeakPolarHBondContact CA-O 3.48Å; K1172-N1195 PolarHBondContact N-O 2.82Å
1196	V	36.2	Very low	32.3	Very low	56 Å²	56	138.2 Å²	138.2	34%	0.339	74%	0.744	S	S	.	*			trans	-82.8	152.1	-172.3	-169.9	0	0	0	0	113.6	N1170 T1198	N1170-V1196 HydrophobicContact CB-CG2 3.49Å; N1170-V1196 VanDerWaalsContact CB-CG2 3.49Å; N1170-V1196 WeakPolarHBondContact OD1-CG2 3.06Å; V1196-T1198 WeakPolarHBondContact CG1-OG1 3Å
1197	P	30.2	Very low	32.8	Very low	57 Å²	57	133.9 Å²	133.9	37%	0.37	75%	0.746	S	S	.	*				-125.8	146.5	126.1	-2.2	22.7	0	0	0	115.5	R1171 T1173	R1171-P1197 PolarHBondContact NH1-O 3.08Å; T1173-P1197 HydrophobicContact CG2-CG 4.1Å
1198	T	37.2	Very low	33	Very low	119 Å²	119	131.8 Å²	131.8	73%	0.73	75%	0.749	S	S	*	*			trans	-138.5	137.4	178.6	-56.5	0	0	0	0	109.5	V1196	V1196-T1198 WeakPolarHBondContact CG1-OG1 3Å
1199	R	34.2	Very low	33.7	Very low	214 Å²	214	133.6 Å²	133.6	81%	0.808	75%	0.75	S	S	*	*			trans	162.5	152.3	161.4	-93	171.6	179.1	-110.1	7.9	106.7
1200	Q	26.8	Very low	34.1	Very low	142 Å²	142	132 Å²	132	66%	0.664	75%	0.746	S	S	*	*			cis	-149.8	125	-16	-115.7	160.9	-62.6	0	0	104.9
1201	A	33.8	Very low	34.5	Very low	87 Å²	87	134.4 Å²	134.4	72%	0.719	75%	0.753	S	S	*	*				63.9	115.6	85.7	0	0	0	0	0	114.8
1202	F	26.9	Very low	35.1	Very low	211 Å²	211	128.9 Å²	128.9	93%	0.925	75%	0.746	S	S	*	*			trans	-145	133.5	157	-121	-85.1	0	0	0	108.7
1203	T	37.3	Very low	35.2	Very low	139 Å²	139	122.4 Å²	122.4	85%	0.853	74%	0.738	S	S	*	*			trans	-153.9	128.5	-178.7	48	0	0	0	0	110
1204	A	34.5	Very low	35.7	Very low	97 Å²	97	121.2 Å²	121.2	80%	0.802	73%	0.734	S	S	*	*			trans	-146.5	152.7	169.2	0	0	0	0	0	110.2
1205	P	50.2	Low	35.9	Very low	123 Å²	123	127.2 Å²	127.2	80%	0.799	75%	0.752	S	S	*	*			trans	-135.1	155.9	-144.2	39.8	-22.8	0	0	0	117.6
1206	T	34.8	Very low	36.4	Very low	151 Å²	151	126.7 Å²	126.7	93%	0.926	76%	0.761	S	S	*	*			trans	-158.1	148.7	146.9	31.7	0	0	0	0	107.9
1207	G	37.8	Very low	36.9	Very low	82 Å²	82	132 Å²	132	85%	0.845	79%	0.787	S	S	*	*			cis	152.9	63.2	-0.4	0	0	0	0	0	112.4
1208	G	33.3	Very low	37.3	Very low	78 Å²	78	135.9 Å²	135.9	80%	0.804	81%	0.809	S	S	*	*			trans	-153	146.5	-178.8	0	0	0	0	0	112.2
1209	V	42.8	Very low	37.3	Very low	132 Å²	132	138.8 Å²	138.8	80%	0.8	81%	0.814	S	S	*	*			trans	-109.6	138.3	-165.8	177.3	0	0	0	0	112
1210	I	36.4	Very low	37.5	Very low	160 Å²	160	135.2 Å²	135.2	82%	0.821	82%	0.816	S	S	*	*			trans	-117.5	118.9	159.7	-61.9	178.3	0	0	0	107.9
1211	T	38.6	Very low	38	Very low	130 Å²	130	135 Å²	135	80%	0.798	82%	0.824	S	S	*	*			trans	-82.6	132.5	179	-19.4	0	0	0	0	110.5
1212	V	42.9	Very low	38.1	Very low	134 Å²	134	133.4 Å²	133.4	81%	0.812	82%	0.816	S	S	*	*			trans	-108.6	133.7	174.1	-176.9	0	0	0	0	109.5
1213	S	37	Very low	38.8	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	81%	0.81	S	S	*	*			trans	-130.8	139.8	169.1	55.9	0	0	0	0	109.9
1214	P	40.1	Very low	38.7	Very low	123 Å²	123	133.6 Å²	133.6	80%	0.799	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-81.5	146.3	-161.8	31.9	-36.6	0	0	0	114
1215	Y	35.8	Very low	39	Very low	233 Å²	233	136.3 Å²	136.3	91%	0.914	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-74	122	160.6	-117.5	-89.2	0	0	0	109.4
1216	A	38.2	Very low	38.3	Very low	86 Å²	86	140.1 Å²	140.1	71%	0.711	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-76.8	138.4	174.7	0	0	0	0	0	111
1217	L	45.6	Very low	38.2	Very low	169 Å²	169	143.8 Å²	143.8	89%	0.885	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-74.3	137.8	164.9	-85.6	78.5	0	0	0	109.9
1218	T	38	Very low	38.1	Very low	137 Å²	137	148.3 Å²	148.3	84%	0.84	83%	0.828	S	S	*	*			trans	-129.9	149.3	155.1	46.7	0	0	0	0	110.3
1219	H	38.4	Very low	38.3	Very low	181 Å²	181	151.9 Å²	151.9	84%	0.838	83%	0.83	S	S	*	*			trans	-69.7	148.7	-168.8	-101	-139.4	0	0	0	114.1
1220	V	38.4	Very low	38.1	Very low	139 Å²	139	152.9 Å²	152.9	84%	0.842	83%	0.831	S	S	*	*			trans	-81.2	121.7	156.8	177.6	0	0	0	0	109.1
1221	T	37	Very low	38.2	Very low	136 Å²	136	152.5 Å²	152.5	83%	0.834	83%	0.832	S	S	*	*			trans	-98.3	105.4	171.3	51.6	0	0	0	0	110.2
1222	G	36.9	Very low	38.2	Very low	54 Å²	54	153.8 Å²	153.8	56%	0.557	83%	0.834	S	S	*	*			trans	-172.6	146.2	177.9	0	0	0	0	0	113.3	Y1224	G1222-Y1224 PolarHBondContact O-N 2.58Å; G1222-Y1224 VanDerWaalsContact O-N 3.09Å
1223	P	39.8	Very low	37.9	Very low	123 Å²	123	155.1 Å²	155.1	80%	0.799	84%	0.835	S	S	*	*			trans	-89.2	72.8	-163.9	36.1	-37.6	0	0	0	114.2
1224	Y	36.3	Very low	37.9	Very low	232 Å²	232	158.3 Å²	158.3	91%	0.91	84%	0.841	S	S	*	*			trans	-123.3	64	164.5	-70.2	-68.1	0	0	0	111.6	G1222	G1222-Y1224 PolarHBondContact O-N 2.58Å; G1222-Y1224 VanDerWaalsContact O-N 3.09Å
1225	N	41.6	Very low	37.8	Very low	154 Å²	154	160.9 Å²	160.9	82%	0.824	84%	0.844	S	S	*	*			trans	-137.1	149.4	172.7	-148.5	-18.2	0	0	0	108
1226	R	34.2	Very low	37.9	Very low	203 Å²	203	155.3 Å²	155.3	77%	0.766	84%	0.839	S	S	*	*			trans	78.2	107.6	-156	-50.3	-179.9	-179.2	-111.9	-2.9	111.2
1227	W	32.2	Very low	37.9	Very low	228 Å²	228	161.1 Å²	161.1	86%	0.864	85%	0.85	S	S	*	*				80.7	153.2	86.9	-89.5	-48	0	0	0	113.4
1228	S	36.5	Very low	37.2	Very low	177 Å²	177	160.4 Å²	160.4	100%	1.238	85%	0.846	S	S	*	*			cis	-155	0	-2	48.2	0	0	0	0	109.7

Retrieved 1,228 of 1,228 residues in 148.8 ms (Link to these results)

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