A0A5K4F5Z2_SCHMA Loading...

Putative guanine-nucleotide-exchange-factor

AlphaFold DB , UniProt , Accession A0A5K4F5Z2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,302 aa.

						>A0A5K4F5Z2_SCHMA|A0A5K4F5Z2
MVDELNMKSASSIYQATGNTNSNDIISQDFESNQSLERNIATGTSENKVKEEVSDTGADTDESDDDTIEEGEEIITSAIPPTQIVDTIVTTTTNPDGSLKRTTKKTTRTVLTTARIRKVRLKNLSANSDSNQSSSYSKNHPDMKNIINFTKFNSEKSDGNSLAQATLAIIPPQTEVIYQENVKPISDIDPDTIAQLKQSPDSVTSQQAITKTTMKKTVSATAATATFYATGSEVINPNIFTSNQSTGEVTSKISNNIKKLKDCNQPFSLSSTNEKNKTNSNESSRQVANGNEINSIEINDNNMSMKKNDCEFARTITTRTVTTTHSSGSATTTTTTTTTTMDNDNNNSTRQQTTRVTNNFASKRFFFTFKKPFSLFSKDIRTAIEDGQTNQNTDLNKTDIVDTEQLALMTMKESERMFSEAKSMFASNQTLTSDKVSQSRGSKSNNEINIYSRNDDGIVQGYQSRFANLPLYQGYGIIAHQIALSNKANTAKKSTPETQNIDDDHNGNDQETSINLVSDPIDIGQISDQSGTDINLVANAFAHLLDESILKFLYEATNQQLVRSGSLNLFDLPAYISGLPQNKELSLSGSTDEGTVHQEIDNYDISSNLSDYNDDKNEEEFQQKQRTSNLREIQGSKSVSEGLCQKTSRFGVGAQGAFRVAWSEMPEVVESNCLQRLTRHEIQLQEAMFEVITSEASYYQSLNVLVNHFYHAPEFECEPLHSSVQGSQIINKTGKDCYSPQNYTTGQQDVINTNDQVLSEPSTPLVNTVPIGPTSAYSTNTVINNNTDFTDFCSDLNNTNNQTTTRHPLLKPLEKHHLFSNVLLVCLASEMFLRDLEARWESRMPILNEVCDLIVKHAGGVNFEPYITYLRNQTYQMATLRNLCRRDSFRSALDNLHAHPRSGKNMINSFLALPMQRLTRLKLLVEVIRRLQDAVVRDSKDKTLEKRPFRVPSDRERENVQLALRELNRLLTASETEKELMDRKSRLLTLSSSLEFPDNVKRIAISDKRLIKEGELRECLTDNGRMSVFQKLTIRKPNTFYLILFNDMLLVTKKKKNERFLVLDYCDRASVQPLVQRSGDPFNSGTNLLKNPKNSISAEPLCHINLSNDDLKVVPQKSKRFLSPESEDDVNILKSRTKTKRHRHFKTTVDFKNVIDLNNNDNKDETNRILSHIETNESNKECSSLDDHNDINNVANISTTDTNTTTKAANSLVTSSVNTSKITKLSRSGSSLSGYQLRFNQEKNRHLKPSIFNTSQPSTPVNCKTNIIHLKLLGSHNGTCTELTLSSNDNQEFESWCKAFSV
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.9	Very low	30.6	Very low	182 Å²	182	102.7 Å²	102.7	90%	0.897	57%	0.565	S	S	*	*				0	-52	0	-85.6	-175.5	170.6	0	0	113	D3 E4	M1-D3 PolarHBondContact O-N 3.43Å; M1-E4 WeakPolarHBondContact O-CB 3.32Å; M1-E4 PolarHBondContact O-N 2.87Å
2	V	26.9	Very low	30.5	Very low	107 Å²	107	103 Å²	103	65%	0.648	58%	0.58	S	S	*	*	H	α-helix	trans	-53.6	-46.7	-175	-170.5	0	0	0	0	113.6	E4 L5	V2-E4 PolarHBondContact O-N 3.02Å; V2-E4 VanDerWaalsContact O-N 3.08Å; V2-L5 PolarHBondContact O-N 2.93Å; V2-L5 VanDerWaalsContact O-N 3.1Å
3	D	29.3	Very low	30.5	Very low	66 Å²	66	105.9 Å²	105.9	35%	0.353	59%	0.591	S	S	.	*	H	α-helix	trans	-51.3	-32.6	175.8	-70.6	14.2	0	0	0	114	M1 Y178 K216	M1-D3 PolarHBondContact O-N 3.43Å; D3-Y178 PolarHBondContact OD1-OH 3.42Å; D3-Y178 PolarHBondContact OD2-OH 2.85Å; D3-K216 IonicContact OD2-NZ 3.66Å; D3-K216 PolarHBondContact OD2-NZ 2.98Å
4	E	32.9	Very low	30.2	Very low	112 Å²	112	112.6 Å²	112.6	52%	0.523	61%	0.605	S	S	.	*	H	α-helix	trans	-83.6	-19.9	-174.2	-145.8	-167.1	139.9	0	0	112.8	M1 V2 K8	M1-E4 WeakPolarHBondContact O-CB 3.32Å; M1-E4 PolarHBondContact O-N 2.87Å; V2-E4 PolarHBondContact O-N 3.02Å; V2-E4 VanDerWaalsContact O-N 3.08Å; E4-K8 WeakPolarHBondContact O-CD 3.45Å; E4-K8 WeakPolarHBondContact O-CG 3.32Å; E4-K8 WeakPolarHBondContact OE1-CE 3.34Å; E4-K8 IonicContact OE1-NZ 2.99Å; E4-K8 PolarHBondContact OE1-NZ 3.42Å
5	L	36	Very low	29.9	Very low	77 Å²	77	116.4 Å²	116.4	40%	0.403	62%	0.617	S	S	.	*	H	α-helix	trans	-84.7	-35	179.8	-69.9	166.9	0	0	0	112	V2 M7 K8 S9	V2-L5 PolarHBondContact O-N 2.93Å; V2-L5 VanDerWaalsContact O-N 3.1Å; L5-M7 VanDerWaalsContact C-N 3.32Å; L5-M7 PolarHBondContact O-N 3.31Å; L5-K8 PolarHBondContact O-N 3.33Å; L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 3.49Å; L5-S9 PolarHBondContact O-OG 3.49Å
6	N	30.9	Very low	29.7	Very low	121 Å²	121	115.4 Å²	115.4	65%	0.647	63%	0.63	S	S	*	*	H	α-helix	trans	-64.7	-34.8	175.1	-88.6	-11.4	0	0	0	112.5	A10	N6-A10 PolarHBondContact O-N 3.31Å
7	M	30.6	Very low	29.8	Very low	140 Å²	140	115.8 Å²	115.8	69%	0.69	64%	0.637	S	S	*	*	H	α-helix	trans	-68.4	-40.1	174	-71.5	-97.7	64.4	0	0	112.4	L5 S11	L5-M7 VanDerWaalsContact C-N 3.32Å; L5-M7 PolarHBondContact O-N 3.31Å; M7-S11 PolarHBondContact O-N 3.38Å
8	K	30.9	Very low	29.8	Very low	115 Å²	115	113.9 Å²	113.9	50%	0.5	65%	0.649	S	S	.	*	H	α-helix	trans	-72.8	-38.1	-178.8	-68.5	172.8	-170	177.7	0	112.4	E4 L5 A10 S11	E4-K8 WeakPolarHBondContact O-CD 3.45Å; E4-K8 WeakPolarHBondContact O-CG 3.32Å; E4-K8 WeakPolarHBondContact OE1-CE 3.34Å; E4-K8 IonicContact OE1-NZ 2.99Å; E4-K8 PolarHBondContact OE1-NZ 3.42Å; L5-K8 PolarHBondContact O-N 3.33Å; K8-A10 VanDerWaalsContact C-N 3.33Å; K8-A10 PolarHBondContact O-N 2.58Å; K8-S11 PolarHBondContact O-N 3.37Å
9	S	28.9	Very low	29.7	Very low	83 Å²	83	116.3 Å²	116.3	58%	0.58	66%	0.659	S	S	*	*	H	α-helix	trans	-64.3	-36	177.4	-54.4	0	0	0	0	112.4	L5	L5-S9 WeakPolarHBondContact O-CB 3.47Å; L5-S9 PolarHBondContact O-N 3.49Å; L5-S9 PolarHBondContact O-OG 3.49Å
10	A	27.9	Very low	29.8	Very low	67 Å²	67	117 Å²	117	55%	0.554	67%	0.666	S	S	*	*	H	α-helix	trans	-73	-24.4	175.9	0	0	0	0	0	114	N6 K8	N6-A10 PolarHBondContact O-N 3.31Å; K8-A10 VanDerWaalsContact C-N 3.33Å; K8-A10 PolarHBondContact O-N 2.58Å
11	S	30	Very low	29.8	Very low	60 Å²	60	118.6 Å²	118.6	42%	0.42	67%	0.673	S	S	.	*	H	α-helix	trans	-85.1	-20.2	-173.4	-164.3	0	0	0	0	114.6	M7 K8 I13 Y14	M7-S11 PolarHBondContact O-N 3.38Å; K8-S11 PolarHBondContact O-N 3.37Å; S11-I13 PolarHBondContact O-N 3.45Å; S11-I13 VanDerWaalsContact O-N 3.15Å; S11-Y14 PolarHBondContact O-N 3.16Å
12	S	29.2	Very low	29.6	Very low	106 Å²	106	115.6 Å²	115.6	74%	0.741	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-7.5	-176.7	-68.1	0	0	0	0	114.3
13	I	29.9	Very low	29.6	Very low	141 Å²	141	118 Å²	118	72%	0.723	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-7.8	177.8	-63.5	174.8	0	0	0	111.7	S11	S11-I13 PolarHBondContact O-N 3.45Å; S11-I13 VanDerWaalsContact O-N 3.15Å
14	Y	27.3	Very low	29.6	Very low	200 Å²	200	122.1 Å²	122.1	78%	0.784	70%	0.701	S	S	*	*	S	Bend	trans	-133.6	53	-173.9	-93.7	-81.4	0	0	0	113.9	S11	S11-Y14 PolarHBondContact O-N 3.16Å
15	Q	25.5	Very low	29.4	Very low	169 Å²	169	123.2 Å²	123.2	79%	0.79	71%	0.709	S	S	*	*			trans	-159.5	105.7	165.9	-118.1	144.1	94	0	0	113
16	A	26	Very low	28.8	Very low	100 Å²	100	127 Å²	127	83%	0.826	73%	0.728	S	S	*	*			trans	-150.5	29.5	178.9	0	0	0	0	0	114.2
17	T	31.6	Very low	28.6	Very low	122 Å²	122	126.8 Å²	126.8	75%	0.748	74%	0.736	S	S	*	*	S	Bend	trans	-151.2	124.7	174.1	49.3	0	0	0	0	112.7
18	G	30.2	Very low	28.3	Very low	82 Å²	82	129.1 Å²	129.1	85%	0.845	75%	0.745	S	S	*	*			trans	97.6	107.9	155.9	0	0	0	0	0	117.4
19	N	27.4	Very low	28.1	Very low	160 Å²	160	131.2 Å²	131.2	86%	0.856	76%	0.762	S	S	*	*			trans	-88.8	149.1	158.1	-99.2	-18.4	0	0	0	109.7
20	T	32.7	Very low	28	Very low	130 Å²	130	136.7 Å²	136.7	80%	0.798	78%	0.776	S	S	*	*				175.6	117.5	110.9	39.5	0	0	0	0	113.1
21	N	28.6	Very low	27.9	Very low	151 Å²	151	141.8 Å²	141.8	81%	0.807	79%	0.788	S	S	*	*			trans	38.6	140.9	140.7	-70	4	0	0	0	125.2
22	S	28.5	Very low	27.6	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	81%	0.807	S	S	*	*			trans	88.6	137.9	147.8	-62.7	0	0	0	0	119.1
23	N	27.6	Very low	27.5	Very low	158 Å²	158	146.6 Å²	146.6	85%	0.845	81%	0.81	S	S	*	*			trans	-101.2	152.8	-179.2	-43.4	-90	0	0	0	109.8
24	D	29.4	Very low	27.4	Very low	151 Å²	151	149.8 Å²	149.8	81%	0.807	82%	0.822	S	S	*	*			trans	-154.1	147.4	143.7	-110.1	-31.2	0	0	0	113.8
25	I	27.8	Very low	27.3	Very low	136 Å²	136	144 Å²	144	70%	0.697	81%	0.811	S	S	*	*			trans	50.9	104.9	148.6	-57.9	165.8	0	0	0	120.3
26	I	24.4	Very low	27.4	Very low	156 Å²	156	144.7 Å²	144.7	80%	0.8	82%	0.819	S	S	*	*				36.5	127	125.7	-52.6	173.8	0	0	0	120.1	Q28	I26-Q28 PolarHBondContact O-N 3.25Å
27	S	26.4	Very low	27.4	Very low	116 Å²	116	146.9 Å²	146.9	81%	0.811	81%	0.812	S	S	*	*			trans	-25.7	104.2	160.8	-48.5	0	0	0	0	118.7
28	Q	24	Very low	27.2	Very low	189 Å²	189	151.1 Å²	151.1	88%	0.883	81%	0.814	S	S	*	*			trans	-150.7	173.3	136	-113.8	167.7	9.1	0	0	109.9	I26	I26-Q28 PolarHBondContact O-N 3.25Å
29	D	26.5	Very low	27.1	Very low	159 Å²	159	155.1 Å²	155.1	85%	0.85	82%	0.816	S	S	*	*			trans	82.8	73.8	-176.2	-61.6	-2.2	0	0	0	117.8
30	F	26.5	Very low	27.2	Very low	198 Å²	198	155.6 Å²	155.6	87%	0.868	82%	0.817	S	S	*	*			trans	-70.6	151.7	143.1	-110.6	-112.1	0	0	0	109.9
31	E	25.8	Very low	26.9	Very low	174 Å²	174	153.1 Å²	153.1	81%	0.813	81%	0.81	S	S	*	*			trans	57.4	85.9	165.6	-58.5	-168.6	142.2	0	0	118.8
32	S	24.7	Very low	26.7	Very low	116 Å²	116	153 Å²	153	81%	0.811	82%	0.815	S	S	*	*			trans	-169.9	94.3	133.1	-87.2	0	0	0	0	113.8
33	N	27.5	Very low	26.7	Very low	152 Å²	152	151.1 Å²	151.1	81%	0.813	81%	0.814	S	S	*	*			trans	-177.7	46.3	138.7	-94.6	-39.4	0	0	0	112.9	S35	N33-S35 PolarHBondContact OD1-OG 2.91Å
34	Q	27.1	Very low	26.6	Very low	207 Å²	207	150.3 Å²	150.3	97%	0.967	82%	0.815	S	S	*	*			trans	-89.5	89.9	152.1	-75.3	-170.8	10.4	0	0	107.9
35	S	25.1	Very low	26.5	Very low	79 Å²	79	148.3 Å²	148.3	55%	0.552	81%	0.813	S	S	*	*			trans	-157.3	34.4	-168.8	42.4	0	0	0	0	115.2	N33	N33-S35 PolarHBondContact OD1-OG 2.91Å
36	L	27.2	Very low	26.5	Very low	183 Å²	183	150.3 Å²	150.3	96%	0.958	82%	0.819	S	S	*	*			trans	-151.2	60.2	154.9	-144.5	82.6	0	0	0	114.1
37	E	27.5	Very low	26.5	Very low	147 Å²	147	149.9 Å²	149.9	69%	0.687	82%	0.819	S	S	*	*			trans	-113.7	140.4	160.2	-146.3	-165.5	-101.8	0	0	109.6
38	R	27.4	Very low	26.6	Very low	211 Å²	211	153.6 Å²	153.6	80%	0.796	82%	0.82	S	S	*	*			trans	68.8	107.8	173.2	-51.3	168	-152.9	154.1	13.7	116.6
39	N	26.8	Very low	26.7	Very low	165 Å²	165	150.1 Å²	150.1	88%	0.882	81%	0.811	S	S	*	*			trans	-155.9	96.3	137.5	-112.6	-30.4	0	0	0	112.6
40	I	30	Very low	26.7	Very low	171 Å²	171	150.1 Å²	150.1	88%	0.877	80%	0.804	S	S	*	*			trans	144.3	132.6	146.9	-75.8	163.2	0	0	0	108.8
41	A	25.8	Very low	26.7	Very low	78 Å²	78	146.9 Å²	146.9	65%	0.645	79%	0.792	S	S	*	*			trans	-145.9	173.5	-173.9	0	0	0	0	0	110.7
42	T	25.7	Very low	26.9	Very low	148 Å²	148	146.8 Å²	146.8	91%	0.908	79%	0.791	S	S	*	*			trans	66.1	129.2	163.4	56.1	0	0	0	0	118.6
43	G	28	Very low	27.2	Very low	80 Å²	80	147.2 Å²	147.2	83%	0.825	79%	0.788	S	S	*	*			trans	176.9	82.6	175.1	0	0	0	0	0	111.3
44	T	25.7	Very low	27.3	Very low	141 Å²	141	144.9 Å²	144.9	87%	0.865	78%	0.784	S	S	*	*			trans	-103.8	126.8	-170.4	45.6	0	0	0	0	114.1
45	S	27.8	Very low	27.6	Very low	108 Å²	108	141.4 Å²	141.4	76%	0.755	77%	0.772	S	S	*	*			trans	-178.3	110.4	149.7	54	0	0	0	0	108.7
46	E	26.5	Very low	27.9	Very low	179 Å²	179	143.5 Å²	143.5	84%	0.836	78%	0.782	S	S	*	*				78.1	108.7	79.9	-74.3	-165.7	153.2	0	0	116.2
47	N	25.1	Very low	28.1	Very low	147 Å²	147	138.8 Å²	138.8	79%	0.786	78%	0.778	S	S	*	*			trans	25.3	114.3	140.1	-57.7	-34.6	0	0	0	120.5
48	K	27.7	Very low	28.2	Very low	193 Å²	193	136.4 Å²	136.4	84%	0.839	78%	0.783	S	S	*	*				-177.4	118.4	105.9	-101.5	179.7	176.1	178.1	0	115.1
49	V	26.2	Very low	28.7	Very low	116 Å²	116	134.3 Å²	134.3	70%	0.703	79%	0.788	S	S	*	*				49.5	131.7	107.2	176.8	0	0	0	0	119.6
50	K	27.1	Very low	28.9	Very low	160 Å²	160	132.2 Å²	132.2	70%	0.696	78%	0.781	S	S	*	*			trans	75.4	149.1	160.2	-81.7	-177.5	179.2	-70.9	0	117.7
51	E	27.2	Very low	29	Very low	130 Å²	130	131.8 Å²	131.8	61%	0.607	78%	0.78	S	S	*	*			cis	-168	175.9	-22.6	-143.1	156.5	-135.6	0	0	108.8
52	E	29.3	Very low	29.4	Very low	171 Å²	171	136.7 Å²	136.7	80%	0.799	79%	0.79	S	S	*	*			trans	64.9	160.3	160.2	-68.2	176.7	166.6	0	0	118.9
53	V	31.7	Very low	29.7	Very low	125 Å²	125	135.5 Å²	135.5	76%	0.758	79%	0.788	S	S	*	*				-169.7	153.3	-54.4	127.9	0	0	0	0	107.5
54	S	28.5	Very low	29.9	Very low	104 Å²	104	139.7 Å²	139.7	73%	0.727	79%	0.791	S	S	*	*			trans	65.3	160.5	166.9	82.8	0	0	0	0	117.6
55	D	32.7	Very low	30.3	Very low	133 Å²	133	139.4 Å²	139.4	71%	0.711	78%	0.784	S	S	*	*			cis	-145.6	165.7	0.7	-149.7	23.1	0	0	0	116.3
56	T	31.3	Very low	30.5	Very low	124 Å²	124	141.4 Å²	141.4	76%	0.761	79%	0.786	S	S	*	*			trans	6.5	144.4	158.4	51.7	0	0	0	0	122.4
57	G	33.4	Very low	30.6	Very low	84 Å²	84	136.9 Å²	136.9	87%	0.866	77%	0.771	S	S	*	*			trans	157.6	77.2	162.5	0	0	0	0	0	114.3
58	A	29.6	Very low	30.8	Very low	96 Å²	96	136.9 Å²	136.9	79%	0.793	77%	0.77	S	S	*	*			trans	-98.8	145.2	172.9	0	0	0	0	0	111
59	D	36.1	Very low	30.9	Very low	168 Å²	168	134.6 Å²	134.6	90%	0.898	76%	0.762	S	S	*	*			trans	-156.2	163.8	135.5	-112.5	-33.5	0	0	0	110.7
60	T	31.7	Very low	31.1	Very low	121 Å²	121	135.8 Å²	135.8	74%	0.742	76%	0.76	S	S	*	*			trans	-102.2	147	-165.1	-41.2	0	0	0	0	111.8
61	D	32.5	Very low	31.3	Very low	162 Å²	162	132 Å²	132	87%	0.866	77%	0.766	S	S	*	*			trans	-168.2	163.5	135.3	-101.8	-17	0	0	0	112.3
62	E	32.9	Very low	31.4	Very low	181 Å²	181	134.1 Å²	134.1	85%	0.846	78%	0.776	S	S	*	*			trans	-84.1	146.9	-164.1	-54.6	175.4	129.4	0	0	115.1
63	S	32.5	Very low	31.6	Very low	123 Å²	123	132.2 Å²	132.2	86%	0.86	77%	0.767	S	S	*	*			trans	-172.2	142.2	141.7	17.7	0	0	0	0	113.3
64	D	32.8	Very low	31.6	Very low	168 Å²	168	131.3 Å²	131.3	90%	0.898	76%	0.757	S	S	*	*			trans	-82.4	130.1	173	-56.1	-86.8	0	0	0	113.2
65	D	33	Very low	32	Very low	135 Å²	135	130.3 Å²	130.3	72%	0.722	74%	0.742	S	S	*	*				174.2	123.9	129.4	-178.9	18.2	0	0	0	108.2	T67	D65-T67 PolarHBondContact OD1-OG1 3.38Å
66	D	32.1	Very low	32	Very low	149 Å²	149	128 Å²	128	80%	0.797	73%	0.733	S	S	*	*			trans	-143.7	104.8	164.5	-142.2	-21.2	0	0	0	112.5	I68	D66-I68 PolarHBondContact O-N 3.46Å
67	T	29.9	Very low	32.3	Very low	84 Å²	84	124.2 Å²	124.2	52%	0.515	71%	0.712	S	S	.	*			trans	-89.7	94.9	-174.2	-66.2	0	0	0	0	110.6	D65	D65-T67 PolarHBondContact OD1-OG1 3.38Å
68	I	29.1	Very low	32.5	Very low	148 Å²	148	123.8 Å²	123.8	76%	0.759	70%	0.7	S	S	*	*			trans	-87.4	126.2	176.7	-56.9	-180	0	0	0	111.2	D66	D66-I68 PolarHBondContact O-N 3.46Å
69	E	29.1	Very low	33.5	Very low	144 Å²	144	122.6 Å²	122.6	67%	0.673	68%	0.679	S	S	*	*			trans	-87.2	132.6	178	-56.1	-162.5	142.6	0	0	112.1	G71 K1036	E69-G71 PolarHBondContact O-N 2.88Å; E69-K1036 IonicContact OE1-NZ 2.72Å; E69-K1036 PolarHBondContact OE1-NZ 2.63Å
70	E	31.6	Very low	33.9	Very low	142 Å²	142	116 Å²	116	66%	0.664	65%	0.646	S	S	*	*			trans	-85.4	101.8	178.4	-72.3	176.3	-178.1	0	0	110.7	K122	E70-K122 WeakPolarHBondContact OE1-CE 3.46Å; E70-K122 IonicContact OE1-NZ 3.93Å; E70-K122 PolarHBondContact OE1-NZ 3.32Å; E70-K122 IonicContact OE2-NZ 3.57Å
71	G	29.5	Very low	34.7	Very low	79 Å²	79	112.6 Å²	112.6	81%	0.814	63%	0.626	S	S	*	*			trans	-81.8	126.5	173.5	0	0	0	0	0	113	E69	E69-G71 PolarHBondContact O-N 2.88Å
72	E	30.3	Very low	35.7	Very low	176 Å²	176	106.3 Å²	106.3	82%	0.822	59%	0.593	S	S	*	*			trans	-84.3	128.6	174.9	-64.4	-163.7	143.5	0	0	112.3
73	E	33.6	Very low	36.8	Very low	131 Å²	131	101.5 Å²	101.5	61%	0.612	57%	0.571	S	S	*	*			trans	-112.1	124.1	173.6	-172.9	179.8	-148.2	0	0	110.7	I75	E73-I75 HydrophobicContact CG-CG1 4.46Å; E73-I75 PolarHBondContact O-N 3.05Å
74	I	32.2	Very low	37.7	Very low	106 Å²	106	97.5 Å²	97.5	54%	0.544	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	99.9	-178.4	-56.6	176.5	0	0	0	110	T76 R115	I74-T76 PolarHBondContact O-N 3.5Å; I74-R115 HydrophobicContact CG2-CG 4.37Å
75	I	36.8	Very low	39	Very low	82 Å²	82	90.8 Å²	90.8	42%	0.421	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.9	174.6	-56.1	178.3	0	0	0	108.8	E73 I116	E73-I75 HydrophobicContact CG-CG1 4.46Å; E73-I75 PolarHBondContact O-N 3.05Å; I75-I116 PolarHBondContact O-N 2.93Å; I75-I116 VanDerWaalsContact O-O 3.14Å
76	T	31.3	Very low	40.1	Very low	86 Å²	86	85.9 Å²	85.9	53%	0.528	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.4	175	-51.3	0	0	0	0	109.1	I74 R115	I74-T76 PolarHBondContact O-N 3.5Å; T76-R115 HydrophobicContact CG2-CG 4.38Å
77	S	39.2	Very low	41.6	Very low	43 Å²	43	79.7 Å²	79.7	30%	0.301	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.1	176.5	59	0	0	0	0	110.7	I79 A114 I116	S77-I79 PolarHBondContact O-N 3.43Å; S77-A114 PolarHBondContact N-O 3.29Å; S77-A114 PolarHBondContact O-N 3.28Å; S77-I116 WeakPolarHBondContact OG-CD1 3.48Å
78	A	37.1	Very low	42.9	Very low	75 Å²	75	78.2 Å²	78.2	62%	0.62	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	128.3	166.8	0	0	0	0	0	109.2
79	I	49.8	Very low	44.7	Very low	71 Å²	71	72.4 Å²	72.4	36%	0.364	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	135	162.5	-61.8	176.7	0	0	0	105.6	S77 T112 A114	S77-I79 PolarHBondContact O-N 3.43Å; I79-T112 WeakPolarHBondContact CB-O 3.31Å; I79-T112 HydrophobicContact CD1-CG2 4.11Å; I79-T112 PolarHBondContact N-O 3.5Å; I79-A114 HydrophobicContact CD1-CB 3.94Å; I79-A114 HydrophobicContact CG1-CB 4.03Å
80	P	44.9	Very low	46.2	Very low	30 Å²	30	67 Å²	67	20%	0.195	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	149.2	-178.5	27.3	-39.2	0	0	0	111.9	T82 T221 A223	P80-T82 PolarHBondContact O-N 3Å; P80-T221 WeakPolarHBondContact CG-O 3.21Å; P80-A223 HydrophobicContact CG-CB 3.71Å
81	P	48.5	Very low	47.8	Very low	49 Å²	49	62.2 Å²	62.2	32%	0.318	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	137.1	-174	19.6	-31.1	0	0	0	112.9	T109 V110 L111 T221	P81-T109 HydrophobicContact CB-CG2 3.49Å; P81-T109 VanDerWaalsContact CB-CG2 3.49Å; P81-V110 WeakPolarHBondContact CA-O 3.31Å; P81-L111 HydrophobicContact CB-CD2 3.99Å; P81-L111 HydrophobicContact CG-CD2 4.47Å; P81-T221 PolarHBondContact O-N 3.23Å; P81-T221 PolarHBondContact O-OG1 3.27Å; P81-T221 VanDerWaalsContact O-OG1 3.05Å
82	T	54.2	Low	49.5	Very low	30 Å²	30	59.7 Å²	59.7	18%	0.184	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.9	172.2	-61.9	0	0	0	0	109.7	P80 T109 V110 V218 A220	P80-T82 PolarHBondContact O-N 3Å; T82-T109 WeakPolarHBondContact O-CA 3.45Å; T82-V110 PolarHBondContact N-O 2.73Å; T82-V110 PolarHBondContact O-N 2.79Å; T82-V218 HydrophobicContact CG2-CG1 3.97Å; T82-A220 HydrophobicContact CG2-CB 4.08Å; T82-A220 WeakPolarHBondContact OG1-CB 3.31Å
83	Q	55.8	Low	51.2	Low	80 Å²	80	54 Å²	54	37%	0.374	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	133.7	173.5	-62.1	-173.2	28	0	0	110.4	T107 R108 S219	Q83-T107 HydrophobicContact CB-CG2 4.47Å; Q83-R108 WeakPolarHBondContact CA-O 3.42Å; Q83-S219 PolarHBondContact N-O 2.94Å; Q83-S219 PolarHBondContact O-N 3.31Å
84	I	51.7	Low	52.8	Low	40 Å²	40	50 Å²	50	21%	0.205	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.2	172.3	-57.2	173.4	0	0	0	106.1	T107 R108 V110 V218	I84-T107 CarbonylContact O-C 3.42Å; I84-T107 WeakPolarHBondContact O-CA 3.26Å; I84-R108 HydrophobicContact CB-CB 4.44Å; I84-R108 PolarHBondContact N-O 3.3Å; I84-R108 PolarHBondContact O-N 3.35Å; I84-V110 HydrophobicContact CD1-CG2 3.95Å; I84-V218 HydrophobicContact CG1-CG2 4.48Å
85	V	59.7	Low	53.8	Low	27 Å²	27	48.9 Å²	48.9	16%	0.164	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	102.6	-177.7	-175.6	0	0	0	0	109.1	T107 T217	V85-T107 HydrophobicContact CG2-CG2 4.11Å; V85-T217 PolarHBondContact N-O 3.32Å; V85-T217 PolarHBondContact O-N 3.2Å
86	D	55.2	Low	55.3	Low	31 Å²	31	50.9 Å²	50.9	17%	0.166	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	119.9	170.5	-63.9	-53	0	0	0	108.7	K105 T106 K216	D86-K105 CarbonylContact O-C 3.57Å; D86-K105 WeakPolarHBondContact O-CA 3.48Å; D86-T106 PolarHBondContact N-O 3.31Å; D86-T106 PolarHBondContact O-N 3.45Å; D86-K216 WeakPolarHBondContact OD1-CG 3.48Å
87	T	63.8	Low	56.9	Low	19 Å²	19	49 Å²	49	12%	0.117	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	107.5	177.5	-58.6	0	0	0	0	109.4	V89 T103 K105 K215	T87-V89 HydrophobicContact CG2-CG2 4.27Å; T87-T103 HydrophobicContact CG2-CG2 4.07Å; T87-K105 HydrophobicContact CG2-CG 3.99Å; T87-K215 PolarHBondContact N-O 2.94Å; T87-K215 PolarHBondContact O-N 3.27Å
88	I	58.7	Low	58	Low	53 Å²	53	49.2 Å²	49.2	27%	0.272	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.2	173.5	-46	179.2	0	0	0	108	T103 K104 T212 M214	I88-T103 CarbonylContact O-C 3.59Å; I88-T103 VanDerWaalsContact O-CA 3.27Å; I88-T103 WeakPolarHBondContact O-CA 3.26Å; I88-K104 HydrophobicContact CB-CB 4.41Å; I88-K104 PolarHBondContact N-O 3.38Å; I88-K104 PolarHBondContact O-N 3.29Å; I88-T212 HydrophobicContact CG2-CG2 3.9Å; I88-M214 HydrophobicContact CG1-CG 4.19Å; I88-M214 HydrophobicContact CG2-CG 4.43Å
89	V	65.9	Low	59.3	Low	26 Å²	26	51.6 Å²	51.6	16%	0.158	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.6	169.8	-177.2	0	0	0	0	107.8	T87 R101 T103 T213	T87-V89 HydrophobicContact CG2-CG2 4.27Å; V89-R101 HydrophobicContact CG1-CG 4.13Å; V89-T103 HydrophobicContact CG2-CG2 4.13Å; V89-T213 PolarHBondContact N-O 3.05Å; V89-T213 PolarHBondContact O-N 3.36Å
90	T	61.1	Low	60.1	Low	31 Å²	31	54 Å²	54	19%	0.19	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.7	176.1	-56.7	0	0	0	0	108.3	R101 T102 T210	T90-R101 WeakPolarHBondContact O-CA 3.29Å; T90-T102 PolarHBondContact N-O 3.15Å; T90-T102 PolarHBondContact O-N 3.37Å; T90-T210 HydrophobicContact CG2-CG2 3.52Å
91	T	65.7	Low	61.2	Low	42 Å²	42	61 Å²	61	26%	0.258	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	111.7	175.8	-53.5	0	0	0	0	107.7	L99 K211	T91-L99 HydrophobicContact CG2-CB 4.45Å; T91-L99 HydrophobicContact CG2-CD2 4.02Å; T91-K211 PolarHBondContact N-O 2.69Å; T91-K211 PolarHBondContact O-N 3.24Å
92	T	64.2	Low	62.1	Low	26 Å²	26	62.2 Å²	62.2	16%	0.16	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.3	175	-59.8	0	0	0	0	108.7	K100 I185 T210	T92-K100 PolarHBondContact N-O 2.9Å; T92-K100 PolarHBondContact O-N 2.68Å; T92-I185 HydrophobicContact CG2-CD1 3.94Å; T92-T210 PolarHBondContact OG1-OG1 2.98Å
93	T	66.3	Low	62.7	Low	55 Å²	55	64.4 Å²	64.4	34%	0.337	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	114.5	169.1	-52.8	0	0	0	0	107.9	I209	T93-I209 PolarHBondContact N-O 2.82Å; T93-I209 PolarHBondContact O-N 2.96Å
94	N	67.5	Low	63.2	Low	48 Å²	48	67.4 Å²	67.4	26%	0.257	37%	0.366	S	S	.	.			trans	-72.6	161.6	176.7	-67.1	-29.6	0	0	0	110.8	D96 G97 S98	N94-D96 WeakPolarHBondContact CB-OD1 3.18Å; N94-D96 PolarHBondContact O-N 3.01Å; N94-G97 PolarHBondContact O-N 3.27Å; N94-S98 WeakPolarHBondContact CB-O 3.37Å; N94-S98 PolarHBondContact N-O 3.1Å; N94-S98 PolarHBondContact ND2-OG 3.05Å
95	P	52.3	Low	64	Low	83 Å²	83	72.4 Å²	72.4	54%	0.539	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.5	178.3	-26.3	36.6	0	0	0	115.2	G97 Q206	P95-G97 PolarHBondContact O-N 3.18Å; P95-Q206 HydrophobicContact CB-CB 4.38Å
96	D	69.2	Low	64.3	Low	124 Å²	124	74 Å²	74	66%	0.663	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	2.5	174.5	68.8	-12.8	0	0	0	113.5	N94 S98	N94-D96 WeakPolarHBondContact CB-OD1 3.18Å; N94-D96 PolarHBondContact O-N 3.01Å; D96-S98 VanDerWaalsContact C-N 3.28Å; D96-S98 VanDerWaalsContact CG-OG 3.24Å; D96-S98 PolarHBondContact O-N 2.81Å; D96-S98 VanDerWaalsContact OD1-CB 3.25Å; D96-S98 WeakPolarHBondContact OD1-CB 3.24Å; D96-S98 PolarHBondContact OD1-N 2.86Å; D96-S98 PolarHBondContact OD1-OG 3.33Å; D96-S98 PolarHBondContact OD2-OG 2.97Å; D96-S98 VanDerWaalsContact OD2-OG 3.09Å
97	G	64.8	Low	65.1	Low	47 Å²	47	76.2 Å²	76.2	49%	0.485	41%	0.411	S	S	.	.	S	Bend	trans	80	-0.8	-175	0	0	0	0	0	114.6	N94 P95	N94-G97 PolarHBondContact O-N 3.27Å; P95-G97 PolarHBondContact O-N 3.18Å
98	S	62.9	Low	64.7	Low	46 Å²	46	83.1 Å²	83.1	32%	0.322	44%	0.435	S	S	.	.			trans	-74	140.4	177.9	69.4	0	0	0	0	111.8	N94 D96	N94-S98 WeakPolarHBondContact CB-O 3.37Å; N94-S98 PolarHBondContact N-O 3.1Å; N94-S98 PolarHBondContact ND2-OG 3.05Å; D96-S98 VanDerWaalsContact C-N 3.28Å; D96-S98 VanDerWaalsContact CG-OG 3.24Å; D96-S98 PolarHBondContact O-N 2.81Å; D96-S98 VanDerWaalsContact OD1-CB 3.25Å; D96-S98 WeakPolarHBondContact OD1-CB 3.24Å; D96-S98 PolarHBondContact OD1-N 2.86Å; D96-S98 PolarHBondContact OD1-OG 3.33Å; D96-S98 PolarHBondContact OD2-OG 2.97Å; D96-S98 VanDerWaalsContact OD2-OG 3.09Å
99	L	63.1	Low	64.7	Low	125 Å²	125	84.9 Å²	84.9	65%	0.654	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	106.1	-178.8	-69	89.2	0	0	0	110.8	T91 R101	T91-L99 HydrophobicContact CG2-CB 4.45Å; T91-L99 HydrophobicContact CG2-CD2 4.02Å; L99-R101 PolarHBondContact O-N 3.33Å
100	K	65.8	Low	63.8	Low	121 Å²	121	86.8 Å²	86.8	53%	0.526	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	105.1	173.4	-164.4	172.7	-175.1	176.9	0	109.4	T92	T92-K100 PolarHBondContact N-O 2.9Å; T92-K100 PolarHBondContact O-N 2.68Å
101	R	68.1	Low	63.1	Low	179 Å²	179	91.7 Å²	91.7	68%	0.675	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	119.5	177	-175.9	-179.7	178.6	172.3	2.3	110.8	V89 T90 L99	V89-R101 HydrophobicContact CG1-CG 4.13Å; T90-R101 WeakPolarHBondContact O-CA 3.29Å; L99-R101 PolarHBondContact O-N 3.33Å
102	T	69.1	Low	62.1	Low	73 Å²	73	92.7 Å²	92.7	45%	0.448	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	155.8	168	49.4	0	0	0	0	110.3	T90	T90-T102 PolarHBondContact N-O 3.15Å; T90-T102 PolarHBondContact O-N 3.37Å
103	T	65.2	Low	61.1	Low	77 Å²	77	96.8 Å²	96.8	47%	0.472	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	122.8	-179.9	-64.9	0	0	0	0	110	T87 I88 V89	T87-T103 HydrophobicContact CG2-CG2 4.07Å; I88-T103 CarbonylContact O-C 3.59Å; I88-T103 VanDerWaalsContact O-CA 3.27Å; I88-T103 WeakPolarHBondContact O-CA 3.26Å; V89-T103 HydrophobicContact CG2-CG2 4.13Å
104	K	67.2	Low	59.7	Low	142 Å²	142	95.7 Å²	95.7	62%	0.617	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	121.4	178.9	-174.2	174.3	-176.9	174.8	0	108.6	I88	I88-K104 HydrophobicContact CB-CB 4.41Å; I88-K104 PolarHBondContact N-O 3.38Å; I88-K104 PolarHBondContact O-N 3.29Å
105	K	68.9	Low	58.1	Low	146 Å²	146	102.9 Å²	102.9	64%	0.635	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	146.8	171.3	-72.7	-171.5	172.4	-177.1	0	110.1	D86 T87	D86-K105 CarbonylContact O-C 3.57Å; D86-K105 WeakPolarHBondContact O-CA 3.48Å; T87-K105 HydrophobicContact CG2-CG 3.99Å
106	T	66	Low	57.3	Low	59 Å²	59	103.5 Å²	103.5	36%	0.362	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	120.9	174.9	-65.5	0	0	0	0	108	D86	D86-T106 PolarHBondContact N-O 3.31Å; D86-T106 PolarHBondContact O-N 3.45Å
107	T	70.5	Confident	55.5	Low	78 Å²	78	107.2 Å²	107.2	48%	0.479	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.8	-179.7	-56.3	0	0	0	0	109.3	Q83 I84 V85	Q83-T107 HydrophobicContact CB-CG2 4.47Å; I84-T107 CarbonylContact O-C 3.42Å; I84-T107 WeakPolarHBondContact O-CA 3.26Å; V85-T107 HydrophobicContact CG2-CG2 4.11Å
108	R	55.8	Low	54	Low	165 Å²	165	112.3 Å²	112.3	62%	0.623	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	142.8	170.6	-75.1	175.6	164.9	171.8	-5.8	109.4	Q83 I84	Q83-R108 WeakPolarHBondContact CA-O 3.42Å; I84-R108 HydrophobicContact CB-CB 4.44Å; I84-R108 PolarHBondContact N-O 3.3Å; I84-R108 PolarHBondContact O-N 3.35Å
109	T	58.2	Low	52.4	Low	90 Å²	90	116 Å²	116	55%	0.552	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118	123.9	-179.2	-53.2	0	0	0	0	109.3	P81 T82	P81-T109 HydrophobicContact CB-CG2 3.49Å; P81-T109 VanDerWaalsContact CB-CG2 3.49Å; T82-T109 WeakPolarHBondContact O-CA 3.45Å
110	V	47.1	Very low	50.8	Low	65 Å²	65	121 Å²	121	39%	0.394	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.2	126.7	179.6	-175.9	0	0	0	0	109	P81 T82 I84	P81-V110 WeakPolarHBondContact CA-O 3.31Å; T82-V110 PolarHBondContact N-O 2.73Å; T82-V110 PolarHBondContact O-N 2.79Å; I84-V110 HydrophobicContact CD1-CG2 3.95Å
111	L	47.6	Very low	49.1	Very low	134 Å²	134	122.6 Å²	122.6	70%	0.702	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.6	134.6	175.2	-76.7	161.9	0	0	0	109.6	P81	P81-L111 HydrophobicContact CB-CD2 3.99Å; P81-L111 HydrophobicContact CG-CD2 4.47Å
112	T	44.5	Very low	47.3	Very low	64 Å²	64	121.3 Å²	121.3	39%	0.393	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.6	136.9	178.3	-49.9	0	0	0	0	108.9	I79	I79-T112 WeakPolarHBondContact CB-O 3.31Å; I79-T112 HydrophobicContact CD1-CG2 4.11Å; I79-T112 PolarHBondContact N-O 3.5Å
113	T	43.8	Very low	45.4	Very low	111 Å²	111	124.2 Å²	124.2	68%	0.681	60%	0.603	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111	144.9	176.8	49.8	0	0	0	0	110.8
114	A	35.4	Very low	43.7	Very low	32 Å²	32	128.3 Å²	128.3	26%	0.264	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.5	141.2	175.4	0	0	0	0	0	110.8	S77 I79	S77-A114 PolarHBondContact N-O 3.29Å; S77-A114 PolarHBondContact O-N 3.28Å; I79-A114 HydrophobicContact CD1-CB 3.94Å; I79-A114 HydrophobicContact CG1-CB 4.03Å
115	R	34.6	Very low	42	Very low	200 Å²	200	127.7 Å²	127.7	76%	0.755	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.9	120.2	170.3	-75.1	179.3	170.9	167.4	-2.9	108.7	I74 T76	I74-R115 HydrophobicContact CG2-CG 4.37Å; T76-R115 HydrophobicContact CG2-CG 4.38Å
116	I	35.7	Very low	40.1	Very low	96 Å²	96	125.2 Å²	125.2	49%	0.492	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.8	124.8	175.1	-58.6	-178.4	0	0	0	107.7	I75 S77	I75-I116 PolarHBondContact O-N 2.93Å; I75-I116 VanDerWaalsContact O-O 3.14Å; S77-I116 WeakPolarHBondContact OG-CD1 3.48Å
117	R	31.4	Very low	38.5	Very low	202 Å²	202	130.6 Å²	130.6	76%	0.762	67%	0.667	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.9	129.8	172.4	-73.3	-179.8	170.2	139.9	-6.4	109.4
118	K	32.7	Very low	36.6	Very low	154 Å²	154	131.6 Å²	131.6	67%	0.67	68%	0.678	S	S	*	*			trans	-91	115.8	175.5	-174.5	-179.9	-179.1	-177.1	0	108.9
119	V	30.9	Very low	35.5	Very low	122 Å²	122	130.6 Å²	130.6	74%	0.739	68%	0.684	S	S	*	*			trans	-107.5	129.6	178.2	-177.6	0	0	0	0	109
120	R	27.9	Very low	34.4	Very low	231 Å²	231	131.8 Å²	131.8	87%	0.872	70%	0.697	S	S	*	*			trans	-92.3	115.8	177.1	-164	171.8	-170.2	151.3	1.5	109.5
121	L	31.7	Very low	33.4	Very low	155 Å²	155	135.7 Å²	135.7	81%	0.812	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-73.9	148.3	173.6	-68.9	169.6	0	0	0	110.3
122	K	29.8	Very low	32.8	Very low	151 Å²	151	138.9 Å²	138.9	66%	0.657	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-99.9	135.4	173.5	-76	171.7	176	156.6	0	109.2	E70	E70-K122 WeakPolarHBondContact OE1-CE 3.46Å; E70-K122 IonicContact OE1-NZ 3.93Å; E70-K122 PolarHBondContact OE1-NZ 3.32Å; E70-K122 IonicContact OE2-NZ 3.57Å
123	N	29	Very low	32	Very low	135 Å²	135	141.5 Å²	141.5	72%	0.722	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-62.5	139.8	177	-72	11.4	0	0	0	110.2	E233	N123-E233 PolarHBondContact ND2-OE2 3.24Å
124	L	30.2	Very low	31.4	Very low	163 Å²	163	141.8 Å²	141.8	85%	0.853	75%	0.754	S	S	*	*			trans	-111.9	136	155.7	-77.2	83.2	0	0	0	106.5
125	S	29.8	Very low	31.1	Very low	128 Å²	128	144.5 Å²	144.5	90%	0.895	77%	0.771	S	S	*	*			trans	-70.2	146.9	177.9	51	0	0	0	0	111.3
126	A	29.2	Very low	30.8	Very low	94 Å²	94	145.5 Å²	145.5	78%	0.777	78%	0.777	S	S	*	*			trans	-100.1	143.1	174.8	0	0	0	0	0	110.7
127	N	32	Very low	30.5	Very low	173 Å²	173	146.4 Å²	146.4	93%	0.925	79%	0.791	S	S	*	*			trans	-113.8	145.1	153.9	-94.1	-5.2	0	0	0	107.6
128	S	30.7	Very low	30.4	Very low	99 Å²	99	145.4 Å²	145.4	69%	0.692	79%	0.792	S	S	*	*			trans	-98	159.4	-175	54.7	0	0	0	0	112.3
129	D	32.4	Very low	30.2	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	80%	0.799	S	S	*	*				177.6	158.2	104.8	-94.7	-3.3	0	0	0	115.5
130	S	35.3	Very low	30.2	Very low	116 Å²	116	148.2 Å²	148.2	81%	0.811	80%	0.804	S	S	*	*			trans	75.8	141.8	164.2	75.7	0	0	0	0	119.3
131	N	27.8	Very low	30.3	Very low	147 Å²	147	142.7 Å²	142.7	79%	0.786	80%	0.799	S	S	*	*			trans	-127.5	156.2	-178.5	-64.6	-80.4	0	0	0	110.2
132	Q	33.8	Very low	30.2	Very low	200 Å²	200	142.6 Å²	142.6	94%	0.935	80%	0.799	S	S	*	*			trans	-160.8	154.6	138.9	-111.9	170	42.9	0	0	110.9
133	S	27.2	Very low	30.1	Very low	120 Å²	120	144 Å²	144	84%	0.839	81%	0.81	S	S	*	*			trans	-156.6	144.6	-168.2	55.6	0	0	0	0	115
134	S	30.9	Very low	30	Very low	116 Å²	116	146.7 Å²	146.7	81%	0.811	82%	0.815	S	S	*	*			trans	-171.7	168.6	168.4	55.6	0	0	0	0	110.2
135	S	29.2	Very low	30.1	Very low	90 Å²	90	144.7 Å²	144.7	63%	0.629	81%	0.805	S	S	*	*				-158.6	161.9	-66.8	47.9	0	0	0	0	111.3
136	Y	28.6	Very low	30.1	Very low	221 Å²	221	143.6 Å²	143.6	87%	0.867	79%	0.789	S	S	*	*			trans	69.2	157.5	175.4	-58.6	-83.5	0	0	0	117.1
137	S	29.9	Very low	30.1	Very low	114 Å²	114	145.8 Å²	145.8	80%	0.797	79%	0.786	S	S	*	*			cis	-142	-176.4	3.1	-159.1	0	0	0	0	113.1
138	K	28.5	Very low	29.8	Very low	181 Å²	181	143.2 Å²	143.2	79%	0.787	77%	0.772	S	S	*	*			trans	-105.1	152	-176.5	-61.7	172.5	178.2	172.1	0	113.4
139	N	28.8	Very low	29.6	Very low	152 Å²	152	146.6 Å²	146.6	81%	0.813	77%	0.774	S	S	*	*				156.4	104.7	121.6	-79.6	-20.2	0	0	0	114.6
140	H	30.5	Very low	29.4	Very low	183 Å²	183	145.3 Å²	145.3	85%	0.847	77%	0.772	S	S	*	*			trans	-166.8	141.3	138.4	-133.2	-94.9	0	0	0	112.3
141	P	30.4	Very low	29	Very low	116 Å²	116	148.7 Å²	148.7	75%	0.753	77%	0.772	S	S	*	*			trans	-106.7	92.6	179.9	36.6	-29.1	0	0	0	113.2
142	D	29.6	Very low	28.9	Very low	152 Å²	152	150.8 Å²	150.8	81%	0.813	78%	0.775	S	S	*	*			trans	-152.7	45.1	171.6	-142.4	6.2	0	0	0	115.9
143	M	28	Very low	28.5	Very low	180 Å²	180	148 Å²	148	89%	0.887	77%	0.766	S	S	*	*			trans	-140.6	107	165.1	-74.5	-161	-173.2	0	0	112
144	K	27.7	Very low	28.6	Very low	193 Å²	193	147.7 Å²	147.7	84%	0.839	76%	0.764	S	S	*	*			trans	-100.9	53	169.7	-75.7	-173.1	177.4	176.2	0	112.6
145	N	31.8	Very low	28.3	Very low	120 Å²	120	149.5 Å²	149.5	64%	0.642	76%	0.76	S	S	*	*			trans	-105.1	88.9	164.7	-78.7	-19.9	0	0	0	108.3	I147	N145-I147 PolarHBondContact O-N 3.23Å
146	I	30.7	Very low	28.3	Very low	106 Å²	106	153.6 Å²	153.6	54%	0.544	77%	0.766	S	S	.	*			trans	-84.5	111	-165.6	-57.8	176.2	0	0	0	110.9	N148	I146-N148 HydrophobicContact CG2-CB 4.24Å; I146-N148 VanDerWaalsContact CG2-CG 3.48Å; I146-N148 VanDerWaalsContact CG2-OD1 3.23Å; I146-N148 WeakPolarHBondContact CG2-OD1 3.34Å; I146-N148 PolarHBondContact O-N 3Å
147	I	27.6	Very low	28.2	Very low	140 Å²	140	147.9 Å²	147.9	72%	0.718	76%	0.759	S	S	*	*			trans	-81.6	94.7	164.8	-55.2	175.3	0	0	0	107.9	N145 F149	N145-I147 PolarHBondContact O-N 3.23Å; I147-F149 HydrophobicContact CG2-CD2 3.93Å; I147-F149 HydrophobicContact CG2-CE2 3.46Å; I147-F149 VanDerWaalsContact CG2-CE2 3.46Å; I147-F149 HydrophobicContact CG2-CZ 4.01Å
148	N	26.3	Very low	28.2	Very low	119 Å²	119	150.1 Å²	150.1	64%	0.636	76%	0.762	S	S	*	*			trans	-92.1	104.9	178.9	-97.9	-12.1	0	0	0	111.5	I146 T150	I146-N148 HydrophobicContact CG2-CB 4.24Å; I146-N148 VanDerWaalsContact CG2-CG 3.48Å; I146-N148 VanDerWaalsContact CG2-OD1 3.23Å; I146-N148 WeakPolarHBondContact CG2-OD1 3.34Å; I146-N148 PolarHBondContact O-N 3Å; N148-T150 PolarHBondContact O-N 2.82Å
149	F	26.5	Very low	28.3	Very low	169 Å²	169	145.1 Å²	145.1	74%	0.741	76%	0.761	S	S	*	*			trans	-88	85.5	167.5	-71.8	-75.6	0	0	0	111	I147 K151	I147-F149 HydrophobicContact CG2-CD2 3.93Å; I147-F149 HydrophobicContact CG2-CE2 3.46Å; I147-F149 VanDerWaalsContact CG2-CE2 3.46Å; I147-F149 HydrophobicContact CG2-CZ 4.01Å; F149-K151 PolarHBondContact O-N 2.77Å; F149-K151 VanDerWaalsContact O-N 3.12Å
150	T	27.4	Very low	28.3	Very low	117 Å²	117	145.1 Å²	145.1	72%	0.718	76%	0.761	S	S	*	*			trans	-75.2	95.8	171	36.3	0	0	0	0	111.1	N148 F152	N148-T150 PolarHBondContact O-N 2.82Å; T150-F152 PolarHBondContact O-N 2.96Å
151	K	27.9	Very low	28.3	Very low	186 Å²	186	142.1 Å²	142.1	81%	0.809	76%	0.761	S	S	*	*			trans	-74.2	107.8	171.9	-171.4	176.4	-175.1	177.3	0	110.1	F149	F149-K151 PolarHBondContact O-N 2.77Å; F149-K151 VanDerWaalsContact O-N 3.12Å
152	F	25.9	Very low	28.3	Very low	192 Å²	192	141.5 Å²	141.5	84%	0.842	75%	0.751	S	S	*	*			trans	-73.4	127.5	168.4	-109.8	-90.9	0	0	0	109.8	T150	T150-F152 PolarHBondContact O-N 2.96Å
153	N	25.7	Very low	28.5	Very low	140 Å²	140	137.1 Å²	137.1	75%	0.749	74%	0.735	S	S	*	*			trans	-90.3	120.2	165.4	-70.5	-18.9	0	0	0	108.3
154	S	28.4	Very low	28.9	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	72%	0.719	S	S	*	*			trans	-120.7	129.1	162.4	56.7	0	0	0	0	108.6
155	E	26	Very low	29.2	Very low	155 Å²	155	127 Å²	127	72%	0.724	70%	0.696	S	S	*	*			trans	-79	146	-178.1	-65.8	-172.5	85.6	0	0	112.6
156	K	27.7	Very low	29.3	Very low	175 Å²	175	124.3 Å²	124.3	76%	0.761	68%	0.684	S	S	*	*			trans	42.4	91.5	146.5	-58.7	165.4	-175.2	133.7	0	118.2
157	S	27.1	Very low	29.5	Very low	102 Å²	102	123.6 Å²	123.6	71%	0.713	68%	0.681	S	S	*	*				178.7	132.8	120.2	54.9	0	0	0	0	111.2
158	D	29.4	Very low	29.8	Very low	161 Å²	161	119.5 Å²	119.5	86%	0.861	67%	0.668	S	S	*	*	S	Bend	trans	61.8	154.4	161.2	-50.2	-27.8	0	0	0	118.8	N160	D158-N160 PolarHBondContact O-N 3.3Å
159	G	30.4	Very low	30.3	Very low	76 Å²	76	118.6 Å²	118.6	78%	0.784	66%	0.663	S	S	*	*	S	Bend	trans	-85.3	98.2	-158.7	0	0	0	0	0	115
160	N	29.1	Very low	31	Very low	152 Å²	152	115.1 Å²	115.1	81%	0.813	65%	0.65	S	S	*	*			trans	-165.1	100.6	148.8	-99.7	-48.8	0	0	0	110.8	D158 L162	D158-N160 PolarHBondContact O-N 3.3Å; N160-L162 PolarHBondContact O-N 3.09Å; N160-L162 VanDerWaalsContact O-N 3.17Å
161	S	30	Very low	31.5	Very low	119 Å²	119	111.2 Å²	111.2	83%	0.832	63%	0.627	S	S	*	*			trans	-80.2	100.3	-180	-160	0	0	0	0	111.2	A163	S161-A163 PolarHBondContact O-N 3.03Å
162	L	31	Very low	32	Very low	104 Å²	104	107.7 Å²	107.7	55%	0.545	62%	0.623	S	S	.	*			trans	-83.1	97.4	179.2	-169.1	75.6	0	0	0	110.6	N160 Q164 Y228 T230	N160-L162 PolarHBondContact O-N 3.09Å; N160-L162 VanDerWaalsContact O-N 3.17Å; L162-Q164 PolarHBondContact O-N 2.88Å; L162-Y228 HydrophobicContact CD1-CD1 4.44Å; L162-Y228 HydrophobicContact CD2-CD1 3.82Å; L162-Y228 HydrophobicContact CD2-CE1 4.22Å; L162-Y228 HydrophobicContact CG-CD1 4.06Å; L162-T230 HydrophobicContact CD1-CG2 3.63Å
163	A	34.6	Very low	32.8	Very low	59 Å²	59	105.4 Å²	105.4	49%	0.488	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.8	112.4	178.1	0	0	0	0	0	110.8	S161 Y228 A229	S161-A163 PolarHBondContact O-N 3.03Å; A163-Y228 WeakPolarHBondContact O-CA 3.36Å; A163-A229 HydrophobicContact CB-CB 4.37Å; A163-A229 PolarHBondContact N-O 3.09Å; A163-A229 PolarHBondContact O-N 3.39Å
164	Q	34.8	Very low	33.6	Very low	117 Å²	117	102.3 Å²	102.3	55%	0.547	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.9	126.6	175.4	-168	-176.5	44.8	0	0	110.5	L162 T226 F227 Y228	L162-Q164 PolarHBondContact O-N 2.88Å; Q164-T226 HydrophobicContact CG-CG2 3.54Å; Q164-F227 CarbonylContact C-O 3.6Å; Q164-F227 WeakPolarHBondContact CA-O 3.37Å; Q164-Y228 HydrophobicContact CB-CD1 4.19Å; Q164-Y228 HydrophobicContact CB-CE1 4.21Å; Q164-Y228 HydrophobicContact CG-CD1 4.02Å; Q164-Y228 HydrophobicContact CG-CE1 3.69Å; Q164-Y228 VanDerWaalsContact NE2-CE1 3.3Å; Q164-Y228 PolarHBondContact NE2-OH 2.82Å
165	A	33.8	Very low	34.1	Very low	44 Å²	44	101.5 Å²	101.5	36%	0.364	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.8	130	179	0	0	0	0	0	110.9	T226 F227	A165-T226 WeakPolarHBondContact O-CA 3.35Å; A165-F227 PolarHBondContact N-O 3.38Å; A165-F227 PolarHBondContact O-N 3.34Å
166	T	35	Very low	34.7	Very low	63 Å²	63	96.1 Å²	96.1	39%	0.387	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.2	109.8	-171.5	-54.9	0	0	0	0	110.8	T224	T166-T224 HydrophobicContact CG2-CG2 3.36Å
167	L	34.9	Very low	35	Very low	92 Å²	92	93.3 Å²	93.3	48%	0.482	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93	113.1	176.1	179.7	67.9	0	0	0	109.9	I169 T224 A225 F227	L167-I169 HydrophobicContact CD2-CD1 4.33Å; L167-I169 HydrophobicContact CD2-CG1 4.27Å; L167-I169 HydrophobicContact CG-CG1 4.19Å; L167-T224 WeakPolarHBondContact O-CA 3.33Å; L167-A225 PolarHBondContact N-O 3.15Å; L167-A225 PolarHBondContact O-N 3.45Å; L167-F227 HydrophobicContact CB-CE2 4.07Å
168	A	35	Very low	35.4	Very low	54 Å²	54	92.9 Å²	92.9	45%	0.446	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	108.7	172.7	0	0	0	0	0	110.6
169	I	36.6	Very low	35.8	Very low	100 Å²	100	91.6 Å²	91.6	51%	0.513	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	107.3	172.9	-56.4	176.1	0	0	0	107.9	L167 P171 A222 A223	L167-I169 HydrophobicContact CD2-CD1 4.33Å; L167-I169 HydrophobicContact CD2-CG1 4.27Å; L167-I169 HydrophobicContact CG-CG1 4.19Å; I169-P171 WeakPolarHBondContact O-CD 3.46Å; I169-A222 CarbonylContact O-C 3.55Å; I169-A222 WeakPolarHBondContact O-CA 3.42Å; I169-A223 HydrophobicContact CB-CB 4.36Å; I169-A223 PolarHBondContact N-O 3.41Å; I169-A223 PolarHBondContact O-N 3.25Å
170	I	40.6	Very low	36.3	Very low	95 Å²	95	93.2 Å²	93.2	49%	0.487	51%	0.514	S	S	.	.			trans	-89.7	110.5	172.1	-55.8	175.5	0	0	0	107.9	A222	I170-A222 HydrophobicContact CG1-CB 4.17Å
171	P	36.9	Very low	36.9	Very low	35 Å²	35	92.7 Å²	92.7	23%	0.227	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-73.8	148.7	175.9	31	-34.2	0	0	0	110.8	I169 A220	I169-P171 WeakPolarHBondContact O-CD 3.46Å; P171-A220 HydrophobicContact CB-CB 3.95Å; P171-A220 HydrophobicContact CG-CB 3.39Å; P171-A220 VanDerWaalsContact CG-O 3.32Å; P171-A220 WeakPolarHBondContact CG-O 3.48Å
172	P	38.4	Very low	37.6	Very low	112 Å²	112	91 Å²	91	73%	0.727	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-64.5	137.1	178.1	27.3	-34.3	0	0	0	111
173	Q	44	Very low	38.2	Very low	145 Å²	145	90.8 Å²	90.8	68%	0.678	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-77.7	128.6	166.1	-67.4	-171.5	1.2	0	0	109
174	T	42.9	Very low	38.6	Very low	74 Å²	74	90.8 Å²	90.8	45%	0.454	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116.5	178.7	-54.6	0	0	0	0	109	V176 V218	T174-V176 HydrophobicContact CG2-CG2 4.24Å; T174-V218 PolarHBondContact N-O 3.25Å; T174-V218 PolarHBondContact O-N 3.12Å
175	E	38.3	Very low	39.1	Very low	97 Å²	97	88.7 Å²	88.7	45%	0.453	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.9	171.1	-56.8	-147.4	128.9	0	0	110.3	K215 T217	E175-K215 VanDerWaalsContact CD-CE 3.41Å; E175-K215 WeakPolarHBondContact OE1-CE 3.4Å; E175-K215 IonicContact OE1-NZ 3.8Å; E175-K215 PolarHBondContact OE1-NZ 3.22Å; E175-K215 WeakPolarHBondContact OE2-CE 3.27Å; E175-K215 IonicContact OE2-NZ 2.65Å; E175-K215 PolarHBondContact OE2-NZ 3.1Å; E175-T217 HydrophobicContact CG-CG2 4.25Å; E175-T217 PolarHBondContact OE1-OG1 3.27Å
176	V	37.7	Very low	39.7	Very low	43 Å²	43	90.9 Å²	90.9	26%	0.261	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.3	173.4	-169.3	0	0	0	0	108.1	T174 Y178 K216	T174-V176 HydrophobicContact CG2-CG2 4.24Å; V176-Y178 HydrophobicContact CB-CE2 4.02Å; V176-Y178 HydrophobicContact CG1-CD2 3.99Å; V176-Y178 HydrophobicContact CG1-CE1 4.3Å; V176-Y178 HydrophobicContact CG1-CE2 3.4Å; V176-Y178 VanDerWaalsContact CG1-CE2 3.4Å; V176-K216 PolarHBondContact N-O 3.05Å; V176-K216 PolarHBondContact O-N 3.39Å
177	I	34.6	Very low	40.6	Very low	115 Å²	115	92.4 Å²	92.4	59%	0.59	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	123.6	179.5	-58	175.7	0	0	0	108.1
178	Y	34.8	Very low	41.5	Very low	93 Å²	93	90.6 Å²	90.6	37%	0.365	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	117.2	176.5	-67.2	-81.2	0	0	0	108.6	D3 V176 M214 K216	D3-Y178 PolarHBondContact OD1-OH 3.42Å; D3-Y178 PolarHBondContact OD2-OH 2.85Å; V176-Y178 HydrophobicContact CB-CE2 4.02Å; V176-Y178 HydrophobicContact CG1-CD2 3.99Å; V176-Y178 HydrophobicContact CG1-CE1 4.3Å; V176-Y178 HydrophobicContact CG1-CE2 3.4Å; V176-Y178 VanDerWaalsContact CG1-CE2 3.4Å; Y178-M214 PolarHBondContact N-O 2.64Å; Y178-M214 PolarHBondContact O-N 2.64Å; Y178-K216 HydrophobicContact CE2-CD 4.45Å
179	Q	37.9	Very low	42.6	Very low	135 Å²	135	91.8 Å²	91.8	63%	0.631	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	128.6	166.8	-96.3	179.5	-8.7	0	0	109.1	T213	Q179-T213 HydrophobicContact CG-CG2 4.05Å
180	E	41.6	Very low	43.5	Very low	109 Å²	109	91.5 Å²	91.5	51%	0.509	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-103.9	148.8	173.9	-160.9	178.8	169.8	0	0	109.5	K183 T212	E180-K183 IonicContact OE1-NZ 2.7Å; E180-T212 PolarHBondContact N-O 2.96Å
181	N	40.5	Very low	44	Very low	142 Å²	142	92.4 Å²	92.4	76%	0.759	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-61.7	148.8	-174.7	-78.3	-13.6	0	0	0	112.5	K183	N181-K183 PolarHBondContact O-N 3.45Å
182	V	44.7	Very low	44.7	Very low	83 Å²	83	93.6 Å²	93.6	50%	0.503	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-57.4	131.4	173.5	177.1	0	0	0	0	109.4	I209 K211	V182-I209 HydrophobicContact CG1-CG2 3.31Å; V182-K211 HydrophobicContact CG2-CB 4.32Å; V182-K211 HydrophobicContact CG2-CD 4.29Å; V182-K211 HydrophobicContact CG2-CG 4.26Å
183	K	45.4	Very low	45.4	Very low	99 Å²	99	90.8 Å²	90.8	43%	0.43	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	146.7	176.2	-80	-179.5	173.9	170.3	0	111.5	E180 N181 D187 T210	E180-K183 IonicContact OE1-NZ 2.7Å; N181-K183 PolarHBondContact O-N 3.45Å; K183-D187 HydrophobicContact CD-CB 4.25Å; K183-T210 PolarHBondContact N-O 3.11Å; K183-T210 VanDerWaalsContact N-O 3.16Å; K183-T210 PolarHBondContact O-N 3.01Å
184	P	42.6	Very low	45.9	Very low	59 Å²	59	86.8 Å²	86.8	38%	0.383	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	155.4	165.3	31	-34.2	0	0	0	110.5	S186 D187	P184-S186 WeakPolarHBondContact CG-OG 3.46Å; P184-S186 PolarHBondContact O-N 3.43Å; P184-S186 VanDerWaalsContact O-N 3.14Å; P184-D187 PolarHBondContact O-N 2.73Å
185	I	44	Very low	46.4	Very low	74 Å²	74	90.4 Å²	90.4	38%	0.379	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-69.3	-9.1	-176.6	-118.7	158	0	0	0	113.8	T92 D187 I188 A208	T92-I185 HydrophobicContact CG2-CD1 3.94Å; I185-D187 VanDerWaalsContact C-N 3.27Å; I185-D187 PolarHBondContact O-N 2.73Å; I185-I188 HydrophobicContact CG1-CD1 3.79Å; I185-A208 HydrophobicContact CD1-CB 3.82Å
186	S	47.8	Very low	46.6	Very low	89 Å²	89	91.2 Å²	91.2	62%	0.622	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-62.9	-28.4	172.7	46.3	0	0	0	0	114.2	P184 I188	P184-S186 WeakPolarHBondContact CG-OG 3.46Å; P184-S186 PolarHBondContact O-N 3.43Å; P184-S186 VanDerWaalsContact O-N 3.14Å; S186-I188 PolarHBondContact O-N 3.41Å
187	D	53.3	Low	46.9	Very low	95 Å²	95	96.9 Å²	96.9	51%	0.508	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-91.6	15.4	-167.9	-60.4	16.1	0	0	0	112.2	K183 P184 I185	K183-D187 HydrophobicContact CD-CB 4.25Å; P184-D187 PolarHBondContact O-N 2.73Å; I185-D187 VanDerWaalsContact C-N 3.27Å; I185-D187 PolarHBondContact O-N 2.73Å
188	I	54.3	Low	47.1	Very low	54 Å²	54	99.8 Å²	99.8	28%	0.277	52%	0.523	S	S	.	.	S	Bend	trans	-103.1	137.7	-176.3	-58.3	-179.3	0	0	0	109	I185 S186 T192 I193	I185-I188 HydrophobicContact CG1-CD1 3.79Å; S186-I188 PolarHBondContact O-N 3.41Å; I188-T192 HydrophobicContact CG2-CG2 3.74Å; I188-I193 HydrophobicContact CB-CD1 4.2Å; I188-I193 HydrophobicContact CB-CG1 4.06Å; I188-I193 HydrophobicContact CG2-CG1 3.95Å; I188-I193 VanDerWaalsContact O-CD1 3.27Å; I188-I193 WeakPolarHBondContact O-CD1 3.37Å
189	D	58.5	Low	47.1	Very low	79 Å²	79	100.3 Å²	100.3	42%	0.422	54%	0.54	S	S	.	.			trans	-50.4	133.3	176.4	145.8	60.6	0	0	0	112.3	D191 T192 I193	D189-D191 VanDerWaalsContact C-N 3.28Å; D189-D191 PolarHBondContact O-N 3.17Å; D189-D191 PolarHBondContact OD1-N 2.74Å; D189-D191 VanDerWaalsContact OD1-N 3.13Å; D189-T192 WeakPolarHBondContact O-CA 3.29Å; D189-T192 WeakPolarHBondContact O-CB 3.26Å; D189-T192 PolarHBondContact O-N 2.68Å; D189-T192 VanDerWaalsContact O-N 3.08Å; D189-T192 VanDerWaalsContact OD2-CB 3.29Å; D189-T192 WeakPolarHBondContact OD2-CB 3.16Å; D189-T192 PolarHBondContact OD2-N 2.74Å; D189-T192 PolarHBondContact OD2-OG1 3.38Å; D189-I193 PolarHBondContact O-N 3.33Å
190	P	54.2	Low	47	Very low	95 Å²	95	99.5 Å²	99.5	62%	0.617	55%	0.547	S	S	*	.	H	α-helix	trans	-59.6	-31.6	-176.9	23.2	-34.3	0	0	0	114.2	I193 A194	P190-I193 PolarHBondContact O-N 2.81Å; P190-A194 WeakPolarHBondContact O-CB 3.18Å; P190-A194 PolarHBondContact O-N 2.83Å
191	D	51.6	Low	46.7	Very low	114 Å²	114	102.1 Å²	102.1	61%	0.61	56%	0.564	S	S	*	*	H	α-helix	trans	-69.8	-36.2	176.8	-75.5	-13.8	0	0	0	111.4	D189 A194 Q195	D189-D191 VanDerWaalsContact C-N 3.28Å; D189-D191 PolarHBondContact O-N 3.17Å; D189-D191 PolarHBondContact OD1-N 2.74Å; D189-D191 VanDerWaalsContact OD1-N 3.13Å; D191-A194 PolarHBondContact O-N 3.05Å; D191-Q195 WeakPolarHBondContact O-CG 3.29Å; D191-Q195 PolarHBondContact O-N 3.3Å; D191-Q195 VanDerWaalsContact O-N 3.13Å
192	T	51.6	Low	46.2	Very low	60 Å²	60	100.5 Å²	100.5	37%	0.368	56%	0.564	S	S	.	*	H	α-helix	trans	-67.2	-37.8	170.7	-59.7	0	0	0	0	111.7	I188 D189 Q195 L196	I188-T192 HydrophobicContact CG2-CG2 3.74Å; D189-T192 WeakPolarHBondContact O-CA 3.29Å; D189-T192 WeakPolarHBondContact O-CB 3.26Å; D189-T192 PolarHBondContact O-N 2.68Å; D189-T192 VanDerWaalsContact O-N 3.08Å; D189-T192 VanDerWaalsContact OD2-CB 3.29Å; D189-T192 WeakPolarHBondContact OD2-CB 3.16Å; D189-T192 PolarHBondContact OD2-N 2.74Å; D189-T192 PolarHBondContact OD2-OG1 3.38Å; T192-Q195 PolarHBondContact O-N 3.27Å; T192-L196 HydrophobicContact CG2-CD1 4.42Å; T192-L196 WeakPolarHBondContact O-CG 3.44Å; T192-L196 PolarHBondContact O-N 2.79Å
193	I	54.1	Low	45.6	Very low	53 Å²	53	102.4 Å²	102.4	27%	0.272	58%	0.575	S	S	.	*	H	α-helix	trans	-66.2	-39	173.3	-66.5	175.5	0	0	0	111.1	I188 D189 P190 L196 K197	I188-I193 HydrophobicContact CB-CD1 4.2Å; I188-I193 HydrophobicContact CB-CG1 4.06Å; I188-I193 HydrophobicContact CG2-CG1 3.95Å; I188-I193 VanDerWaalsContact O-CD1 3.27Å; I188-I193 WeakPolarHBondContact O-CD1 3.37Å; D189-I193 PolarHBondContact O-N 3.33Å; P190-I193 PolarHBondContact O-N 2.81Å; I193-L196 PolarHBondContact O-N 2.74Å; I193-L196 VanDerWaalsContact O-N 3.16Å; I193-K197 HydrophobicContact CG2-CD 4.41Å; I193-K197 PolarHBondContact O-N 2.73Å
194	A	54.4	Low	45.1	Very low	61 Å²	61	103 Å²	103	50%	0.504	59%	0.588	S	S	.	*	H	α-helix	trans	-62	-43	176.9	0	0	0	0	0	111.8	P190 D191 L196 K197	P190-A194 WeakPolarHBondContact O-CB 3.18Å; P190-A194 PolarHBondContact O-N 2.83Å; D191-A194 PolarHBondContact O-N 3.05Å; A194-L196 PolarHBondContact O-N 3.33Å; A194-K197 PolarHBondContact O-N 2.87Å
195	Q	52.1	Low	44.7	Very low	150 Å²	150	106 Å²	106	70%	0.701	61%	0.61	S	S	*	*	H	α-helix	trans	-64.6	-24.6	175.3	-70.4	174.1	43.4	0	0	113.5	D191 T192	D191-Q195 WeakPolarHBondContact O-CG 3.29Å; D191-Q195 PolarHBondContact O-N 3.3Å; D191-Q195 VanDerWaalsContact O-N 3.13Å; T192-Q195 PolarHBondContact O-N 3.27Å
196	L	42.8	Very low	44.5	Very low	114 Å²	114	109.5 Å²	109.5	60%	0.597	63%	0.625	S	S	*	*	H	α-helix	trans	-86.5	-11.5	177.7	-69.5	169.1	0	0	0	114	T192 I193 A194 Q198	T192-L196 HydrophobicContact CG2-CD1 4.42Å; T192-L196 WeakPolarHBondContact O-CG 3.44Å; T192-L196 PolarHBondContact O-N 2.79Å; I193-L196 PolarHBondContact O-N 2.74Å; I193-L196 VanDerWaalsContact O-N 3.16Å; A194-L196 PolarHBondContact O-N 3.33Å; L196-Q198 VanDerWaalsContact C-N 3.34Å; L196-Q198 PolarHBondContact O-N 3.4Å
197	K	43.7	Very low	44.4	Very low	161 Å²	161	113.9 Å²	113.9	70%	0.7	64%	0.635	S	S	*	*			trans	-87.2	18.2	-175	-88.7	-174.8	172.9	-178	0	115.7	I193 A194 S199	I193-K197 HydrophobicContact CG2-CD 4.41Å; I193-K197 PolarHBondContact O-N 2.73Å; A194-K197 PolarHBondContact O-N 2.87Å; K197-S199 PolarHBondContact O-N 3.35Å
198	Q	39	Very low	43.9	Very low	176 Å²	176	110.2 Å²	110.2	82%	0.822	62%	0.619	S	S	*	*			trans	-76.3	70.3	173.9	-67.6	-170.6	-1.2	0	0	112.8	L196	L196-Q198 VanDerWaalsContact C-N 3.34Å; L196-Q198 PolarHBondContact O-N 3.4Å
199	S	35.1	Very low	43.5	Very low	105 Å²	105	112.1 Å²	112.1	73%	0.734	63%	0.628	S	S	*	*	S	Bend	trans	177.9	132.9	147.2	-100.1	0	0	0	0	109.3	K197	K197-S199 PolarHBondContact O-N 3.35Å
200	P	35.6	Very low	42.9	Very low	117 Å²	117	108.9 Å²	108.9	76%	0.76	61%	0.611	S	S	*	*			trans	-79.4	129.7	165.4	32.7	-30.5	0	0	0	110
201	D	36.1	Very low	42.7	Very low	165 Å²	165	108.9 Å²	108.9	88%	0.882	60%	0.602	S	S	*	*				-170.9	178.9	127.5	-99.7	-27.3	0	0	0	110.5
202	S	29.3	Very low	42.4	Very low	107 Å²	107	105.2 Å²	105.2	75%	0.748	58%	0.584	S	S	*	*			trans	-90.4	179.9	-155.1	65.2	0	0	0	0	116.8
203	V	33.2	Very low	42.1	Very low	123 Å²	123	104 Å²	104	75%	0.745	58%	0.576	S	S	*	*			trans	105.6	98.3	163.7	-171.6	0	0	0	0	117.9
204	T	33.5	Very low	41.4	Very low	112 Å²	112	104.8 Å²	104.8	69%	0.687	58%	0.579	S	S	*	*			trans	45	98.5	131.2	-44.8	0	0	0	0	121.2	Q206	T204-Q206 PolarHBondContact O-N 3.05Å; T204-Q206 VanDerWaalsContact O-N 3.17Å
205	S	35.2	Very low	41.1	Very low	123 Å²	123	105.1 Å²	105.1	86%	0.86	57%	0.569	S	S	*	*				46	53.1	125.5	-45.7	0	0	0	0	120.2
206	Q	38.5	Very low	40.8	Very low	147 Å²	147	100.4 Å²	100.4	69%	0.687	55%	0.546	S	S	*	.			trans	-130.7	145	159.1	-68.1	-167.7	-4.1	0	0	111.7	P95 T204 A208	P95-Q206 HydrophobicContact CB-CB 4.38Å; T204-Q206 PolarHBondContact O-N 3.05Å; T204-Q206 VanDerWaalsContact O-N 3.17Å; Q206-A208 PolarHBondContact O-N 3.28Å
207	Q	45.6	Very low	41.1	Very low	180 Å²	180	95.9 Å²	95.9	84%	0.841	52%	0.524	S	S	*	.			trans	-76.9	107.6	-169.9	-70.1	178.6	-15.8	0	0	111.8	I209	Q207-I209 PolarHBondContact O-N 3.37Å
208	A	42.5	Very low	41.3	Very low	19 Å²	19	90.2 Å²	90.2	16%	0.157	50%	0.503	C	S	.	.			trans	-71.2	125.9	171.1	0	0	0	0	0	111	I185 Q206	I185-A208 HydrophobicContact CD1-CB 3.82Å; Q206-A208 PolarHBondContact O-N 3.28Å
209	I	47.8	Very low	41.5	Very low	94 Å²	94	83.1 Å²	83.1	48%	0.482	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	132	-174.8	-60.5	179.9	0	0	0	109.3	T93 V182 Q207	T93-I209 PolarHBondContact N-O 2.82Å; T93-I209 PolarHBondContact O-N 2.96Å; V182-I209 HydrophobicContact CG1-CG2 3.31Å; Q207-I209 PolarHBondContact O-N 3.37Å
210	T	45.4	Very low	42.1	Very low	10 Å²	10	79.5 Å²	79.5	6%	0.061	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.2	179	-62.5	0	0	0	0	111.8	T90 T92 K183	T90-T210 HydrophobicContact CG2-CG2 3.52Å; T92-T210 PolarHBondContact OG1-OG1 2.98Å; K183-T210 PolarHBondContact N-O 3.11Å; K183-T210 VanDerWaalsContact N-O 3.16Å; K183-T210 PolarHBondContact O-N 3.01Å
211	K	49.5	Very low	42.6	Very low	96 Å²	96	77.2 Å²	77.2	42%	0.417	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	122.3	174.4	-173.7	169.8	-177.1	169.9	0	110.1	T91 V182	T91-K211 PolarHBondContact N-O 2.69Å; T91-K211 PolarHBondContact O-N 3.24Å; V182-K211 HydrophobicContact CG2-CB 4.32Å; V182-K211 HydrophobicContact CG2-CD 4.29Å; V182-K211 HydrophobicContact CG2-CG 4.26Å
212	T	45.8	Very low	42.8	Very low	37 Å²	37	71.4 Å²	71.4	23%	0.227	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.5	179.9	-58.2	0	0	0	0	110.4	I88 E180	I88-T212 HydrophobicContact CG2-CG2 3.9Å; E180-T212 PolarHBondContact N-O 2.96Å
213	T	45.8	Very low	43.4	Very low	34 Å²	34	67.7 Å²	67.7	21%	0.209	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	126.6	176.1	-61.8	0	0	0	0	109.1	V89 Q179	V89-T213 PolarHBondContact N-O 3.05Å; V89-T213 PolarHBondContact O-N 3.36Å; Q179-T213 HydrophobicContact CG-CG2 4.05Å
214	M	37.8	Very low	43.7	Very low	69 Å²	69	66.2 Å²	66.2	34%	0.34	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.7	174.1	-81.6	-170.3	62.3	0	0	110.1	I88 Y178	I88-M214 HydrophobicContact CG1-CG 4.19Å; I88-M214 HydrophobicContact CG2-CG 4.43Å; Y178-M214 PolarHBondContact N-O 2.64Å; Y178-M214 PolarHBondContact O-N 2.64Å
215	K	49.5	Very low	43.9	Very low	68 Å²	68	62.5 Å²	62.5	30%	0.296	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	123.6	167.5	167.9	166.9	166.5	159.6	0	108.7	T87 E175 T217	T87-K215 PolarHBondContact N-O 2.94Å; T87-K215 PolarHBondContact O-N 3.27Å; E175-K215 VanDerWaalsContact CD-CE 3.41Å; E175-K215 WeakPolarHBondContact OE1-CE 3.4Å; E175-K215 IonicContact OE1-NZ 3.8Å; E175-K215 PolarHBondContact OE1-NZ 3.22Å; E175-K215 WeakPolarHBondContact OE2-CE 3.27Å; E175-K215 IonicContact OE2-NZ 2.65Å; E175-K215 PolarHBondContact OE2-NZ 3.1Å; K215-T217 WeakPolarHBondContact CE-OG1 3.39Å
216	K	45.8	Very low	44	Very low	51 Å²	51	59.7 Å²	59.7	22%	0.222	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	112.3	177.9	-179.4	172.8	179.1	-167.7	0	108.5	D3 D86 V176 Y178	D3-K216 IonicContact OD2-NZ 3.66Å; D3-K216 PolarHBondContact OD2-NZ 2.98Å; D86-K216 WeakPolarHBondContact OD1-CG 3.48Å; V176-K216 PolarHBondContact N-O 3.05Å; V176-K216 PolarHBondContact O-N 3.39Å; Y178-K216 HydrophobicContact CE2-CD 4.45Å
217	T	48.1	Very low	44	Very low	19 Å²	19	58.4 Å²	58.4	12%	0.117	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.7	178.4	-63.3	0	0	0	0	108.8	V85 E175 K215	V85-T217 PolarHBondContact N-O 3.32Å; V85-T217 PolarHBondContact O-N 3.2Å; E175-T217 HydrophobicContact CG-CG2 4.25Å; E175-T217 PolarHBondContact OE1-OG1 3.27Å; K215-T217 WeakPolarHBondContact CE-OG1 3.39Å
218	V	47.7	Very low	43.5	Very low	43 Å²	43	56.6 Å²	56.6	26%	0.261	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.6	172.8	-176.7	0	0	0	0	108.5	T82 I84 T174	T82-V218 HydrophobicContact CG2-CG1 3.97Å; I84-V218 HydrophobicContact CG1-CG2 4.48Å; T174-V218 PolarHBondContact N-O 3.25Å; T174-V218 PolarHBondContact O-N 3.12Å
219	S	43.6	Very low	43.1	Very low	26 Å²	26	58.5 Å²	58.5	18%	0.182	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	107.3	178.5	59.8	0	0	0	0	109.8	Q83	Q83-S219 PolarHBondContact N-O 2.94Å; Q83-S219 PolarHBondContact O-N 3.31Å
220	A	47.3	Very low	42.3	Very low	29 Å²	29	59.4 Å²	59.4	24%	0.24	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	144.5	167.4	0	0	0	0	0	110.4	T82 P171	T82-A220 HydrophobicContact CG2-CB 4.08Å; T82-A220 WeakPolarHBondContact OG1-CB 3.31Å; P171-A220 HydrophobicContact CB-CB 3.95Å; P171-A220 HydrophobicContact CG-CB 3.39Å; P171-A220 VanDerWaalsContact CG-O 3.32Å; P171-A220 WeakPolarHBondContact CG-O 3.48Å
221	T	46.1	Very low	41.7	Very low	70 Å²	70	62.6 Å²	62.6	43%	0.429	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-78.1	147.3	178.7	-40.5	0	0	0	0	109.1	P80 P81 A223	P80-T221 WeakPolarHBondContact CG-O 3.21Å; P81-T221 PolarHBondContact O-N 3.23Å; P81-T221 PolarHBondContact O-OG1 3.27Å; P81-T221 VanDerWaalsContact O-OG1 3.05Å; T221-A223 PolarHBondContact O-N 3.36Å
222	A	41.2	Very low	40.7	Very low	43 Å²	43	64.1 Å²	64.1	36%	0.355	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-62.6	135.7	-178.6	0	0	0	0	0	111.9	I169 I170	I169-A222 CarbonylContact O-C 3.55Å; I169-A222 WeakPolarHBondContact O-CA 3.42Å; I170-A222 HydrophobicContact CG1-CB 4.17Å
223	A	41.9	Very low	39.8	Very low	29 Å²	29	69.4 Å²	69.4	24%	0.24	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	115.4	179.7	0	0	0	0	0	110.3	P80 I169 T221	P80-A223 HydrophobicContact CG-CB 3.71Å; I169-A223 HydrophobicContact CB-CB 4.36Å; I169-A223 PolarHBondContact N-O 3.41Å; I169-A223 PolarHBondContact O-N 3.25Å; T221-A223 PolarHBondContact O-N 3.36Å
224	T	39.2	Very low	38.8	Very low	92 Å²	92	74.9 Å²	74.9	56%	0.564	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	111.3	-177.6	-52.4	0	0	0	0	110	T166 L167	T166-T224 HydrophobicContact CG2-CG2 3.36Å; L167-T224 WeakPolarHBondContact O-CA 3.33Å
225	A	37.8	Very low	38.3	Very low	34 Å²	34	79 Å²	79	28%	0.281	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.7	176.6	0	0	0	0	0	110.3	L167 F227	L167-A225 PolarHBondContact N-O 3.15Å; L167-A225 PolarHBondContact O-N 3.45Å; A225-F227 HydrophobicContact CB-CE2 3.96Å; A225-F227 HydrophobicContact CB-CZ 4.1Å
226	T	37.9	Very low	37.2	Very low	64 Å²	64	81.6 Å²	81.6	39%	0.393	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.7	-175.4	-49.8	0	0	0	0	110.5	Q164 A165 Y228	Q164-T226 HydrophobicContact CG-CG2 3.54Å; A165-T226 WeakPolarHBondContact O-CA 3.35Å; T226-Y228 HydrophobicContact CG2-CE2 4.49Å
227	F	37	Very low	36.3	Very low	119 Å²	119	84.3 Å²	84.3	52%	0.522	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	146.3	-178.6	-56.6	-87.8	0	0	0	110.3	Q164 A165 L167 A225	Q164-F227 CarbonylContact C-O 3.6Å; Q164-F227 WeakPolarHBondContact CA-O 3.37Å; A165-F227 PolarHBondContact N-O 3.38Å; A165-F227 PolarHBondContact O-N 3.34Å; L167-F227 HydrophobicContact CB-CE2 4.07Å; A225-F227 HydrophobicContact CB-CE2 3.96Å; A225-F227 HydrophobicContact CB-CZ 4.1Å
228	Y	36.5	Very low	35.3	Very low	143 Å²	143	88.7 Å²	88.7	56%	0.561	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.5	131	172	-59.5	-86.6	0	0	0	108.8	L162 A163 Q164 T226	L162-Y228 HydrophobicContact CD1-CD1 4.44Å; L162-Y228 HydrophobicContact CD2-CD1 3.82Å; L162-Y228 HydrophobicContact CD2-CE1 4.22Å; L162-Y228 HydrophobicContact CG-CD1 4.06Å; A163-Y228 WeakPolarHBondContact O-CA 3.36Å; Q164-Y228 HydrophobicContact CB-CD1 4.19Å; Q164-Y228 HydrophobicContact CB-CE1 4.21Å; Q164-Y228 HydrophobicContact CG-CD1 4.02Å; Q164-Y228 HydrophobicContact CG-CE1 3.69Å; Q164-Y228 VanDerWaalsContact NE2-CE1 3.3Å; Q164-Y228 PolarHBondContact NE2-OH 2.82Å; T226-Y228 HydrophobicContact CG2-CE2 4.49Å
229	A	33.7	Very low	34.3	Very low	59 Å²	59	93.3 Å²	93.3	49%	0.488	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	134.2	173.4	0	0	0	0	0	110.7	A163	A163-A229 HydrophobicContact CB-CB 4.37Å; A163-A229 PolarHBondContact N-O 3.09Å; A163-A229 PolarHBondContact O-N 3.39Å
230	T	31.2	Very low	33.4	Very low	112 Å²	112	101.8 Å²	101.8	69%	0.687	59%	0.591	S	S	*	*			trans	-125.1	123.9	169.3	46.9	0	0	0	0	108.2	L162	L162-T230 HydrophobicContact CD1-CG2 3.63Å
231	G	31.5	Very low	32.4	Very low	78 Å²	78	104.9 Å²	104.9	80%	0.804	61%	0.607	S	S	*	*			trans	-179.6	130.6	-177.7	0	0	0	0	0	110.8
232	S	28.3	Very low	31.5	Very low	128 Å²	128	107.4 Å²	107.4	90%	0.895	63%	0.627	S	S	*	*			trans	-102.3	82.2	-176.7	174.5	0	0	0	0	110.6
233	E	27.4	Very low	30.9	Very low	148 Å²	148	111.7 Å²	111.7	69%	0.692	64%	0.644	S	S	*	*			trans	-150.7	141.1	168.1	-124.3	166.4	-166.1	0	0	110.9	N123 I235	N123-E233 PolarHBondContact ND2-OE2 3.24Å; E233-I235 PolarHBondContact O-N 3.49Å
234	V	26	Very low	30.3	Very low	149 Å²	149	119 Å²	119	90%	0.903	67%	0.674	S	S	*	*			trans	-90.5	99.4	-167	-178.1	0	0	0	0	110.8
235	I	26.6	Very low	29.7	Very low	155 Å²	155	119 Å²	119	80%	0.795	68%	0.677	S	S	*	*			trans	-110.4	118.8	172.5	-58.3	-178.7	0	0	0	109.3	E233 P237	E233-I235 PolarHBondContact O-N 3.49Å; I235-P237 WeakPolarHBondContact O-CD 3.36Å
236	N	26.5	Very low	29.1	Very low	122 Å²	122	123.8 Å²	123.8	65%	0.652	70%	0.704	S	S	*	*			trans	-80.2	111.7	-166.1	-172.1	-3.6	0	0	0	112.5	N238	N236-N238 PolarHBondContact O-N 2.91Å; N236-N238 PolarHBondContact OD1-ND2 3.22Å
237	P	26.9	Very low	28.5	Very low	109 Å²	109	124.3 Å²	124.3	71%	0.708	72%	0.721	S	S	*	*			trans	-90	64.7	-171.9	37.2	-34.8	0	0	0	111.8	I235	I235-P237 WeakPolarHBondContact O-CD 3.36Å
238	N	27.5	Very low	27.9	Very low	111 Å²	111	127.9 Å²	127.9	59%	0.594	74%	0.739	S	S	*	*			trans	-128.2	55	-177.3	-85.4	-56.4	0	0	0	114	N236	N236-N238 PolarHBondContact O-N 2.91Å; N236-N238 PolarHBondContact OD1-ND2 3.22Å
239	I	27	Very low	27.5	Very low	140 Å²	140	126.9 Å²	126.9	72%	0.718	75%	0.748	S	S	*	*	S	Bend	trans	-127.3	125.7	152.1	-52.7	-177.6	0	0	0	106.7
240	F	24.8	Very low	27.1	Very low	203 Å²	203	130.5 Å²	130.5	89%	0.89	76%	0.764	S	S	*	*	S	Bend	trans	74.2	32.2	-176.6	-61	-65.6	0	0	0	120
241	T	25.1	Very low	26.8	Very low	95 Å²	95	129.3 Å²	129.3	58%	0.583	76%	0.761	S	S	*	*			trans	-143.8	118.6	139.1	52.2	0	0	0	0	112.3
242	S	28.5	Very low	27	Very low	122 Å²	122	135 Å²	135	85%	0.853	76%	0.763	S	S	*	*			trans	-128.1	122.5	162	57.2	0	0	0	0	108.4
243	N	28.1	Very low	26.8	Very low	133 Å²	133	135.7 Å²	135.7	71%	0.711	76%	0.755	S	S	*	*			trans	-106.6	-180	-170.8	-74.5	-59.9	0	0	0	112.2
244	Q	28.5	Very low	26.7	Very low	183 Å²	183	133.3 Å²	133.3	86%	0.855	76%	0.755	S	S	*	*			trans	77.3	147.3	154.7	-78	165.2	26	0	0	117
245	S	27.3	Very low	26.8	Very low	91 Å²	91	133.1 Å²	133.1	64%	0.636	75%	0.749	S	S	*	*			cis	-154.6	169.6	-5.8	55.3	0	0	0	0	113
246	T	25.1	Very low	26.9	Very low	136 Å²	136	133 Å²	133	83%	0.834	75%	0.75	S	S	*	*			trans	44.1	121.3	145.5	51.2	0	0	0	0	120.4
247	G	25	Very low	26.9	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	76%	0.759	S	S	*	*			trans	164.6	61.7	160.3	0	0	0	0	0	120.3
248	E	25.1	Very low	26.9	Very low	194 Å²	194	139.4 Å²	139.4	91%	0.907	77%	0.767	S	S	*	*			trans	61.6	-175.6	136	-151	157.2	-139	0	0	120.9
249	V	27	Very low	26.9	Very low	123 Å²	123	143.1 Å²	143.1	75%	0.745	78%	0.778	S	S	*	*			trans	63.5	79.2	172.1	-161	0	0	0	0	118.1
250	T	25.3	Very low	26.8	Very low	135 Å²	135	143.2 Å²	143.2	83%	0.828	78%	0.779	S	S	*	*			trans	-54.3	134.8	153.2	49.7	0	0	0	0	114.2
251	S	25.9	Very low	26.9	Very low	87 Å²	87	142.2 Å²	142.2	61%	0.608	77%	0.774	S	S	*	*			trans	-177.2	164.2	136.6	54.3	0	0	0	0	111.4
252	K	35.6	Very low	26.8	Very low	197 Å²	197	144.1 Å²	144.1	86%	0.857	78%	0.781	S	S	*	*			trans	57.7	70.3	-175.9	-52.9	174.2	-175.4	174.2	0	112.8
253	I	24.1	Very low	26.7	Very low	142 Å²	142	144.2 Å²	144.2	73%	0.728	78%	0.78	S	S	*	*			cis	58.8	120.3	40.3	-59.5	178.2	0	0	0	112.9
254	S	25.2	Very low	26.5	Very low	98 Å²	98	145 Å²	145	69%	0.685	79%	0.785	S	S	*	*			trans	51.8	104	164	-61.6	0	0	0	0	119.1
255	N	27.1	Very low	26.3	Very low	145 Å²	145	144.8 Å²	144.8	78%	0.775	78%	0.783	S	S	*	*				-163.5	161.6	89.5	-94.4	-35	0	0	0	113.5
256	N	30.3	Very low	26.4	Very low	153 Å²	153	144.8 Å²	144.8	82%	0.818	78%	0.781	S	S	*	*			trans	72.5	36.7	161.3	-57.6	-23.4	0	0	0	120.4
257	I	26.3	Very low	26.2	Very low	166 Å²	166	146.8 Å²	146.8	85%	0.851	78%	0.779	S	S	*	*			trans	-87.1	90.7	139	-59.8	178.4	0	0	0	107.6
258	K	25.2	Very low	26.1	Very low	199 Å²	199	147.3 Å²	147.3	87%	0.865	77%	0.771	S	S	*	*			trans	164.7	77	157.7	-95	168.8	179.9	-179.5	0	113
259	K	28.3	Very low	25.9	Very low	190 Å²	190	145.8 Å²	145.8	83%	0.826	77%	0.768	S	S	*	*			trans	-137.8	116.4	140	-77.4	-159.1	176.3	-177.4	0	105.7
260	L	24.8	Very low	25.6	Very low	141 Å²	141	144.6 Å²	144.6	74%	0.738	77%	0.765	S	S	*	*				60.1	111	97.9	-63.9	166.7	0	0	0	109.9
261	K	26.3	Very low	25.5	Very low	182 Å²	182	143.2 Å²	143.2	79%	0.791	76%	0.761	S	S	*	*			cis	56.7	122.6	26.5	-147.4	-175.6	-176.5	-171.1	0	112.3
262	D	23.9	Very low	25.5	Very low	136 Å²	136	145.8 Å²	145.8	73%	0.727	77%	0.773	S	S	*	*			trans	86.5	155.7	-174.7	-49.4	-29.5	0	0	0	115.9
263	C	26.5	Very low	24.9	Very low	124 Å²	124	142.9 Å²	142.9	84%	0.838	77%	0.767	S	S	*	*			trans	64.5	117.8	-162.8	-54.8	0	0	0	0	115.1
264	N	23.6	Very low	25.2	Very low	150 Å²	150	145.7 Å²	145.7	80%	0.802	78%	0.777	S	S	*	*			cis	61.8	98.2	1.5	-101.1	-0.5	0	0	0	116.8
265	Q	24.6	Very low	25.2	Very low	177 Å²	177	148.9 Å²	148.9	83%	0.827	78%	0.779	S	S	*	*			trans	170.1	163	131.7	-89.2	-64.2	-65.4	0	0	110.5
266	P	28.7	Very low	25.4	Very low	91 Å²	91	149.4 Å²	149.4	59%	0.591	78%	0.782	S	S	*	*			trans	-128.5	-149	-166.3	32.6	-8.8	0	0	0	113.7
267	F	21.5	Very low	25.2	Very low	179 Å²	179	150.2 Å²	150.2	79%	0.785	78%	0.778	S	S	*	*			trans	78.7	107.3	164.4	-72.3	-70.1	0	0	0	120.7
268	S	21.9	Very low	25.3	Very low	84 Å²	84	147.2 Å²	147.2	59%	0.587	77%	0.767	S	S	*	*				37.9	152.9	113.7	75.5	0	0	0	0	123.6
269	L	21.7	Very low	25.4	Very low	162 Å²	162	144.3 Å²	144.3	85%	0.848	76%	0.761	S	S	*	*			trans	71.1	153.2	158.1	-65.3	162.6	0	0	0	114.9
270	S	21	Very low	25.6	Very low	98 Å²	98	140 Å²	140	69%	0.685	76%	0.755	S	S	*	*			cis	-158.7	175.7	-10.3	41	0	0	0	0	110.6
271	S	22.3	Very low	25.6	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	76%	0.759	S	S	*	*			trans	-42.1	146.5	172.8	56.1	0	0	0	0	117.8
272	T	26.5	Very low	25.9	Very low	140 Å²	140	141 Å²	141	86%	0.859	76%	0.764	S	S	*	*				-149.6	154	126.8	12.5	0	0	0	0	111.7
273	N	23.4	Very low	26.2	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	76%	0.763	S	S	*	*			trans	-65	156.7	175.8	-51.3	-91.5	0	0	0	111.9
274	E	30.3	Very low	26.2	Very low	200 Å²	200	139.1 Å²	139.1	94%	0.935	76%	0.763	S	S	*	*				-142.3	159.2	112.9	-135.2	167.4	-151	0	0	112.3
275	K	25	Very low	26.6	Very low	166 Å²	166	144 Å²	144	72%	0.722	77%	0.77	S	S	*	*			trans	-112.8	142	-170.5	-64.2	166.6	180	169.4	0	109.8
276	N	30.7	Very low	26.7	Very low	156 Å²	156	144.6 Å²	144.6	83%	0.834	77%	0.773	S	S	*	*			trans	167	157.3	131.6	-85.1	-35.6	0	0	0	109.8
277	K	26.9	Very low	26.8	Very low	169 Å²	169	147.4 Å²	147.4	74%	0.735	79%	0.788	S	S	*	*			cis	-179.5	157.4	-33.4	-156.5	-173.3	174.1	-176.7	0	105.5
278	T	29.1	Very low	27.2	Very low	104 Å²	104	142.3 Å²	142.3	64%	0.638	78%	0.779	S	S	*	*			trans	61.7	146.2	163.6	55.6	0	0	0	0	117.9
279	N	27.1	Very low	27.5	Very low	137 Å²	137	146.4 Å²	146.4	73%	0.733	79%	0.794	S	S	*	*			cis	-169.6	173	-11.6	-107.1	0.5	0	0	0	108.8
280	S	31.3	Very low	27.9	Very low	101 Å²	101	142 Å²	142	71%	0.706	79%	0.788	S	S	*	*			trans	63.9	120.1	159.6	35.5	0	0	0	0	117.4
281	N	26.1	Very low	28.4	Very low	153 Å²	153	144.3 Å²	144.3	82%	0.818	79%	0.793	S	S	*	*			cis	83.1	107.9	49.7	-69.6	4.9	0	0	0	113.2
282	E	31.8	Very low	28.6	Very low	190 Å²	190	147.8 Å²	147.8	89%	0.888	80%	0.797	S	S	*	*				-177.6	155.4	128.1	-98.8	175.4	177.5	0	0	107.9
283	S	31	Very low	28.8	Very low	101 Å²	101	148.6 Å²	148.6	71%	0.706	80%	0.795	S	S	*	*			cis	168.2	103.5	-34.2	-94.8	0	0	0	0	106.1
284	S	26.6	Very low	29.2	Very low	120 Å²	120	149.1 Å²	149.1	84%	0.839	80%	0.797	S	S	*	*			trans	32.2	128.4	147.5	-51.5	0	0	0	0	121.6
285	R	30.6	Very low	28.9	Very low	253 Å²	253	144.9 Å²	144.9	96%	0.955	79%	0.79	S	S	*	*			trans	-152.5	132.2	136	-112.2	164.5	-165.2	-163.9	2.6	112.8
286	Q	26.4	Very low	29	Very low	189 Å²	189	144.4 Å²	144.4	88%	0.883	79%	0.793	S	S	*	*			trans	-108.5	139.9	172.6	-58.4	166	-55.6	0	0	109.6
287	V	30.9	Very low	28.7	Very low	150 Å²	150	145.6 Å²	145.6	91%	0.909	79%	0.794	S	S	*	*			trans	-161.2	149.7	152.4	-171.9	0	0	0	0	107.4
288	A	31.1	Very low	28.8	Very low	72 Å²	72	144.4 Å²	144.4	60%	0.595	79%	0.794	S	S	*	*			cis	-170.3	151.8	-48.1	0	0	0	0	0	109.7
289	N	27.8	Very low	28.6	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	80%	0.797	S	S	*	*			trans	62.8	145.4	155.1	-56.7	-6.4	0	0	0	121.3
290	G	31	Very low	28.9	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	80%	0.801	S	S	*	*			trans	160.5	56.6	168.7	0	0	0	0	0	118.3
291	N	31.5	Very low	28.7	Very low	147 Å²	147	147.3 Å²	147.3	79%	0.786	80%	0.798	S	S	*	*			trans	28.2	118.6	158.5	-54	9.8	0	0	0	119.5
292	E	25	Very low	28.8	Very low	180 Å²	180	147.6 Å²	147.6	84%	0.841	80%	0.799	S	S	*	*				54.2	119.9	80.6	-70.9	-166.3	149.1	0	0	116.4
293	I	32.2	Very low	28.6	Very low	157 Å²	157	146.6 Å²	146.6	81%	0.805	80%	0.797	S	S	*	*				-171.8	125.8	121.9	-96.9	158.2	0	0	0	112.4
294	N	30.1	Very low	28.4	Very low	147 Å²	147	146.3 Å²	146.3	79%	0.786	80%	0.795	S	S	*	*			trans	40.3	113.6	151.5	-55.8	-10.6	0	0	0	123.4
295	S	24.2	Very low	28.5	Very low	111 Å²	111	148.5 Å²	148.5	78%	0.776	79%	0.794	S	S	*	*			trans	-38.6	148.8	144.1	-31.3	0	0	0	0	116.3
296	I	27.5	Very low	28.3	Very low	156 Å²	156	144.2 Å²	144.2	80%	0.8	78%	0.782	S	S	*	*			trans	-135.2	124.3	140.2	-63.9	-175.7	0	0	0	107.9	I298	I296-I298 HydrophobicContact CG2-CD1 4.48Å; I296-I298 HydrophobicContact CG2-CG1 3.98Å
297	E	23.7	Very low	28.4	Very low	182 Å²	182	143.2 Å²	143.2	85%	0.85	78%	0.775	S	S	*	*			trans	-90.3	137.5	161.1	-63.7	-179.5	124	0	0	108.8
298	I	30.2	Very low	28.3	Very low	144 Å²	144	140.8 Å²	140.8	74%	0.738	76%	0.757	S	S	*	*			trans	-127.6	100.8	156	-59.4	-176.8	0	0	0	107.9	I296	I296-I298 HydrophobicContact CG2-CD1 4.48Å; I296-I298 HydrophobicContact CG2-CG1 3.98Å
299	N	25.5	Very low	28.2	Very low	131 Å²	131	143.3 Å²	143.3	70%	0.701	76%	0.76	S	S	*	*			trans	-84.2	125.8	160.3	-132	-33.2	0	0	0	106.2	N301	N299-N301 PolarHBondContact OD1-ND2 3.43Å
300	D	32.5	Very low	28.1	Very low	153 Å²	153	140.4 Å²	140.4	82%	0.818	75%	0.752	S	S	*	*			trans	-138	103.1	161.6	-110.2	-39	0	0	0	110.7
301	N	26.4	Very low	27.8	Very low	118 Å²	118	145 Å²	145	63%	0.631	76%	0.755	S	S	*	*			trans	-92	136.3	165.2	-63.5	-100.2	0	0	0	106.6	N299	N299-N301 PolarHBondContact OD1-ND2 3.43Å
302	N	28.5	Very low	27.4	Very low	159 Å²	159	146.6 Å²	146.6	85%	0.85	76%	0.755	S	S	*	*			trans	172.2	170	130.6	-95.1	-54.9	0	0	0	113.4
303	M	29.3	Very low	27.4	Very low	169 Å²	169	141.5 Å²	141.5	83%	0.833	74%	0.744	S	S	*	*			trans	60.9	100.1	169.8	-68.5	174.9	63.2	0	0	114.8
304	S	25.2	Very low	27.1	Very low	95 Å²	95	145 Å²	145	66%	0.664	75%	0.746	S	S	*	*			cis	62.7	69.4	28.1	-166.7	0	0	0	0	115
305	M	28.9	Very low	26.8	Very low	167 Å²	167	143.4 Å²	143.4	82%	0.823	74%	0.742	S	S	*	*				-130.7	107.2	128.3	-82.5	-65	-178.6	0	0	106.4
306	K	27.4	Very low	26.8	Very low	162 Å²	162	144.5 Å²	144.5	70%	0.704	74%	0.738	S	S	*	*				64.3	110.8	75.5	-76.9	-173.9	174.2	172.4	0	114.1
307	K	28.3	Very low	26.6	Very low	169 Å²	169	142 Å²	142	74%	0.735	73%	0.73	S	S	*	*				91.7	137.3	122.5	-92.3	-172.7	146.8	-89.8	0	120.1
308	N	29.2	Very low	26.6	Very low	99 Å²	99	139 Å²	139	53%	0.529	73%	0.725	S	S	.	*			trans	99.3	93.7	136.5	-80.8	43.4	0	0	0	119.9
309	D	27.5	Very low	26.3	Very low	124 Å²	124	142 Å²	142	66%	0.663	73%	0.727	S	S	*	*				71.4	147.1	107.3	-53	-12.6	0	0	0	120.8
310	C	26.1	Very low	26.2	Very low	108 Å²	108	141.5 Å²	141.5	73%	0.73	73%	0.728	S	S	*	*			trans	64.7	121	166.4	-66.6	0	0	0	0	116.9
311	E	25.1	Very low	25.8	Very low	168 Å²	168	139 Å²	139	79%	0.785	72%	0.719	S	S	*	*				76.9	159.7	56.2	-72.7	-158.1	129.4	0	0	114.7
312	F	23.5	Very low	25.6	Very low	180 Å²	180	138.3 Å²	138.3	79%	0.789	72%	0.719	S	S	*	*			trans	70.2	80.7	163	-102.9	-92.5	0	0	0	118.5
313	A	23.5	Very low	25.4	Very low	73 Å²	73	136.4 Å²	136.4	60%	0.603	71%	0.713	S	S	*	*				35.3	97.6	113	0	0	0	0	0	117.5
314	R	26.3	Very low	25.1	Very low	229 Å²	229	132.5 Å²	132.5	86%	0.864	70%	0.699	S	S	*	*			trans	-115.3	123.9	141.2	-69.3	177.3	174.9	133.7	-1.5	105.6
315	T	23.2	Very low	25.3	Very low	114 Å²	114	135.8 Å²	135.8	70%	0.699	70%	0.703	S	S	*	*			cis	54.3	67.2	23.2	-45	0	0	0	0	111.7
316	I	25.1	Very low	25.2	Very low	135 Å²	135	132.3 Å²	132.3	69%	0.692	70%	0.696	S	S	*	*			trans	-151.2	112.4	144	-98.9	139.8	0	0	0	105.1
317	T	23.9	Very low	25.2	Very low	103 Å²	103	130 Å²	130	63%	0.632	70%	0.7	S	S	*	*				93.5	139.6	55.1	-74.9	0	0	0	0	110.2
318	T	24.1	Very low	25.1	Very low	120 Å²	120	125.6 Å²	125.6	74%	0.736	70%	0.702	S	S	*	*			trans	63.2	147.1	173.5	42.7	0	0	0	0	116.8
319	R	23.2	Very low	24.9	Very low	206 Å²	206	126.2 Å²	126.2	78%	0.777	71%	0.714	S	S	*	*			cis	159.6	130.5	-12.4	164.6	179.2	-173.4	171.1	3.9	103.4	V321	R319-V321 PolarHBondContact O-N 3.38Å
320	T	22.5	Very low	24.9	Very low	120 Å²	120	124.5 Å²	124.5	74%	0.736	72%	0.717	S	S	*	*			trans	-44.9	109.5	167	-49.8	0	0	0	0	111.7	T322	T320-T322 HydrophobicContact CG2-CG2 3.78Å; T320-T322 PolarHBondContact O-OG1 3.38Å
321	V	24.1	Very low	24.8	Very low	101 Å²	101	124.5 Å²	124.5	61%	0.612	71%	0.714	S	S	*	*			trans	-130.8	86.6	162.2	-176.9	0	0	0	0	104.3	R319	R319-V321 PolarHBondContact O-N 3.38Å
322	T	22	Very low	24.8	Very low	103 Å²	103	122.2 Å²	122.2	63%	0.632	71%	0.712	S	S	*	*				33.6	58.5	67	58.4	0	0	0	0	113.3	T320	T320-T322 HydrophobicContact CG2-CG2 3.78Å; T320-T322 PolarHBondContact O-OG1 3.38Å
323	T	25.3	Very low	24.9	Very low	119 Å²	119	119.1 Å²	119.1	73%	0.73	71%	0.708	S	S	*	*			trans	-92.1	79.4	139.4	-45.6	0	0	0	0	106.1
324	T	23	Very low	24.8	Very low	88 Å²	88	121.6 Å²	121.6	54%	0.54	72%	0.715	S	S	.	*				41.8	105	97.2	63.7	0	0	0	0	112.7
325	H	29.6	Very low	24.8	Very low	164 Å²	164	116.3 Å²	116.3	76%	0.759	71%	0.709	S	S	*	*				176.3	104.3	115.1	-86.7	-56.7	0	0	0	106.4
326	S	26	Very low	24.8	Very low	94 Å²	94	116.3 Å²	116.3	66%	0.657	71%	0.709	S	S	*	*				58.3	130.2	90.4	71.6	0	0	0	0	112.4
327	S	27.4	Very low	24.9	Very low	113 Å²	113	116.3 Å²	116.3	79%	0.79	72%	0.715	S	S	*	*			cis	174.2	154.2	4.2	41.4	0	0	0	0	107.7
328	G	26.5	Very low	24.8	Very low	76 Å²	76	117 Å²	117	78%	0.784	72%	0.72	S	S	*	*			trans	87.1	145.7	176.7	0	0	0	0	0	112.9
329	S	24.2	Very low	25.1	Very low	112 Å²	112	117.6 Å²	117.6	78%	0.783	72%	0.723	S	S	*	*			cis	93.2	73.8	38.5	-176.4	0	0	0	0	113.8
330	A	27.4	Very low	25.3	Very low	88 Å²	88	113 Å²	113	73%	0.727	72%	0.718	S	S	*	*			trans	-142.8	118.7	136.8	0	0	0	0	0	105.7
331	T	25.2	Very low	25.7	Very low	109 Å²	109	115 Å²	115	67%	0.669	72%	0.721	S	S	*	*				65	144.5	50.8	79	0	0	0	0	114.4
332	T	25.2	Very low	26	Very low	120 Å²	120	116.1 Å²	116.1	74%	0.736	72%	0.724	S	S	*	*			trans	68.9	143.5	156.9	27.1	0	0	0	0	117.3
333	T	25.6	Very low	26.5	Very low	114 Å²	114	117.1 Å²	117.1	70%	0.699	73%	0.725	S	S	*	*			cis	-150.9	151.4	-4.3	-30.9	0	0	0	0	110.6
334	T	21.7	Very low	26.8	Very low	125 Å²	125	117.4 Å²	117.4	77%	0.767	72%	0.722	S	S	*	*			trans	-69.1	137.2	154.6	-48	0	0	0	0	110.2
335	T	26	Very low	27.3	Very low	119 Å²	119	118.9 Å²	118.9	73%	0.73	73%	0.727	S	S	*	*			trans	-131.7	117.8	166.3	-54.4	0	0	0	0	111.1
336	T	22	Very low	27.5	Very low	114 Å²	114	117.1 Å²	117.1	70%	0.699	72%	0.723	S	S	*	*			trans	-95.3	140.3	172.9	-47.7	0	0	0	0	109.3	T338	T336-T338 HydrophobicContact CG2-CG2 4.34Å
337	T	27.8	Very low	27.8	Very low	135 Å²	135	119.4 Å²	119.4	83%	0.828	73%	0.728	S	S	*	*			trans	-126.3	112.6	168.1	50.4	0	0	0	0	110.8
338	T	22.5	Very low	27.9	Very low	117 Å²	117	119 Å²	119	72%	0.718	73%	0.725	S	S	*	*			trans	-106.6	133.7	175.9	45.3	0	0	0	0	111.3	T336	T336-T338 HydrophobicContact CG2-CG2 4.34Å
339	T	29.7	Very low	28.1	Very low	132 Å²	132	121.4 Å²	121.4	81%	0.81	73%	0.725	S	S	*	*			trans	-144.2	105.5	159.6	44.6	0	0	0	0	106.8
340	T	26.8	Very low	28.2	Very low	111 Å²	111	127.2 Å²	127.2	68%	0.681	73%	0.73	S	S	*	*				84.1	129	59.5	61.1	0	0	0	0	113.8
341	M	30.9	Very low	28.3	Very low	161 Å²	161	131.5 Å²	131.5	79%	0.793	74%	0.735	S	S	*	*			trans	76.6	138.9	166.4	-41.5	-132.8	-44.7	0	0	114.7
342	D	30.9	Very low	28.2	Very low	124 Å²	124	135.8 Å²	135.8	66%	0.663	75%	0.747	S	S	*	*			cis	-153.3	150	-7.6	-112.1	-15.6	0	0	0	113.5
343	N	32	Very low	28.3	Very low	125 Å²	125	136.2 Å²	136.2	67%	0.668	75%	0.749	S	S	*	*			trans	35.3	148.5	143.9	-99.5	32.3	0	0	0	125.2
344	D	32.7	Very low	28.1	Very low	125 Å²	125	134.2 Å²	134.2	67%	0.668	74%	0.738	S	S	*	*			trans	68.6	143.5	142.4	-67.2	-35	0	0	0	120.7
345	N	33.7	Very low	28.3	Very low	119 Å²	119	140.1 Å²	140.1	64%	0.636	75%	0.746	S	S	*	*			cis	-162.8	157.6	-27.3	-140	-41.5	0	0	0	111.1
346	N	33.8	Very low	28.2	Very low	126 Å²	126	139.2 Å²	139.2	67%	0.674	74%	0.74	S	S	*	*			trans	62	141.4	154.7	-69.4	-43.7	0	0	0	123.9
347	N	32.6	Very low	28.4	Very low	142 Å²	142	140.1 Å²	140.1	76%	0.759	75%	0.745	S	S	*	*			trans	70.8	89.9	144.8	-63.5	-14.6	0	0	0	121.7
348	S	29.5	Very low	28.2	Very low	106 Å²	106	140.8 Å²	140.8	74%	0.741	74%	0.744	S	S	*	*				39.9	111.5	111	-176.9	0	0	0	0	119
349	T	30.7	Very low	28.4	Very low	126 Å²	126	141.6 Å²	141.6	77%	0.773	74%	0.744	S	S	*	*				-166.7	130.6	100.2	-72.4	0	0	0	0	112.4	Q351	T349-Q351 PolarHBondContact O-N 3.25Å
350	R	25.3	Very low	28.2	Very low	234 Å²	234	144.5 Å²	144.5	88%	0.883	75%	0.745	S	S	*	*			trans	-30	105.3	167.8	-179.4	-169.8	-174.9	-176.1	2.6	116.6
351	Q	29.5	Very low	28.1	Very low	178 Å²	178	143.3 Å²	143.3	83%	0.832	75%	0.747	S	S	*	*			trans	-161.3	144.8	143.5	-114	151.1	93.1	0	0	110.1	T349	T349-Q351 PolarHBondContact O-N 3.25Å
352	Q	23.6	Very low	27.8	Very low	199 Å²	199	141.4 Å²	141.4	93%	0.93	75%	0.75	S	S	*	*			trans	-88	127.7	177.7	-71.9	168.7	-65.1	0	0	109.1
353	T	26.6	Very low	27.5	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	76%	0.762	S	S	*	*			trans	-155.2	142.2	172.6	-32.4	0	0	0	0	111.5
354	T	23	Very low	27.2	Very low	73 Å²	73	149.2 Å²	149.2	45%	0.448	77%	0.766	S	S	.	*			trans	-48.8	145.5	176.6	-19.1	0	0	0	0	114.3	D434	T354-D434 WeakPolarHBondContact CB-OD2 3.4Å; T354-D434 HydrophobicContact CG2-CB 4.07Å; T354-D434 WeakPolarHBondContact CG2-OD2 3.34Å; T354-D434 PolarHBondContact OG1-OD2 2.79Å
355	R	25.8	Very low	26.7	Very low	249 Å²	249	152.8 Å²	152.8	94%	0.94	78%	0.776	S	S	*	*			trans	-162.7	135.7	132.8	-112.4	161	-169.6	-179.7	2.6	115.7
356	V	22.6	Very low	26.2	Very low	100 Å²	100	154.1 Å²	154.1	61%	0.606	78%	0.776	S	S	*	*			trans	-74.2	139.5	176.8	174.4	0	0	0	0	111.4
357	T	26.5	Very low	25.7	Very low	132 Å²	132	156.4 Å²	156.4	81%	0.81	78%	0.781	S	S	*	*			trans	-142.7	122.1	147.5	44.2	0	0	0	0	110.6
358	N	23.9	Very low	25.2	Very low	149 Å²	149	155.1 Å²	155.1	80%	0.797	78%	0.778	S	S	*	*			trans	-76.6	127.7	160.2	-74.8	-22.5	0	0	0	107.7
359	N	27	Very low	25	Very low	135 Å²	135	158.6 Å²	158.6	72%	0.722	78%	0.78	S	S	*	*			trans	-173.7	129.7	158.7	-105.7	-21.2	0	0	0	114.1
360	F	24.8	Very low	24.8	Very low	192 Å²	192	161.9 Å²	161.9	84%	0.842	78%	0.784	S	S	*	*			trans	61.8	150.4	156.3	-70.6	-114.7	0	0	0	118
361	A	25.8	Very low	24.9	Very low	86 Å²	86	157.6 Å²	157.6	71%	0.711	77%	0.772	S	S	*	*			cis	-160.3	162.1	-20.6	0	0	0	0	0	109.6
362	S	23.1	Very low	24.8	Very low	122 Å²	122	153.6 Å²	153.6	85%	0.853	76%	0.761	S	S	*	*			trans	-62.9	139.2	178.1	-44.8	0	0	0	0	113.1
363	K	25.8	Very low	25	Very low	210 Å²	210	152.1 Å²	152.1	91%	0.913	75%	0.752	S	S	*	*			trans	-143.1	126.4	148	-112.7	167.8	-172.7	175.2	0	110.7
364	R	25	Very low	25.4	Very low	203 Å²	203	149.6 Å²	149.6	77%	0.766	74%	0.739	S	S	*	*			trans	-62.3	142	-176.5	-66.9	168.4	172.4	164.4	-6.1	111.4	F366	R364-F366 HydrophobicContact CB-CD2 4.05Å; R364-F366 HydrophobicContact CG-CD2 3.87Å; R364-F366 HydrophobicContact CG-CE2 4.01Å
365	F	23.2	Very low	25.9	Very low	200 Å²	200	148.7 Å²	148.7	88%	0.877	73%	0.732	S	S	*	*			trans	-114.3	114.1	130.8	-103.3	-88.3	0	0	0	107.9
366	F	21.8	Very low	26.1	Very low	147 Å²	147	142.2 Å²	142.2	65%	0.645	71%	0.71	S	S	*	*			trans	-88.2	117.9	172.9	-107.1	-122.6	0	0	0	107.9	R364 T368	R364-F366 HydrophobicContact CB-CD2 4.05Å; R364-F366 HydrophobicContact CG-CD2 3.87Å; R364-F366 HydrophobicContact CG-CE2 4.01Å; F366-T368 HydrophobicContact CD1-CG2 4.42Å
367	F	24	Very low	26.6	Very low	173 Å²	173	141.1 Å²	141.1	76%	0.759	71%	0.707	S	S	*	*			trans	-137.5	109.3	156.7	-103.6	-79.2	0	0	0	108.6	F369	F367-F369 HydrophobicContact CD1-CE2 4.08Å; F367-F369 PolarHBondContact O-N 3.15Å
368	T	22.6	Very low	27.1	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	69%	0.688	S	S	*	*			trans	-87.5	95.5	-175.9	46.7	0	0	0	0	110.9	F366	F366-T368 HydrophobicContact CD1-CG2 4.42Å
369	F	24.8	Very low	27.8	Very low	180 Å²	180	135.9 Å²	135.9	79%	0.789	67%	0.67	S	S	*	*			trans	-101	86.5	169.1	-86.5	-82.9	0	0	0	111.1	F367	F367-F369 HydrophobicContact CD1-CE2 4.08Å; F367-F369 PolarHBondContact O-N 3.15Å
370	K	26	Very low	28.2	Very low	194 Å²	194	133.4 Å²	133.4	84%	0.843	66%	0.656	S	S	*	*			trans	-75.6	134.2	166.2	-73.4	-176.5	174	-177.8	0	109.2
371	K	27.5	Very low	28.7	Very low	145 Å²	145	129.8 Å²	129.8	63%	0.63	64%	0.637	S	S	*	*			trans	64	107.2	173.8	-52.4	177.2	179.5	-179.5	0	116.6	L375	K371-L375 HydrophobicContact CB-CD1 3.8Å; K371-L375 HydrophobicContact CB-CG 4.18Å; K371-L375 HydrophobicContact CD-CD1 4.14Å; K371-L375 HydrophobicContact CD-CD2 4.26Å; K371-L375 HydrophobicContact CD-CG 4.23Å
372	P	27.4	Very low	29.5	Very low	94 Å²	94	128.9 Å²	128.9	61%	0.61	62%	0.622	S	S	*	*	S	Bend	trans	-111.4	-45.4	147.9	-7.5	27.2	0	0	0	113.3
373	F	28.8	Very low	30.2	Very low	168 Å²	168	126.4 Å²	126.4	74%	0.737	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-27.5	-163.4	-88.8	-84.4	0	0	0	116.3	L375 T410	F373-L375 VanDerWaalsContact C-N 3.35Å; F373-T410 HydrophobicContact CZ-CG2 4.39Å
374	S	33.6	Very low	30.7	Very low	75 Å²	75	120.8 Å²	120.8	52%	0.524	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80	-17	179.9	67.9	0	0	0	0	113.9
375	L	33	Very low	31.4	Very low	54 Å²	54	116.5 Å²	116.5	28%	0.283	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	-31	-177.3	-68.4	175.3	0	0	0	111.7	K371 F373 S377 K378 D379	K371-L375 HydrophobicContact CB-CD1 3.8Å; K371-L375 HydrophobicContact CB-CG 4.18Å; K371-L375 HydrophobicContact CD-CD1 4.14Å; K371-L375 HydrophobicContact CD-CD2 4.26Å; K371-L375 HydrophobicContact CD-CG 4.23Å; F373-L375 VanDerWaalsContact C-N 3.35Å; L375-S377 PolarHBondContact O-N 3.05Å; L375-K378 PolarHBondContact O-N 3.32Å; L375-D379 WeakPolarHBondContact CB-OD2 3.42Å; L375-D379 WeakPolarHBondContact CD2-OD1 3.45Å; L375-D379 PolarHBondContact O-N 2.62Å
376	F	31.1	Very low	32.2	Very low	112 Å²	112	112.1 Å²	112.1	49%	0.491	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.8	-23.7	-174.3	-148	-87.4	0	0	0	115	I380 T403 L406	F376-I380 HydrophobicContact CD1-CD1 3.92Å; F376-I380 HydrophobicContact CE1-CD1 3.83Å; F376-I380 HydrophobicContact CG-CD1 4.48Å; F376-I380 HydrophobicContact CZ-CD1 4.33Å; F376-I380 WeakPolarHBondContact O-CD1 3.23Å; F376-I380 WeakPolarHBondContact O-CG1 2.97Å; F376-T403 HydrophobicContact CZ-CG2 4.08Å; F376-L406 HydrophobicContact CE2-CD2 4.13Å
377	S	33.8	Very low	32.9	Very low	78 Å²	78	108 Å²	108	55%	0.545	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.9	-6.7	176.2	-174.7	0	0	0	0	114.4	L375	L375-S377 PolarHBondContact O-N 3.05Å
378	K	36.4	Very low	33.6	Very low	91 Å²	91	107 Å²	107	40%	0.396	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.3	-57.1	178	-65.2	-166.1	-172.6	-169.9	0	110.6	L375 I380 R381 T382 E619	L375-K378 PolarHBondContact O-N 3.32Å; K378-I380 PolarHBondContact O-N 2.94Å; K378-R381 CarbonylContact O-C 3.57Å; K378-R381 VanDerWaalsContact O-CA 3.3Å; K378-R381 WeakPolarHBondContact O-CA 3.47Å; K378-R381 WeakPolarHBondContact O-CB 3.48Å; K378-R381 PolarHBondContact O-N 3.41Å; K378-T382 PolarHBondContact O-N 2.81Å; K378-T382 PolarHBondContact O-OG1 3Å; K378-E619 WeakPolarHBondContact CE-OE1 3.48Å; K378-E619 IonicContact NZ-OE1 2.69Å; K378-E619 PolarHBondContact NZ-OE1 3.3Å; K378-E619 IonicContact NZ-OE2 2.74Å; K378-E619 PolarHBondContact NZ-OE2 3.42Å
379	D	37.8	Very low	34.1	Very low	80 Å²	80	106.2 Å²	106.2	43%	0.428	55%	0.554	S	S	.	*	H	α-helix	trans	-62.9	-31.5	-173.3	-57	19.1	0	0	0	111.5	L375 R381 A383	L375-D379 WeakPolarHBondContact CB-OD2 3.42Å; L375-D379 WeakPolarHBondContact CD2-OD1 3.45Å; L375-D379 PolarHBondContact O-N 2.62Å; D379-R381 VanDerWaalsContact C-N 3.35Å; D379-A383 WeakPolarHBondContact O-CB 3.47Å; D379-A383 PolarHBondContact O-N 2.86Å
380	I	35.6	Very low	34.5	Very low	82 Å²	82	105.3 Å²	105.3	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-68.6	-32.2	170.8	-64.4	-175	0	0	0	111.8	F376 K378 I384	F376-I380 HydrophobicContact CD1-CD1 3.92Å; F376-I380 HydrophobicContact CE1-CD1 3.83Å; F376-I380 HydrophobicContact CG-CD1 4.48Å; F376-I380 HydrophobicContact CZ-CD1 4.33Å; F376-I380 WeakPolarHBondContact O-CD1 3.23Å; F376-I380 WeakPolarHBondContact O-CG1 2.97Å; K378-I380 PolarHBondContact O-N 2.94Å; I380-I384 HydrophobicContact CG2-CD1 3.94Å; I380-I384 WeakPolarHBondContact O-CB 3.34Å; I380-I384 VanDerWaalsContact O-CD1 3.28Å; I380-I384 WeakPolarHBondContact O-CD1 3.32Å; I380-I384 WeakPolarHBondContact O-CG1 3.33Å; I380-I384 PolarHBondContact O-N 3.39Å
381	R	35.6	Very low	34.8	Very low	117 Å²	117	104.3 Å²	104.3	44%	0.442	56%	0.556	S	S	.	*	H	α-helix	trans	-77.2	-47.1	177.2	-172.5	173.8	-83.7	146	-7.3	110.8	K378 D379 A383 I384 E385 G859	K378-R381 CarbonylContact O-C 3.57Å; K378-R381 VanDerWaalsContact O-CA 3.3Å; K378-R381 WeakPolarHBondContact O-CA 3.47Å; K378-R381 WeakPolarHBondContact O-CB 3.48Å; K378-R381 PolarHBondContact O-N 3.41Å; D379-R381 VanDerWaalsContact C-N 3.35Å; R381-A383 PolarHBondContact O-N 3.33Å; R381-I384 PolarHBondContact O-N 3.1Å; R381-I384 VanDerWaalsContact O-N 3.16Å; R381-E385 WeakPolarHBondContact CG-OE1 3.48Å; R381-E385 WeakPolarHBondContact O-CB 3.44Å; R381-E385 WeakPolarHBondContact O-CG 3.33Å; R381-E385 PolarHBondContact O-N 3.43Å; R381-G859 PolarHBondContact NH2-O 3.42Å
382	T	41.8	Very low	34.8	Very low	66 Å²	66	104.7 Å²	104.7	41%	0.405	57%	0.565	S	S	.	*	H	α-helix	trans	-60.1	-46.3	172.9	3.2	0	0	0	0	111.8	K378 I384 E385 D386	K378-T382 PolarHBondContact O-N 2.81Å; K378-T382 PolarHBondContact O-OG1 3Å; T382-I384 PolarHBondContact O-N 3.17Å; T382-I384 VanDerWaalsContact O-N 3.15Å; T382-E385 PolarHBondContact O-N 3.06Å; T382-D386 WeakPolarHBondContact O-CB 3.37Å; T382-D386 PolarHBondContact O-N 3.47Å
383	A	37.9	Very low	35.1	Very low	70 Å²	70	106 Å²	106	58%	0.579	57%	0.572	S	S	*	*	H	α-helix	trans	-65.1	-19.4	177.9	0	0	0	0	0	114.3	D379 R381	D379-A383 WeakPolarHBondContact O-CB 3.47Å; D379-A383 PolarHBondContact O-N 2.86Å; R381-A383 PolarHBondContact O-N 3.33Å
384	I	37.8	Very low	35	Very low	92 Å²	92	105.9 Å²	105.9	47%	0.472	58%	0.579	S	S	.	*	H	α-helix	trans	-86.4	-29.7	171.9	-74.2	171.6	0	0	0	111.7	I380 R381 T382	I380-I384 HydrophobicContact CG2-CD1 3.94Å; I380-I384 WeakPolarHBondContact O-CB 3.34Å; I380-I384 VanDerWaalsContact O-CD1 3.28Å; I380-I384 WeakPolarHBondContact O-CD1 3.32Å; I380-I384 WeakPolarHBondContact O-CG1 3.33Å; I380-I384 PolarHBondContact O-N 3.39Å; R381-I384 PolarHBondContact O-N 3.1Å; R381-I384 VanDerWaalsContact O-N 3.16Å; T382-I384 PolarHBondContact O-N 3.17Å; T382-I384 VanDerWaalsContact O-N 3.15Å
385	E	39.5	Very low	35	Very low	113 Å²	113	110 Å²	110	53%	0.528	59%	0.594	S	S	.	*	H	α-helix	trans	-84.4	-46.1	-178.7	-72.6	165.3	-179.3	0	0	111.6	R381 T382 G387 Q388	R381-E385 WeakPolarHBondContact CG-OE1 3.48Å; R381-E385 WeakPolarHBondContact O-CB 3.44Å; R381-E385 WeakPolarHBondContact O-CG 3.33Å; R381-E385 PolarHBondContact O-N 3.43Å; T382-E385 PolarHBondContact O-N 3.06Å; E385-G387 VanDerWaalsContact C-N 3.27Å; E385-G387 PolarHBondContact O-N 3.23Å; E385-Q388 PolarHBondContact O-N 3.2Å
386	D	38.9	Very low	34.9	Very low	108 Å²	108	114.1 Å²	114.1	58%	0.578	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-68.2	-26.9	172.5	-63.2	-39.1	0	0	0	112.3	T382 Q388 T389	T382-D386 WeakPolarHBondContact O-CB 3.37Å; T382-D386 PolarHBondContact O-N 3.47Å; D386-Q388 PolarHBondContact O-N 2.82Å; D386-Q388 VanDerWaalsContact O-N 3.07Å; D386-T389 PolarHBondContact O-N 3.36Å; D386-T389 PolarHBondContact O-OG1 3.44Å
387	G	37.5	Very low	34.7	Very low	61 Å²	61	117.5 Å²	117.5	63%	0.629	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-68.4	-0.1	178.8	0	0	0	0	0	115.3	E385	E385-G387 VanDerWaalsContact C-N 3.27Å; E385-G387 PolarHBondContact O-N 3.23Å
388	Q	37.1	Very low	34.6	Very low	151 Å²	151	119 Å²	119	71%	0.706	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-115.7	0.6	179.4	-60.6	-162.2	-8.1	0	0	114.3	E385 D386	E385-Q388 PolarHBondContact O-N 3.2Å; D386-Q388 PolarHBondContact O-N 2.82Å; D386-Q388 VanDerWaalsContact O-N 3.07Å
389	T	34.7	Very low	34.3	Very low	99 Å²	99	122.1 Å²	122.1	61%	0.607	66%	0.658	S	S	*	*	S	Bend	trans	-122.8	22.2	-168.4	50.6	0	0	0	0	115.6	D386	D386-T389 PolarHBondContact O-N 3.36Å; D386-T389 PolarHBondContact O-OG1 3.44Å
390	N	32	Very low	34	Very low	161 Å²	161	126 Å²	126	86%	0.861	68%	0.677	S	S	*	*			trans	-148.9	138.2	158.2	-93.6	-55.2	0	0	0	112.8
391	Q	32.7	Very low	34.1	Very low	173 Å²	173	127.4 Å²	127.4	81%	0.808	69%	0.689	S	S	*	*			trans	-99.8	153.4	168	-68.3	-177.8	-8.9	0	0	109.9
392	N	28.5	Very low	34.6	Very low	153 Å²	153	126.1 Å²	126.1	82%	0.818	69%	0.691	S	S	*	*			trans	74.1	65	168.3	-49.4	-30.9	0	0	0	118.1
393	T	32.9	Very low	34.4	Very low	122 Å²	122	127.5 Å²	127.5	75%	0.748	70%	0.699	S	S	*	*			trans	-141.6	122.4	145.7	49.2	0	0	0	0	111.2	L395	T393-L395 PolarHBondContact O-N 3.38Å
394	D	27.8	Very low	34.5	Very low	166 Å²	166	129.4 Å²	129.4	89%	0.888	70%	0.696	S	S	*	*			trans	-70.5	90.3	172.2	-75.2	-57.8	0	0	0	111.5	N396	D394-N396 PolarHBondContact O-N 3.49Å
395	L	32.3	Very low	34.7	Very low	161 Å²	161	130.3 Å²	130.3	84%	0.843	70%	0.699	S	S	*	*			trans	-81.5	113.3	164.1	-79.4	169.1	0	0	0	109.3	T393	T393-L395 PolarHBondContact O-N 3.38Å
396	N	30.3	Very low	34.8	Very low	141 Å²	141	128.7 Å²	128.7	75%	0.754	69%	0.693	S	S	*	*			trans	-60.2	151.1	-178.3	-86.1	-75.3	0	0	0	112.1	D394 T398	D394-N396 PolarHBondContact O-N 3.49Å; N396-T398 PolarHBondContact O-N 2.92Å
397	K	28.8	Very low	34.7	Very low	182 Å²	182	126.1 Å²	126.1	79%	0.791	69%	0.687	S	S	*	*	S	Bend	trans	-79.4	47.6	-159.4	-157.5	170.9	-175.2	169.4	0	114.5
398	T	29.8	Very low	35	Very low	111 Å²	111	125.8 Å²	125.8	68%	0.681	67%	0.67	S	S	*	*			trans	-150	99.1	-179.4	48.7	0	0	0	0	109.9	N396	N396-T398 PolarHBondContact O-N 2.92Å
399	D	30.7	Very low	35.2	Very low	156 Å²	156	124.9 Å²	124.9	83%	0.834	67%	0.668	S	S	*	*			trans	171.8	-3.6	154.7	-95.8	-12.7	0	0	0	113.6	V401	D399-V401 PolarHBondContact O-N 2.67Å
400	I	32.1	Very low	35.5	Very low	161 Å²	161	123.4 Å²	123.4	83%	0.826	66%	0.659	S	S	*	*			trans	-69	85.3	162.4	-53.9	177.3	0	0	0	108.3	D402	I400-D402 PolarHBondContact O-N 3.36Å
401	V	38.4	Very low	36	Very low	111 Å²	111	118.6 Å²	118.6	67%	0.673	63%	0.632	S	S	*	*			trans	-62.4	116.7	170.7	177	0	0	0	0	107.9	D399 T403	D399-V401 PolarHBondContact O-N 2.67Å; V401-T403 PolarHBondContact O-N 2.8Å
402	D	45.9	Very low	36.7	Very low	91 Å²	91	116 Å²	116	49%	0.487	62%	0.618	S	S	.	*			trans	-50.8	132.5	-168.2	-60	-65.5	0	0	0	112.5	I400 E404 Q405 L406	I400-D402 PolarHBondContact O-N 3.36Å; D402-E404 HydrophobicContact CB-CB 4.39Å; D402-E404 PolarHBondContact O-N 2.94Å; D402-E404 VanDerWaalsContact O-N 3.16Å; D402-Q405 HydrophobicContact CB-CB 3.93Å; D402-Q405 HydrophobicContact CB-CG 3.69Å; D402-Q405 WeakPolarHBondContact O-CA 3.26Å; D402-Q405 WeakPolarHBondContact O-CB 3.48Å; D402-Q405 PolarHBondContact O-N 2.77Å; D402-Q405 WeakPolarHBondContact OD2-CG 3.37Å; D402-L406 PolarHBondContact O-N 2.9Å
403	T	37.2	Very low	37.7	Very low	94 Å²	94	112.7 Å²	112.7	58%	0.577	60%	0.598	S	S	*	*	H	α-helix	trans	-58.4	-28	168.5	-32.8	0	0	0	0	111.2	F376 V401 A407	F376-T403 HydrophobicContact CZ-CG2 4.08Å; V401-T403 PolarHBondContact O-N 2.8Å; T403-A407 VanDerWaalsContact O-CB 3.23Å; T403-A407 WeakPolarHBondContact O-CB 3.45Å; T403-A407 PolarHBondContact O-N 3.14Å
404	E	39	Very low	38.1	Very low	110 Å²	110	107.4 Å²	107.4	51%	0.514	57%	0.566	S	S	.	*	H	α-helix	trans	-67.6	-41.6	171.2	-166.9	169.8	171.7	0	0	111.7	D402 L408 R1009	D402-E404 HydrophobicContact CB-CB 4.39Å; D402-E404 PolarHBondContact O-N 2.94Å; D402-E404 VanDerWaalsContact O-N 3.16Å; E404-L408 HydrophobicContact CG-CD1 4.29Å; E404-L408 VanDerWaalsContact O-CB 3.3Å; E404-L408 WeakPolarHBondContact O-CB 3.36Å; E404-L408 WeakPolarHBondContact O-CD1 3.45Å; E404-L408 VanDerWaalsContact O-CG 3.26Å; E404-L408 WeakPolarHBondContact O-CG 3.42Å; E404-L408 PolarHBondContact O-N 3.47Å; E404-R1009 IonicContact OE1-CZ 3.68Å; E404-R1009 IonicContact OE1-NH1 3.24Å; E404-R1009 PolarHBondContact OE1-NH1 3.26Å; E404-R1009 IonicContact OE2-NH1 2.8Å; E404-R1009 PolarHBondContact OE2-NH1 2.71Å
405	Q	42.1	Very low	39	Very low	111 Å²	111	103.5 Å²	103.5	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-67	-42.9	174.8	-69.2	-80.9	7.3	0	0	112	D402 L408 M409	D402-Q405 HydrophobicContact CB-CB 3.93Å; D402-Q405 HydrophobicContact CB-CG 3.69Å; D402-Q405 WeakPolarHBondContact O-CA 3.26Å; D402-Q405 WeakPolarHBondContact O-CB 3.48Å; D402-Q405 PolarHBondContact O-N 2.77Å; D402-Q405 WeakPolarHBondContact OD2-CG 3.37Å; Q405-L408 WeakPolarHBondContact O-CB 3.38Å; Q405-L408 PolarHBondContact O-N 3.27Å; Q405-M409 WeakPolarHBondContact O-CB 3.41Å; Q405-M409 PolarHBondContact O-N 3.36Å
406	L	41.1	Very low	40.2	Very low	79 Å²	79	101.8 Å²	101.8	41%	0.414	52%	0.524	S	S	.	.	H	α-helix	trans	-68.9	-36.7	179.6	-174.4	57.7	0	0	0	111.8	F376 D402 M409 T410	F376-L406 HydrophobicContact CE2-CD2 4.13Å; D402-L406 PolarHBondContact O-N 2.9Å; L406-M409 PolarHBondContact O-N 3.23Å; L406-T410 WeakPolarHBondContact O-CB 3.15Å; L406-T410 PolarHBondContact O-N 3.21Å; L406-T410 PolarHBondContact O-OG1 2.85Å
407	A	38.5	Very low	40.8	Very low	54 Å²	54	99.1 Å²	99.1	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-42.9	170	0	0	0	0	0	111.9	T403 T410 M411	T403-A407 VanDerWaalsContact O-CB 3.23Å; T403-A407 WeakPolarHBondContact O-CB 3.45Å; T403-A407 PolarHBondContact O-N 3.14Å; A407-T410 PolarHBondContact O-N 3.38Å; A407-M411 PolarHBondContact O-N 3.33Å
408	L	42.9	Very low	41.4	Very low	54 Å²	54	95.4 Å²	95.4	28%	0.283	49%	0.492	S	S	.	.	H	α-helix	trans	-62.2	-39.7	174	-82	164.7	0	0	0	112.5	E404 Q405 M411 K412	E404-L408 HydrophobicContact CG-CD1 4.29Å; E404-L408 VanDerWaalsContact O-CB 3.3Å; E404-L408 WeakPolarHBondContact O-CB 3.36Å; E404-L408 WeakPolarHBondContact O-CD1 3.45Å; E404-L408 VanDerWaalsContact O-CG 3.26Å; E404-L408 WeakPolarHBondContact O-CG 3.42Å; E404-L408 PolarHBondContact O-N 3.47Å; Q405-L408 WeakPolarHBondContact O-CB 3.38Å; Q405-L408 PolarHBondContact O-N 3.27Å; L408-M411 PolarHBondContact O-N 3.06Å; L408-K412 WeakPolarHBondContact O-CB 3.34Å; L408-K412 WeakPolarHBondContact O-CG 3.48Å; L408-K412 PolarHBondContact O-N 3.33Å
409	M	41	Very low	42.4	Very low	132 Å²	132	93.6 Å²	93.6	65%	0.65	48%	0.484	S	S	*	.	H	α-helix	trans	-68.3	-41.1	177.2	-156.3	-177.6	96	0	0	111.1	Q405 L406 K412 E413	Q405-M409 WeakPolarHBondContact O-CB 3.41Å; Q405-M409 PolarHBondContact O-N 3.36Å; L406-M409 PolarHBondContact O-N 3.23Å; M409-K412 PolarHBondContact O-N 2.96Å; M409-E413 PolarHBondContact O-N 3.47Å
410	T	40.9	Very low	43.1	Very low	68 Å²	68	90.5 Å²	90.5	42%	0.417	47%	0.465	S	S	.	.	H	α-helix	trans	-63.1	-41.1	174.2	-53.7	0	0	0	0	111.6	F373 L406 A407 S414	F373-T410 HydrophobicContact CZ-CG2 4.39Å; L406-T410 WeakPolarHBondContact O-CB 3.15Å; L406-T410 PolarHBondContact O-N 3.21Å; L406-T410 PolarHBondContact O-OG1 2.85Å; A407-T410 PolarHBondContact O-N 3.38Å; T410-S414 PolarHBondContact O-N 3.38Å; T410-S414 VanDerWaalsContact O-N 3.1Å
411	M	42.8	Very low	43.5	Very low	61 Å²	61	83.1 Å²	83.1	30%	0.3	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-50.1	172.4	-84	-175.9	47.3	0	0	111.8	A407 L408 E413 S414 E415 L471	A407-M411 PolarHBondContact O-N 3.33Å; L408-M411 PolarHBondContact O-N 3.06Å; M411-E413 VanDerWaalsContact C-N 3.3Å; M411-E413 PolarHBondContact O-N 3.11Å; M411-S414 PolarHBondContact O-N 3.24Å; M411-S414 VanDerWaalsContact O-N 3.08Å; M411-S414 PolarHBondContact O-OG 3.4Å; M411-E415 PolarHBondContact O-N 2.9Å; M411-L471 HydrophobicContact CG-CD1 4.38Å
412	K	48.4	Very low	43.6	Very low	119 Å²	119	84 Å²	84	52%	0.517	42%	0.422	S	S	.	.	H	α-helix	trans	-58.8	-39.6	179.2	-78.1	175.2	177.4	177.2	0	112.5	L408 M409 E415 R416	L408-K412 WeakPolarHBondContact O-CB 3.34Å; L408-K412 WeakPolarHBondContact O-CG 3.48Å; L408-K412 PolarHBondContact O-N 3.33Å; M409-K412 PolarHBondContact O-N 2.96Å; K412-E415 PolarHBondContact O-N 3.42Å; K412-R416 WeakPolarHBondContact O-CB 3.34Å; K412-R416 PolarHBondContact O-N 3.04Å
413	E	48.1	Very low	43.5	Very low	83 Å²	83	82.8 Å²	82.8	39%	0.388	42%	0.421	S	S	.	.	H	α-helix	trans	-69.9	-33.9	176.8	-162.7	60.8	-162.8	0	0	111.9	M409 M411 R416 M417	M409-E413 PolarHBondContact O-N 3.47Å; M411-E413 VanDerWaalsContact C-N 3.3Å; M411-E413 PolarHBondContact O-N 3.11Å; E413-R416 PolarHBondContact O-N 2.86Å; E413-R416 WeakPolarHBondContact OE1-CD 3.36Å; E413-R416 IonicContact OE1-CZ 3.96Å; E413-R416 IonicContact OE1-NE 2.77Å; E413-R416 IonicContact OE1-NH1 3.49Å; E413-R416 PolarHBondContact OE1-NH1 2.92Å; E413-R416 IonicContact OE2-NH1 3.91Å; E413-M417 WeakPolarHBondContact O-CB 3.38Å; E413-M417 WeakPolarHBondContact O-CG 3.4Å; E413-M417 PolarHBondContact O-N 2.92Å
414	S	43	Very low	43.6	Very low	11 Å²	11	82.1 Å²	82.1	8%	0.077	41%	0.413	C	S	.	.	H	α-helix	trans	-66.6	-38.8	172	75.2	0	0	0	0	113.1	T410 M411 M417 F418 L471	T410-S414 PolarHBondContact O-N 3.38Å; T410-S414 VanDerWaalsContact O-N 3.1Å; M411-S414 PolarHBondContact O-N 3.24Å; M411-S414 VanDerWaalsContact O-N 3.08Å; M411-S414 PolarHBondContact O-OG 3.4Å; S414-M417 PolarHBondContact O-N 3.16Å; S414-F418 WeakPolarHBondContact O-CB 3.49Å; S414-F418 PolarHBondContact O-N 3.37Å; S414-L471 VanDerWaalsContact OG-CD1 3.32Å; S414-L471 WeakPolarHBondContact OG-CD1 3.34Å
415	E	45.6	Very low	43.4	Very low	84 Å²	84	79.8 Å²	79.8	39%	0.393	40%	0.401	S	S	.	.	H	α-helix	trans	-69.2	-35.6	173.8	-69.7	-175.1	161.8	0	0	112	M411 K412 F418 S419	M411-E415 PolarHBondContact O-N 2.9Å; K412-E415 PolarHBondContact O-N 3.42Å; E415-F418 PolarHBondContact O-N 2.88Å; E415-S419 WeakPolarHBondContact O-CB 3.49Å; E415-S419 PolarHBondContact O-N 3.41Å; E415-S419 PolarHBondContact O-OG 3.37Å
416	R	57.4	Low	43.1	Very low	125 Å²	125	77.6 Å²	77.6	47%	0.472	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-53.9	171.2	-175.1	-158.2	147.8	-158.7	-4.9	110.5	K412 E413 F418 S419 E420	K412-R416 WeakPolarHBondContact O-CB 3.34Å; K412-R416 PolarHBondContact O-N 3.04Å; E413-R416 PolarHBondContact O-N 2.86Å; E413-R416 WeakPolarHBondContact OE1-CD 3.36Å; E413-R416 IonicContact OE1-CZ 3.96Å; E413-R416 IonicContact OE1-NE 2.77Å; E413-R416 IonicContact OE1-NH1 3.49Å; E413-R416 PolarHBondContact OE1-NH1 2.92Å; E413-R416 IonicContact OE2-NH1 3.91Å; R416-F418 VanDerWaalsContact C-N 3.26Å; R416-F418 PolarHBondContact O-N 3.13Å; R416-S419 CarbonylContact O-C 3.16Å; R416-S419 WeakPolarHBondContact O-CA 3.34Å; R416-S419 WeakPolarHBondContact O-CB 3.27Å; R416-S419 PolarHBondContact O-N 3.05Å; R416-E420 IonicContact CZ-OE2 2.67Å; R416-E420 VanDerWaalsContact CZ-OE2 3.23Å; R416-E420 IonicContact NE-OE2 2.91Å; R416-E420 PolarHBondContact NE-OE2 3.07Å; R416-E420 IonicContact NH2-OE1 3.5Å; R416-E420 PolarHBondContact NH2-OE1 2.97Å; R416-E420 IonicContact NH2-OE2 3.8Å; R416-E420 PolarHBondContact NH2-OE2 3.31Å; R416-E420 WeakPolarHBondContact O-CB 3.42Å; R416-E420 PolarHBondContact O-N 3.15Å
417	M	42.7	Very low	42.9	Very low	85 Å²	85	76.9 Å²	76.9	42%	0.419	40%	0.404	S	S	.	.	H	α-helix	trans	-57	-39.8	178.3	-74.8	-173	-71.7	0	0	112	E413 S414 E420 A421	E413-M417 WeakPolarHBondContact O-CB 3.38Å; E413-M417 WeakPolarHBondContact O-CG 3.4Å; E413-M417 PolarHBondContact O-N 2.92Å; S414-M417 PolarHBondContact O-N 3.16Å; M417-E420 PolarHBondContact O-N 3.33Å; M417-A421 WeakPolarHBondContact O-CB 3.39Å; M417-A421 PolarHBondContact O-N 3.27Å
418	F	42.7	Very low	42.6	Very low	103 Å²	103	77.9 Å²	77.9	45%	0.452	40%	0.401	S	S	.	.	H	α-helix	trans	-66.9	-36.1	175.8	-156.9	-87.4	0	0	0	112.6	S414 E415 R416 K422	S414-F418 WeakPolarHBondContact O-CB 3.49Å; S414-F418 PolarHBondContact O-N 3.37Å; E415-F418 PolarHBondContact O-N 2.88Å; R416-F418 VanDerWaalsContact C-N 3.26Å; R416-F418 PolarHBondContact O-N 3.13Å; F418-K422 WeakPolarHBondContact O-CB 3.18Å; F418-K422 PolarHBondContact O-N 2.79Å
419	S	49.9	Very low	42.1	Very low	73 Å²	73	81.8 Å²	81.8	51%	0.51	42%	0.418	S	S	.	.	H	α-helix	trans	-72.1	-36.1	175.3	-59	0	0	0	0	112.6	E415 R416 K422 S423	E415-S419 WeakPolarHBondContact O-CB 3.49Å; E415-S419 PolarHBondContact O-N 3.41Å; E415-S419 PolarHBondContact O-OG 3.37Å; R416-S419 CarbonylContact O-C 3.16Å; R416-S419 WeakPolarHBondContact O-CA 3.34Å; R416-S419 WeakPolarHBondContact O-CB 3.27Å; R416-S419 PolarHBondContact O-N 3.05Å; S419-K422 WeakPolarHBondContact O-CB 3.41Å; S419-K422 PolarHBondContact O-N 3.32Å; S419-S423 PolarHBondContact O-N 3.2Å
420	E	44.9	Very low	41.8	Very low	92 Å²	92	81 Å²	81	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-68.9	-46.7	177.3	-159	157.8	156.8	0	0	109.9	R416 M417 K422 S423 M424	R416-E420 IonicContact CZ-OE2 2.67Å; R416-E420 VanDerWaalsContact CZ-OE2 3.23Å; R416-E420 IonicContact NE-OE2 2.91Å; R416-E420 PolarHBondContact NE-OE2 3.07Å; R416-E420 IonicContact NH2-OE1 3.5Å; R416-E420 PolarHBondContact NH2-OE1 2.97Å; R416-E420 IonicContact NH2-OE2 3.8Å; R416-E420 PolarHBondContact NH2-OE2 3.31Å; R416-E420 WeakPolarHBondContact O-CB 3.42Å; R416-E420 PolarHBondContact O-N 3.15Å; M417-E420 PolarHBondContact O-N 3.33Å; E420-K422 PolarHBondContact O-N 3.28Å; E420-S423 WeakPolarHBondContact O-CA 3.49Å; E420-S423 WeakPolarHBondContact O-CB 3.37Å; E420-S423 PolarHBondContact O-N 3.27Å; E420-S423 PolarHBondContact O-OG 3.5Å; E420-M424 WeakPolarHBondContact O-CG 3.37Å; E420-M424 PolarHBondContact O-N 2.81Å
421	A	41.4	Very low	41.4	Very low	6 Å²	6	83.9 Å²	83.9	5%	0.05	43%	0.433	C	S	.	.	H	α-helix	trans	-57.2	-44.4	169.7	0	0	0	0	0	112.3	M417 S423 M424 F425 F541	M417-A421 WeakPolarHBondContact O-CB 3.39Å; M417-A421 PolarHBondContact O-N 3.27Å; A421-S423 PolarHBondContact O-N 3.39Å; A421-M424 WeakPolarHBondContact O-CB 3.46Å; A421-M424 PolarHBondContact O-N 2.9Å; A421-M424 VanDerWaalsContact O-N 3.1Å; A421-F425 HydrophobicContact CB-CE2 4.39Å; A421-F425 WeakPolarHBondContact O-CD2 3.3Å; A421-F425 PolarHBondContact O-N 3.49Å; A421-F425 VanDerWaalsContact O-N 3.14Å; A421-F541 HydrophobicContact CB-CE2 4.08Å; A421-F541 HydrophobicContact CB-CZ 4.1Å
422	K	40.3	Very low	40.9	Very low	128 Å²	128	86.9 Å²	86.9	56%	0.557	46%	0.455	S	S	*	.	H	α-helix	trans	-57.6	-37	174	-175.7	-175.2	178	-174.6	0	112.2	F418 S419 E420 F425 A426	F418-K422 WeakPolarHBondContact O-CB 3.18Å; F418-K422 PolarHBondContact O-N 2.79Å; S419-K422 WeakPolarHBondContact O-CB 3.41Å; S419-K422 PolarHBondContact O-N 3.32Å; E420-K422 PolarHBondContact O-N 3.28Å; K422-F425 PolarHBondContact O-N 3.15Å; K422-A426 PolarHBondContact O-N 2.9Å
423	S	44.6	Very low	40.1	Very low	66 Å²	66	86.1 Å²	86.1	46%	0.462	47%	0.465	S	S	.	.	H	α-helix	trans	-68.3	-37.5	176.2	82.9	0	0	0	0	112.4	S419 E420 A421 F425 A426 S427	S419-S423 PolarHBondContact O-N 3.2Å; E420-S423 WeakPolarHBondContact O-CA 3.49Å; E420-S423 WeakPolarHBondContact O-CB 3.37Å; E420-S423 PolarHBondContact O-N 3.27Å; E420-S423 PolarHBondContact O-OG 3.5Å; A421-S423 PolarHBondContact O-N 3.39Å; S423-F425 VanDerWaalsContact C-N 3.32Å; S423-F425 PolarHBondContact O-N 3.43Å; S423-A426 PolarHBondContact O-N 2.98Å; S423-S427 PolarHBondContact O-N 2.87Å; S423-S427 PolarHBondContact O-OG 2.9Å; S423-S427 VanDerWaalsContact O-OG 3.14Å
424	M	38.7	Very low	39.2	Very low	81 Å²	81	87.1 Å²	87.1	40%	0.399	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-29.8	176	-63.4	177.6	76.3	0	0	113	E420 A421 S427 N428	E420-M424 WeakPolarHBondContact O-CG 3.37Å; E420-M424 PolarHBondContact O-N 2.81Å; A421-M424 WeakPolarHBondContact O-CB 3.46Å; A421-M424 PolarHBondContact O-N 2.9Å; A421-M424 VanDerWaalsContact O-N 3.1Å; M424-S427 PolarHBondContact O-OG 3.01Å; M424-N428 PolarHBondContact O-N 2.97Å; M424-N428 PolarHBondContact O-ND2 3.21Å
425	F	34.9	Very low	38.7	Very low	60 Å²	60	95.6 Å²	95.6	26%	0.263	51%	0.508	S	S	.	.	H	α-helix	trans	-76.9	-36.3	172.9	-64.2	-57.8	0	0	0	112.6	A421 K422 S423 S427 N428 Q429 V537 A540 F541	A421-F425 HydrophobicContact CB-CE2 4.39Å; A421-F425 WeakPolarHBondContact O-CD2 3.3Å; A421-F425 PolarHBondContact O-N 3.49Å; A421-F425 VanDerWaalsContact O-N 3.14Å; K422-F425 PolarHBondContact O-N 3.15Å; S423-F425 VanDerWaalsContact C-N 3.32Å; S423-F425 PolarHBondContact O-N 3.43Å; F425-S427 VanDerWaalsContact C-N 3.32Å; F425-S427 PolarHBondContact O-N 3.02Å; F425-N428 PolarHBondContact O-N 2.76Å; F425-Q429 PolarHBondContact O-N 2.99Å; F425-V537 HydrophobicContact CD1-CG2 3.94Å; F425-V537 HydrophobicContact CE1-CB 3.96Å; F425-V537 HydrophobicContact CE1-CG1 4.31Å; F425-V537 HydrophobicContact CE1-CG2 3.37Å; F425-V537 HydrophobicContact CE2-CG1 4.48Å; F425-V537 HydrophobicContact CZ-CB 3.99Å; F425-V537 HydrophobicContact CZ-CG1 3.85Å; F425-V537 HydrophobicContact CZ-CG2 3.77Å; F425-A540 HydrophobicContact CZ-CB 4.47Å; F425-F541 HydrophobicContact CE2-CE2 4.2Å; F425-F541 HydrophobicContact CZ-CD2 4.48Å
426	A	36.4	Very low	38.1	Very low	65 Å²	65	98.6 Å²	98.6	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-65.1	-32.5	175	0	0	0	0	0	113.2	K422 S423	K422-A426 PolarHBondContact O-N 2.9Å; S423-A426 PolarHBondContact O-N 2.98Å
427	S	35.4	Very low	36.7	Very low	65 Å²	65	97 Å²	97	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-85.1	-17.1	178.7	56	0	0	0	0	114.9	S423 M424 F425 T430	S423-S427 PolarHBondContact O-N 2.87Å; S423-S427 PolarHBondContact O-OG 2.9Å; S423-S427 VanDerWaalsContact O-OG 3.14Å; M424-S427 PolarHBondContact O-OG 3.01Å; F425-S427 VanDerWaalsContact C-N 3.32Å; F425-S427 PolarHBondContact O-N 3.02Å; S427-T430 PolarHBondContact O-OG1 3.09Å
428	N	32.6	Very low	36.1	Very low	75 Å²	75	102 Å²	102	40%	0.401	56%	0.562	S	S	.	*	H	α-helix	trans	-85.9	-27.4	175.9	-80.3	-47.5	0	0	0	113.3	M424 F425 T430 L431	M424-N428 PolarHBondContact O-N 2.97Å; M424-N428 PolarHBondContact O-ND2 3.21Å; F425-N428 PolarHBondContact O-N 2.76Å; N428-T430 PolarHBondContact O-N 3.29Å; N428-L431 PolarHBondContact O-N 3.46Å
429	Q	33.6	Very low	35.5	Very low	136 Å²	136	101.9 Å²	101.9	64%	0.636	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-16.6	177.5	-73.9	-173.9	-22.6	0	0	114.2	F425	F425-Q429 PolarHBondContact O-N 2.99Å
430	T	34.7	Very low	34.5	Very low	115 Å²	115	110.1 Å²	110.1	71%	0.706	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	2	176.2	47.2	0	0	0	0	114.1	S427 N428	S427-T430 PolarHBondContact O-OG1 3.09Å; N428-T430 PolarHBondContact O-N 3.29Å
431	L	31.2	Very low	33.7	Very low	128 Å²	128	109.1 Å²	109.1	67%	0.67	61%	0.609	S	S	*	*	S	Bend	trans	-106.1	-0.1	-175.3	-85.9	160.8	0	0	0	115.2	N428	N428-L431 PolarHBondContact O-N 3.46Å
432	T	32.2	Very low	33.3	Very low	124 Å²	124	113.9 Å²	113.9	76%	0.761	64%	0.642	S	S	*	*	S	Bend	trans	-109	-2.5	-172.7	50.9	0	0	0	0	115.6
433	S	31.6	Very low	32.9	Very low	104 Å²	104	117.4 Å²	117.4	73%	0.727	66%	0.657	S	S	*	*	S	Bend	trans	-92.8	-36.5	-175.1	-163.7	0	0	0	0	114.5	K435	S433-K435 PolarHBondContact O-N 2.87Å
434	D	29.7	Very low	32.3	Very low	103 Å²	103	119 Å²	119	55%	0.551	67%	0.668	S	S	*	*	S	Bend	trans	-88.3	80.2	-173.9	-85.1	-5.3	0	0	0	113	T354	T354-D434 WeakPolarHBondContact CB-OD2 3.4Å; T354-D434 HydrophobicContact CG2-CB 4.07Å; T354-D434 WeakPolarHBondContact CG2-OD2 3.34Å; T354-D434 PolarHBondContact OG1-OD2 2.79Å
435	K	32.7	Very low	31.9	Very low	189 Å²	189	121.5 Å²	121.5	82%	0.822	68%	0.683	S	S	*	*			trans	174.1	58.4	151.6	-99.2	162.9	-176.9	-179.6	0	117.3	S433	S433-K435 PolarHBondContact O-N 2.87Å
436	V	31.8	Very low	31.8	Very low	148 Å²	148	126.9 Å²	126.9	90%	0.897	72%	0.715	S	S	*	*			trans	-135.5	138.7	146.3	-175.2	0	0	0	0	107.8
437	S	28.2	Very low	31.3	Very low	91 Å²	91	131.9 Å²	131.9	64%	0.636	73%	0.727	S	S	*	*			trans	-149.8	144.4	-171	-59.4	0	0	0	0	112.6
438	Q	29.8	Very low	31	Very low	190 Å²	190	136.9 Å²	136.9	89%	0.888	75%	0.747	S	S	*	*			trans	71.2	133.8	171.6	-51.3	162.5	31.2	0	0	112.8
439	S	30.4	Very low	30.6	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	76%	0.761	S	S	*	*			cis	-153.8	155.4	32.4	58.8	0	0	0	0	115.1
440	R	29.5	Very low	30.3	Very low	245 Å²	245	140.1 Å²	140.1	93%	0.925	77%	0.767	S	S	*	*			trans	33.3	121.8	146.4	-60	170.7	176.1	163.8	-2.1	117.6
441	G	28.8	Very low	29.9	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	77%	0.774	S	S	*	*			cis	105.1	146.8	41.9	0	0	0	0	0	109.9
442	S	32	Very low	29.5	Very low	105 Å²	105	144.4 Å²	144.4	73%	0.734	78%	0.781	S	S	*	*			cis	-164.5	152.6	14	-41.2	0	0	0	0	112.4
443	K	32.4	Very low	29.3	Very low	203 Å²	203	149.6 Å²	149.6	88%	0.883	79%	0.787	S	S	*	*			trans	67.9	150.9	155	-64.2	168.7	-176.3	179.3	0	117.1
444	S	31.9	Very low	29.3	Very low	98 Å²	98	149.9 Å²	149.9	69%	0.685	78%	0.78	S	S	*	*			cis	-149	135.2	1.6	48	0	0	0	0	114.1
445	N	30.7	Very low	29.3	Very low	135 Å²	135	152.6 Å²	152.6	72%	0.722	79%	0.794	S	S	*	*			trans	44.7	112.5	134.7	-51.5	22.5	0	0	0	120.6
446	N	31.7	Very low	29.2	Very low	173 Å²	173	148 Å²	148	93%	0.925	78%	0.779	S	S	*	*				-148.8	130.4	115.4	-107.5	-19.6	0	0	0	108.8
447	E	25.9	Very low	29.1	Very low	169 Å²	169	143.7 Å²	143.7	79%	0.79	76%	0.764	S	S	*	*			trans	-102.5	131.5	-167	-61.9	178.1	132.1	0	0	112.6
448	I	29.4	Very low	29.2	Very low	171 Å²	171	145.5 Å²	145.5	88%	0.877	77%	0.765	S	S	*	*			trans	-134.7	122.5	151.9	-62.3	-175.4	0	0	0	107.5
449	N	24.9	Very low	29.2	Very low	131 Å²	131	140.4 Å²	140.4	70%	0.701	75%	0.747	S	S	*	*			trans	-67.3	156.2	174.2	-66.5	-84	0	0	0	109.6
450	I	27.8	Very low	29.1	Very low	148 Å²	148	141.9 Å²	141.9	76%	0.759	74%	0.743	S	S	*	*				-167.6	125.8	64.4	-80.4	175	0	0	0	108.8
451	Y	25.2	Very low	29.1	Very low	215 Å²	215	131.7 Å²	131.7	84%	0.843	71%	0.714	S	S	*	*			trans	45	141.8	151.2	-71.8	-99.8	0	0	0	122.9
452	S	23.9	Very low	29.1	Very low	118 Å²	118	134.3 Å²	134.3	83%	0.825	70%	0.703	S	S	*	*			trans	-52.7	145.8	176.4	-47.9	0	0	0	0	114.7
453	R	28	Very low	29	Very low	233 Å²	233	134.8 Å²	134.8	88%	0.879	69%	0.693	S	S	*	*			trans	-140.3	76.5	172.1	-156.2	171.2	-168.1	160.3	3.6	114.5
454	N	30.8	Very low	29.1	Very low	110 Å²	110	129 Å²	129	59%	0.588	68%	0.678	S	S	*	*			trans	63.2	101.9	144.3	-59.3	51.9	0	0	0	119.4	D456	N454-D456 HydrophobicContact CB-CB 4.38Å; N454-D456 WeakPolarHBondContact CB-OD2 3.5Å; N454-D456 PolarHBondContact ND2-OD2 3.19Å; N454-D456 PolarHBondContact O-N 2.82Å
455	D	29.8	Very low	29.1	Very low	160 Å²	160	131.4 Å²	131.4	86%	0.856	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	20.4	161.5	-67.8	-71.2	0	0	0	114.6	G457	D455-G457 PolarHBondContact O-N 3.49Å
456	D	31.3	Very low	29.4	Very low	92 Å²	92	128.5 Å²	128.5	49%	0.492	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	-21.1	-177.7	-71.9	-42.9	0	0	0	113.7	N454 I458 V459 Q460	N454-D456 HydrophobicContact CB-CB 4.38Å; N454-D456 WeakPolarHBondContact CB-OD2 3.5Å; N454-D456 PolarHBondContact ND2-OD2 3.19Å; N454-D456 PolarHBondContact O-N 2.82Å; D456-I458 VanDerWaalsContact C-N 3.31Å; D456-I458 PolarHBondContact O-N 2.84Å; D456-V459 PolarHBondContact O-N 2.83Å; D456-Q460 PolarHBondContact O-N 2.97Å
457	G	29.9	Very low	29.6	Very low	58 Å²	58	123.9 Å²	123.9	60%	0.598	64%	0.639	S	S	*	*	H	α-helix	trans	-62.3	-31.3	-168.1	0	0	0	0	0	114.8	D455	D455-G457 PolarHBondContact O-N 3.49Å
458	I	29.1	Very low	30.2	Very low	128 Å²	128	121.2 Å²	121.2	66%	0.656	63%	0.63	S	S	*	*	H	α-helix	trans	-75.9	-38.6	-177.7	-60.4	179.3	0	0	0	111	D456 G461 Y462	D456-I458 VanDerWaalsContact C-N 3.31Å; D456-I458 PolarHBondContact O-N 2.84Å; I458-G461 PolarHBondContact O-N 2.91Å; I458-Y462 HydrophobicContact CG2-CE2 4.17Å; I458-Y462 WeakPolarHBondContact O-CD2 3.48Å
459	V	29.5	Very low	30.6	Very low	84 Å²	84	114.7 Å²	114.7	51%	0.509	60%	0.597	S	S	.	*	H	α-helix	trans	-70	-40.1	-175.3	-178.2	0	0	0	0	111.8	D456 G461 Y462 Q463	D456-V459 PolarHBondContact O-N 2.83Å; V459-G461 PolarHBondContact O-N 3.43Å; V459-Y462 PolarHBondContact O-N 3.46Å; V459-Y462 VanDerWaalsContact O-N 3.09Å; V459-Q463 PolarHBondContact O-N 2.9Å
460	Q	29.8	Very low	31.4	Very low	132 Å²	132	110.3 Å²	110.3	62%	0.617	58%	0.575	S	S	*	*	H	α-helix	trans	-62.6	-32.5	174.3	-69.9	-173.5	-10.1	0	0	112.3	D456 Y462 Q463 S464	D456-Q460 PolarHBondContact O-N 2.97Å; Q460-Y462 PolarHBondContact O-N 3.2Å; Q460-Q463 PolarHBondContact O-N 3.31Å; Q460-S464 PolarHBondContact O-N 3.49Å
461	G	29.2	Very low	32	Very low	31 Å²	31	106.5 Å²	106.5	32%	0.32	56%	0.556	S	S	.	*	H	α-helix	trans	-63.2	-15.8	174.2	0	0	0	0	0	114.9	I458 V459 R465	I458-G461 PolarHBondContact O-N 2.91Å; V459-G461 PolarHBondContact O-N 3.43Å; G461-R465 PolarHBondContact O-NE 2.91Å; G461-R465 PolarHBondContact O-NH2 3.16Å
462	Y	27.4	Very low	32.7	Very low	127 Å²	127	101.8 Å²	101.8	50%	0.498	54%	0.538	S	S	.	.	H	α-helix	trans	-95.2	-40.7	171.1	-75.6	-83.4	0	0	0	112.6	I458 V459 Q460 S464 R465 F466	I458-Y462 HydrophobicContact CG2-CE2 4.17Å; I458-Y462 WeakPolarHBondContact O-CD2 3.48Å; V459-Y462 PolarHBondContact O-N 3.46Å; V459-Y462 VanDerWaalsContact O-N 3.09Å; Q460-Y462 PolarHBondContact O-N 3.2Å; Y462-S464 VanDerWaalsContact C-N 3.32Å; Y462-S464 PolarHBondContact O-N 2.94Å; Y462-R465 PolarHBondContact O-N 3.22Å; Y462-F466 HydrophobicContact CD1-CE2 4.3Å
463	Q	30.3	Very low	33.7	Very low	114 Å²	114	97.4 Å²	97.4	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-57.3	-43.3	178.6	-70.5	-166.5	-92.6	0	0	112.7	V459 Q460 R465 A467	V459-Q463 PolarHBondContact O-N 2.9Å; Q460-Q463 PolarHBondContact O-N 3.31Å; Q463-R465 VanDerWaalsContact C-N 3.3Å; Q463-R465 PolarHBondContact O-N 3.24Å; Q463-A467 WeakPolarHBondContact O-CB 3.49Å; Q463-A467 PolarHBondContact O-N 2.87Å
464	S	34.8	Very low	34.3	Very low	81 Å²	81	87 Å²	87	57%	0.566	47%	0.469	S	S	*	.	H	α-helix	trans	-65.8	-29.4	-179.2	-172.7	0	0	0	0	113.7	Q460 Y462 N468	Q460-S464 PolarHBondContact O-N 3.49Å; Y462-S464 VanDerWaalsContact C-N 3.32Å; Y462-S464 PolarHBondContact O-N 2.94Å; S464-N468 PolarHBondContact O-ND2 3.42Å
465	R	31.9	Very low	35	Very low	150 Å²	150	84.7 Å²	84.7	57%	0.566	45%	0.453	S	S	*	.	H	α-helix	trans	-80.6	-25.1	-174.5	-79.8	-171.4	-77.2	177.4	-0.3	114.6	G461 Y462 Q463 L469	G461-R465 PolarHBondContact O-NE 2.91Å; G461-R465 PolarHBondContact O-NH2 3.16Å; Y462-R465 PolarHBondContact O-N 3.22Å; Q463-R465 VanDerWaalsContact C-N 3.3Å; Q463-R465 PolarHBondContact O-N 3.24Å; R465-L469 WeakPolarHBondContact O-CD1 3.19Å
466	F	36.8	Very low	35.6	Very low	74 Å²	74	78.5 Å²	78.5	33%	0.325	43%	0.427	S	S	.	.	H	α-helix	trans	-108.7	-24.6	-177	-67.3	-76.5	0	0	0	114.6	Y462 N468 L469 I477	Y462-F466 HydrophobicContact CD1-CE2 4.3Å; F466-N468 PolarHBondContact O-N 3.03Å; F466-N468 VanDerWaalsContact O-N 3.09Å; F466-L469 PolarHBondContact O-N 2.64Å; F466-I477 HydrophobicContact CE1-CB 4.42Å; F466-I477 HydrophobicContact CE1-CG2 3.9Å; F466-I477 HydrophobicContact CZ-CG2 4.44Å
467	A	35.6	Very low	36.2	Very low	75 Å²	75	77.5 Å²	77.5	62%	0.62	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.9	-176.9	0	0	0	0	0	115.2	Q463	Q463-A467 WeakPolarHBondContact O-CB 3.49Å; Q463-A467 PolarHBondContact O-N 2.87Å
468	N	39.4	Very low	36.9	Very low	113 Å²	113	76.5 Å²	76.5	60%	0.604	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	1.5	-177.9	-69	-58.6	0	0	0	114.2	S464 F466	S464-N468 PolarHBondContact O-ND2 3.42Å; F466-N468 PolarHBondContact O-N 3.03Å; F466-N468 VanDerWaalsContact O-N 3.09Å
469	L	37.8	Very low	37.6	Very low	34 Å²	34	71.1 Å²	71.1	18%	0.178	38%	0.376	C	S	.	.	S	Bend	trans	-101.1	129.2	179.6	-70.8	109.6	0	0	0	111	R465 F466 L471 Q473 I477	R465-L469 WeakPolarHBondContact O-CD1 3.19Å; F466-L469 PolarHBondContact O-N 2.64Å; L469-L471 PolarHBondContact O-N 3.43Å; L469-Q473 HydrophobicContact CB-CB 4.11Å; L469-Q473 HydrophobicContact CD2-CB 3.68Å; L469-I477 HydrophobicContact CD2-CD1 3.56Å
470	P	40.7	Very low	38.4	Very low	39 Å²	39	71.6 Å²	71.6	25%	0.253	37%	0.372	S	S	.	.			trans	-47.1	136.2	161.9	-29.3	35.5	0	0	0	111.4	Y472 Q473 G474	P470-Y472 VanDerWaalsContact C-N 3.25Å; P470-Y472 HydrophobicContact CB-CD1 3.88Å; P470-Y472 HydrophobicContact CB-CE1 3.67Å; P470-Y472 HydrophobicContact CG-CE1 4.46Å; P470-Y472 PolarHBondContact O-N 2.55Å; P470-Q473 WeakPolarHBondContact O-CA 3.37Å; P470-Q473 WeakPolarHBondContact O-CB 3.37Å; P470-Q473 PolarHBondContact O-N 3.14Å; P470-G474 PolarHBondContact O-N 2.84Å
471	L	40.2	Very low	39.3	Very low	68 Å²	68	70.1 Å²	70.1	36%	0.356	37%	0.366	S	S	.	.	H	α-helix	trans	-44.7	-43.8	-168.8	-75.3	155.8	0	0	0	114.4	M411 S414 L469 Q473 G474 Y475	M411-L471 HydrophobicContact CG-CD1 4.38Å; S414-L471 VanDerWaalsContact OG-CD1 3.32Å; S414-L471 WeakPolarHBondContact OG-CD1 3.34Å; L469-L471 PolarHBondContact O-N 3.43Å; L471-Q473 VanDerWaalsContact C-N 3.27Å; L471-Q473 PolarHBondContact O-N 2.92Å; L471-G474 WeakPolarHBondContact O-CA 3.43Å; L471-G474 PolarHBondContact O-N 3.42Å; L471-Y475 HydrophobicContact CB-CE2 4.36Å; L471-Y475 WeakPolarHBondContact O-CD2 3.3Å; L471-Y475 PolarHBondContact O-N 3.25Å
472	Y	40.5	Very low	40.1	Very low	116 Å²	116	70.1 Å²	70.1	46%	0.455	36%	0.358	S	S	.	.	H	α-helix	trans	-59.8	-32	178.5	79	-91.5	0	0	0	114	P470 G476	P470-Y472 VanDerWaalsContact C-N 3.25Å; P470-Y472 HydrophobicContact CB-CD1 3.88Å; P470-Y472 HydrophobicContact CB-CE1 3.67Å; P470-Y472 HydrophobicContact CG-CE1 4.46Å; P470-Y472 PolarHBondContact O-N 2.55Å; Y472-G476 PolarHBondContact O-N 2.89Å
473	Q	45.6	Very low	41.1	Very low	27 Å²	27	66.3 Å²	66.3	13%	0.126	35%	0.353	C	S	.	.	H	α-helix	trans	-76.3	-34.5	175.1	-57.2	177.9	1.1	0	0	111.1	L469 P470 L471 G476 I477 H816	L469-Q473 HydrophobicContact CB-CB 4.11Å; L469-Q473 HydrophobicContact CD2-CB 3.68Å; P470-Q473 WeakPolarHBondContact O-CA 3.37Å; P470-Q473 WeakPolarHBondContact O-CB 3.37Å; P470-Q473 PolarHBondContact O-N 3.14Å; L471-Q473 VanDerWaalsContact C-N 3.27Å; L471-Q473 PolarHBondContact O-N 2.92Å; Q473-G476 PolarHBondContact O-N 3.37Å; Q473-I477 WeakPolarHBondContact O-CG1 3.31Å; Q473-I477 PolarHBondContact O-N 3.28Å; Q473-H816 PolarHBondContact NE2-CE1 3.17Å
474	G	40.9	Very low	41.9	Very low	13 Å²	13	64.8 Å²	64.8	13%	0.134	35%	0.348	C	S	.	.	H	α-helix	trans	-59.8	-52.2	169.9	0	0	0	0	0	111.5	P470 L471 G476 I477 I478	P470-G474 PolarHBondContact O-N 2.84Å; L471-G474 WeakPolarHBondContact O-CA 3.43Å; L471-G474 PolarHBondContact O-N 3.42Å; G474-G476 VanDerWaalsContact C-N 3.32Å; G474-G476 PolarHBondContact O-N 3.44Å; G474-I477 PolarHBondContact O-N 2.9Å; G474-I478 VanDerWaalsContact O-CG1 3.32Å; G474-I478 WeakPolarHBondContact O-CG1 3.44Å; G474-I478 PolarHBondContact O-N 3.07Å
475	Y	45	Very low	42.2	Very low	62 Å²	62	61.7 Å²	61.7	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-58.9	-40.5	173.1	-72	-67.2	0	0	0	112.6	L471 I478 A479	L471-Y475 HydrophobicContact CB-CE2 4.36Å; L471-Y475 WeakPolarHBondContact O-CD2 3.3Å; L471-Y475 PolarHBondContact O-N 3.25Å; Y475-I478 PolarHBondContact O-N 3.4Å; Y475-A479 VanDerWaalsContact O-CB 3.3Å; Y475-A479 WeakPolarHBondContact O-CB 3.44Å; Y475-A479 PolarHBondContact O-N 2.86Å
476	G	41.3	Very low	42.8	Very low	31 Å²	31	58.2 Å²	58.2	32%	0.32	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-42.1	177	0	0	0	0	0	113.6	Y472 Q473 G474 H480	Y472-G476 PolarHBondContact O-N 2.89Å; Q473-G476 PolarHBondContact O-N 3.37Å; G474-G476 VanDerWaalsContact C-N 3.32Å; G474-G476 PolarHBondContact O-N 3.44Å; G476-H480 VanDerWaalsContact O-CB 3.32Å; G476-H480 WeakPolarHBondContact O-CB 3.38Å; G476-H480 PolarHBondContact O-N 3.41Å
477	I	44.5	Very low	43.2	Very low	70 Å²	70	61.8 Å²	61.8	36%	0.359	33%	0.334	S	S	.	.	H	α-helix	trans	-68.7	-41.1	175.4	-66.3	170.7	0	0	0	110.8	F466 L469 Q473 G474 H480 Q481	F466-I477 HydrophobicContact CE1-CB 4.42Å; F466-I477 HydrophobicContact CE1-CG2 3.9Å; F466-I477 HydrophobicContact CZ-CG2 4.44Å; L469-I477 HydrophobicContact CD2-CD1 3.56Å; Q473-I477 WeakPolarHBondContact O-CG1 3.31Å; Q473-I477 PolarHBondContact O-N 3.28Å; G474-I477 PolarHBondContact O-N 2.9Å; I477-H480 PolarHBondContact O-N 2.91Å; I477-Q481 WeakPolarHBondContact O-CB 3.36Å; I477-Q481 PolarHBondContact O-N 3.5Å
478	I	44	Very low	43.4	Very low	38 Å²	38	60.9 Å²	60.9	20%	0.195	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-47.5	176.3	-68.2	165.9	0	0	0	110.5	G474 Y475 H480 Q481 I482 F541	G474-I478 VanDerWaalsContact O-CG1 3.32Å; G474-I478 WeakPolarHBondContact O-CG1 3.44Å; G474-I478 PolarHBondContact O-N 3.07Å; Y475-I478 PolarHBondContact O-N 3.4Å; I478-H480 PolarHBondContact O-N 3.15Å; I478-Q481 PolarHBondContact O-N 2.83Å; I478-I482 HydrophobicContact CG2-CD1 3.8Å; I478-I482 HydrophobicContact CG2-CG1 4.48Å; I478-I482 VanDerWaalsContact O-CG1 3.28Å; I478-I482 WeakPolarHBondContact O-CG1 3.27Å; I478-I482 PolarHBondContact O-N 2.72Å; I478-F541 HydrophobicContact CD1-CE1 4.49Å; I478-F541 HydrophobicContact CD1-CZ 4.46Å; I478-F541 HydrophobicContact CG2-CD1 4.37Å
479	A	45.3	Very low	43.2	Very low	15 Å²	15	59 Å²	59	12%	0.124	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-41.7	176.7	0	0	0	0	0	112.3	Y475 I482 A483 L553	Y475-A479 VanDerWaalsContact O-CB 3.3Å; Y475-A479 WeakPolarHBondContact O-CB 3.44Å; Y475-A479 PolarHBondContact O-N 2.86Å; A479-I482 PolarHBondContact O-N 3.32Å; A479-A483 WeakPolarHBondContact O-CB 3.49Å; A479-A483 PolarHBondContact O-N 2.86Å; A479-L553 HydrophobicContact CB-CB 4.32Å; A479-L553 HydrophobicContact CB-CD1 4.5Å; A479-L553 HydrophobicContact CB-CD2 4.37Å
480	H	45.9	Very low	43.3	Very low	93 Å²	93	62 Å²	62	43%	0.431	34%	0.337	S	S	.	.	H	α-helix	trans	-64.2	-41.7	174.8	-171.6	73.1	0	0	0	112.1	G476 I477 I478 A483 L484	G476-H480 VanDerWaalsContact O-CB 3.32Å; G476-H480 WeakPolarHBondContact O-CB 3.38Å; G476-H480 PolarHBondContact O-N 3.41Å; I477-H480 PolarHBondContact O-N 2.91Å; I478-H480 PolarHBondContact O-N 3.15Å; H480-A483 PolarHBondContact O-N 3.41Å; H480-L484 WeakPolarHBondContact O-CG 3.33Å; H480-L484 PolarHBondContact O-N 3.25Å
481	Q	48	Very low	43.1	Very low	101 Å²	101	63.8 Å²	63.8	47%	0.472	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-39.3	177.4	-161.4	68.4	34.9	0	0	112.1	I477 I478 L484 S485	I477-Q481 WeakPolarHBondContact O-CB 3.36Å; I477-Q481 PolarHBondContact O-N 3.5Å; I478-Q481 PolarHBondContact O-N 2.83Å; Q481-L484 PolarHBondContact O-N 3.32Å; Q481-S485 WeakPolarHBondContact O-CB 3.1Å; Q481-S485 PolarHBondContact O-N 2.92Å
482	I	46.5	Very low	43.1	Very low	31 Å²	31	69.7 Å²	69.7	16%	0.159	38%	0.378	C	S	.	.	H	α-helix	trans	-63.2	-45.1	172.4	-67.7	168	0	0	0	110.3	I478 A479 L484 S485 N486 A538 F541	I478-I482 HydrophobicContact CG2-CD1 3.8Å; I478-I482 HydrophobicContact CG2-CG1 4.48Å; I478-I482 VanDerWaalsContact O-CG1 3.28Å; I478-I482 WeakPolarHBondContact O-CG1 3.27Å; I478-I482 PolarHBondContact O-N 2.72Å; A479-I482 PolarHBondContact O-N 3.32Å; I482-L484 PolarHBondContact O-N 3.45Å; I482-S485 PolarHBondContact O-N 3.4Å; I482-N486 WeakPolarHBondContact O-CB 3.42Å; I482-N486 VanDerWaalsContact O-CG 3.31Å; I482-N486 PolarHBondContact O-N 3.48Å; I482-A538 HydrophobicContact CG1-CB 3.93Å; I482-F541 HydrophobicContact CD1-CB 4.33Å
483	A	48.4	Very low	42.8	Very low	47 Å²	47	73.3 Å²	73.3	39%	0.388	40%	0.396	S	S	.	.	H	α-helix	trans	-62	-41.3	177.7	0	0	0	0	0	112.5	A479 H480 K487	A479-A483 WeakPolarHBondContact O-CB 3.49Å; A479-A483 PolarHBondContact O-N 2.86Å; H480-A483 PolarHBondContact O-N 3.41Å; A483-K487 WeakPolarHBondContact O-CB 3.48Å; A483-K487 PolarHBondContact O-N 3.4Å
484	L	46.9	Very low	42	Very low	83 Å²	83	76.6 Å²	76.6	44%	0.435	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-44.1	173.6	-70.9	176	0	0	0	112.4	H480 Q481 I482 N486 K487 A488	H480-L484 WeakPolarHBondContact O-CG 3.33Å; H480-L484 PolarHBondContact O-N 3.25Å; Q481-L484 PolarHBondContact O-N 3.32Å; I482-L484 PolarHBondContact O-N 3.45Å; L484-N486 PolarHBondContact O-N 2.88Å; L484-K487 PolarHBondContact O-N 3.42Å; L484-A488 PolarHBondContact O-N 3.2Å
485	S	42.1	Very low	41.4	Very low	16 Å²	16	82.3 Å²	82.3	11%	0.112	45%	0.454	C	S	.	.	H	α-helix	trans	-61.6	-43.8	176.4	-159.6	0	0	0	0	111.3	Q481 I482 K487 A488 N489 N535	Q481-S485 WeakPolarHBondContact O-CB 3.1Å; Q481-S485 PolarHBondContact O-N 2.92Å; I482-S485 PolarHBondContact O-N 3.4Å; S485-K487 PolarHBondContact O-N 2.9Å; S485-A488 PolarHBondContact O-N 3.27Å; S485-N489 PolarHBondContact O-N 3.07Å; S485-N489 PolarHBondContact O-ND2 3.37Å; S485-N535 PolarHBondContact OG-OD1 3.2Å
486	N	43.4	Very low	40.8	Very low	77 Å²	77	84.8 Å²	84.8	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-63.5	-40.4	176.9	-73	-13.7	0	0	0	111.8	I482 L484 A488 N489 T490	I482-N486 WeakPolarHBondContact O-CB 3.42Å; I482-N486 VanDerWaalsContact O-CG 3.31Å; I482-N486 PolarHBondContact O-N 3.48Å; L484-N486 PolarHBondContact O-N 2.88Å; N486-A488 VanDerWaalsContact C-N 3.33Å; N486-A488 PolarHBondContact O-N 3.3Å; N486-N489 PolarHBondContact O-N 3.45Å; N486-T490 WeakPolarHBondContact O-CG2 3.34Å; N486-T490 PolarHBondContact O-N 2.9Å; N486-T490 PolarHBondContact O-OG1 3.23Å
487	K	44.5	Very low	40.2	Very low	148 Å²	148	92.2 Å²	92.2	64%	0.643	51%	0.505	S	S	*	.	H	α-helix	trans	-65.1	-33.8	175.3	-167.5	175.1	-177.5	-179.2	0	112.8	A483 L484 S485 T490 A491	A483-K487 WeakPolarHBondContact O-CB 3.48Å; A483-K487 PolarHBondContact O-N 3.4Å; L484-K487 PolarHBondContact O-N 3.42Å; S485-K487 PolarHBondContact O-N 2.9Å; K487-T490 PolarHBondContact O-OG1 2.81Å; K487-A491 WeakPolarHBondContact O-CB 3.44Å; K487-A491 PolarHBondContact O-N 2.86Å
488	A	41.3	Very low	39.5	Very low	57 Å²	57	95.1 Å²	95.1	47%	0.471	53%	0.525	S	S	.	.	H	α-helix	trans	-71.8	-33.8	173.4	0	0	0	0	0	112.8	L484 S485 N486	L484-A488 PolarHBondContact O-N 3.2Å; S485-A488 PolarHBondContact O-N 3.27Å; N486-A488 VanDerWaalsContact C-N 3.33Å; N486-A488 PolarHBondContact O-N 3.3Å
489	N	35.3	Very low	39	Very low	73 Å²	73	101.7 Å²	101.7	39%	0.39	56%	0.556	S	S	.	*	H	α-helix	trans	-76.1	-39.4	178.6	-71.1	-23.4	0	0	0	112.8	S485 N486 K492 N535	S485-N489 PolarHBondContact O-N 3.07Å; S485-N489 PolarHBondContact O-ND2 3.37Å; N486-N489 PolarHBondContact O-N 3.45Å; N489-K492 PolarHBondContact O-N 3.02Å; N489-N535 PolarHBondContact ND2-OD1 2.92Å
490	T	38.5	Very low	38	Very low	96 Å²	96	107.8 Å²	107.8	59%	0.589	59%	0.586	S	S	*	*	H	α-helix	trans	-67.2	-37.3	177.3	52.3	0	0	0	0	112.2	N486 K487 K492 K493	N486-T490 WeakPolarHBondContact O-CG2 3.34Å; N486-T490 PolarHBondContact O-N 2.9Å; N486-T490 PolarHBondContact O-OG1 3.23Å; K487-T490 PolarHBondContact O-OG1 2.81Å; T490-K492 PolarHBondContact O-N 3.08Å; T490-K493 PolarHBondContact O-N 3.49Å; T490-K493 VanDerWaalsContact O-N 3.13Å
491	A	37.3	Very low	37.5	Very low	78 Å²	78	110.7 Å²	110.7	65%	0.645	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-9.4	175.1	0	0	0	0	0	114.7	K487	K487-A491 WeakPolarHBondContact O-CB 3.44Å; K487-A491 PolarHBondContact O-N 2.86Å
492	K	39.5	Very low	36.7	Very low	191 Å²	191	112 Å²	112	83%	0.83	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	7.7	177.1	-71.9	-173.5	174	-176	0	114.2	N489 T490	N489-K492 PolarHBondContact O-N 3.02Å; T490-K492 PolarHBondContact O-N 3.08Å
493	K	34.1	Very low	36.3	Very low	193 Å²	193	118.1 Å²	118.1	84%	0.839	65%	0.646	S	S	*	*	S	Bend	trans	-133.8	29.7	-175.1	-147.4	-175.4	179.1	-176.2	0	114.9	T490	T490-K493 PolarHBondContact O-N 3.49Å; T490-K493 VanDerWaalsContact O-N 3.13Å
494	S	30	Very low	35.7	Very low	95 Å²	95	122.2 Å²	122.2	66%	0.664	66%	0.662	S	S	*	*			trans	-131	69.6	177.9	63.2	0	0	0	0	112
495	T	28.3	Very low	35.3	Very low	133 Å²	133	125.8 Å²	125.8	82%	0.816	68%	0.676	S	S	*	*			trans	-116.3	117.1	162.2	-47.9	0	0	0	0	106.6
496	P	31	Very low	34.9	Very low	115 Å²	115	132.1 Å²	132.1	75%	0.747	71%	0.708	S	S	*	*			trans	-66.5	145	179.6	-19.9	32.7	0	0	0	111.8
497	E	28.6	Very low	34.4	Very low	187 Å²	187	131.1 Å²	131.1	87%	0.874	72%	0.716	S	S	*	*			trans	-74.7	128.4	165.8	-62.4	174	135.3	0	0	108.9
498	T	30.7	Very low	33.7	Very low	130 Å²	130	130.7 Å²	130.7	80%	0.798	72%	0.721	S	S	*	*			trans	-101.8	115.8	169	-52.4	0	0	0	0	108.2
499	Q	33.4	Very low	33.3	Very low	177 Å²	177	134.2 Å²	134.2	83%	0.827	73%	0.732	S	S	*	*			trans	-84.2	143.3	171.8	-70.5	-174.8	-23	0	0	110.6
500	N	25	Very low	33.3	Very low	142 Å²	142	139.7 Å²	139.7	76%	0.759	76%	0.755	S	S	*	*			trans	-80.1	152.5	175.5	-57.6	-38.4	0	0	0	111.4
501	I	33.8	Very low	32.6	Very low	155 Å²	155	143.9 Å²	143.9	80%	0.795	77%	0.768	S	S	*	*			trans	-175	92.9	145.8	-91.4	145.8	0	0	0	102.4
502	D	32.8	Very low	32.3	Very low	129 Å²	129	146.4 Å²	146.4	69%	0.69	78%	0.775	S	S	*	*				74.7	111.4	89.8	-64.1	-37.5	0	0	0	112.1
503	D	36.7	Very low	31.6	Very low	159 Å²	159	141.9 Å²	141.9	85%	0.85	77%	0.768	S	S	*	*			trans	179.3	99.6	135.6	-94.2	-13.7	0	0	0	112.7
504	D	35.9	Very low	31.2	Very low	132 Å²	132	139.3 Å²	139.3	71%	0.706	76%	0.762	S	S	*	*			trans	56.2	143	133.8	-115.1	-23	0	0	0	127
505	H	39.2	Very low	31.1	Very low	158 Å²	158	141.2 Å²	141.2	73%	0.731	77%	0.765	S	S	*	*			trans	66.6	153.2	156.9	-68.8	22.9	0	0	0	121.7
506	N	32.8	Very low	30.9	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	76%	0.764	S	S	*	*			cis	-168.5	151.5	-37.3	-158.3	-5.6	0	0	0	110.1
507	G	33	Very low	30.7	Very low	56 Å²	56	143 Å²	143	58%	0.577	77%	0.767	S	S	*	*			trans	100	119	172.1	0	0	0	0	0	115.6
508	N	29.9	Very low	30.4	Very low	139 Å²	139	139 Å²	139	74%	0.743	76%	0.759	S	S	*	*				86.3	130.7	62.4	-78.8	60.5	0	0	0	112.4
509	D	34.1	Very low	30.2	Very low	131 Å²	131	140.5 Å²	140.5	70%	0.701	76%	0.762	S	S	*	*			cis	-147.3	176	11.5	-72.7	-59.3	0	0	0	113.1
510	Q	33.7	Very low	29.9	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	76%	0.759	S	S	*	*			trans	68	101.9	164.9	-55.2	-179.1	10.1	0	0	116.6
511	E	25.1	Very low	30	Very low	185 Å²	185	138.9 Å²	138.9	86%	0.864	76%	0.764	S	S	*	*			cis	86.7	104.2	22.5	-155.3	-179.5	-124.5	0	0	116.8
512	T	29.6	Very low	29.6	Very low	130 Å²	130	137.7 Å²	137.7	80%	0.798	76%	0.759	S	S	*	*			trans	174.1	98.6	146.6	22.4	0	0	0	0	108.1
513	S	24.7	Very low	29.2	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	77%	0.766	S	S	*	*				58.1	128.4	92.5	71.6	0	0	0	0	114.4
514	I	26.4	Very low	28.6	Very low	140 Å²	140	135 Å²	135	72%	0.718	76%	0.759	S	S	*	*				-169	145.4	70.4	-84.7	173.4	0	0	0	111.5
515	N	27.8	Very low	28.1	Very low	134 Å²	134	137.9 Å²	137.9	72%	0.717	77%	0.769	S	S	*	*			trans	61.7	134.9	164.5	-63.2	-12.2	0	0	0	118.5
516	L	23.6	Very low	27.5	Very low	153 Å²	153	138.2 Å²	138.2	80%	0.801	77%	0.774	S	S	*	*				57.9	128.8	58	-68	94.4	0	0	0	112.1
517	V	26.9	Very low	27.3	Very low	133 Å²	133	135.5 Å²	135.5	81%	0.806	77%	0.767	S	S	*	*				-150.7	153.3	55.4	155.9	0	0	0	0	111.3
518	S	22.8	Very low	27.2	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	78%	0.775	S	S	*	*			trans	-80.1	141.2	169.2	-46.3	0	0	0	0	112
519	D	26.7	Very low	27.2	Very low	161 Å²	161	138.6 Å²	138.6	86%	0.861	77%	0.766	S	S	*	*			trans	-169.3	151.2	137.2	-100.3	-25.4	0	0	0	112.9
520	P	27.3	Very low	27.1	Very low	115 Å²	115	136.3 Å²	136.3	75%	0.747	76%	0.761	S	S	*	*			trans	-111.2	140.9	-175.7	39	-30.1	0	0	0	114.6
521	I	26.3	Very low	27	Very low	170 Å²	170	129.2 Å²	129.2	87%	0.872	74%	0.738	S	S	*	*			trans	-149.6	143.5	166.4	-52	178.1	0	0	0	108.2
522	D	26	Very low	27.5	Very low	131 Å²	131	124.2 Å²	124.2	70%	0.701	72%	0.72	S	S	*	*			cis	-177	106.1	-38	-177.9	24.1	0	0	0	104.2
523	I	23.5	Very low	27.7	Very low	163 Å²	163	122 Å²	122	84%	0.836	70%	0.703	S	S	*	*			trans	20.1	118.5	149.9	-52.8	172.9	0	0	0	118.2
524	G	24.2	Very low	28.2	Very low	68 Å²	68	121.2 Å²	121.2	70%	0.701	69%	0.69	S	S	*	*			trans	-177.1	109.5	162.1	0	0	0	0	0	116.8
525	Q	26.1	Very low	28.6	Very low	193 Å²	193	116.4 Å²	116.4	90%	0.902	67%	0.666	S	S	*	*			trans	58.7	88.1	153.6	-53.1	-178.7	32.4	0	0	119
526	I	27.1	Very low	29.3	Very low	164 Å²	164	115 Å²	115	84%	0.841	66%	0.659	S	S	*	*				-155.9	126.8	121.1	-91.7	143.7	0	0	0	106
527	S	27.9	Very low	29.9	Very low	93 Å²	93	110.4 Å²	110.4	65%	0.65	64%	0.637	S	S	*	*			trans	-109.2	108.7	-175.1	54.5	0	0	0	0	111.6	Q529	S527-Q529 PolarHBondContact O-N 3.01Å
528	D	30.4	Very low	30.4	Very low	138 Å²	138	104.4 Å²	104.4	74%	0.738	60%	0.601	S	S	*	*			trans	-73.9	55.2	178	-79.5	-32	0	0	0	113.3	S530	D528-S530 VanDerWaalsContact C-N 3.26Å; D528-S530 PolarHBondContact O-N 3.44Å
529	Q	31.4	Very low	31.2	Very low	121 Å²	121	103.7 Å²	103.7	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-69.9	-21.9	-176.4	-137.9	66.3	40.9	0	0	113.5	S527 G531 T532	S527-Q529 PolarHBondContact O-N 3.01Å; Q529-G531 VanDerWaalsContact C-N 3.33Å; Q529-G531 PolarHBondContact O-N 2.65Å; Q529-T532 PolarHBondContact O-OG1 3Å
530	S	32	Very low	31.9	Very low	84 Å²	84	97.4 Å²	97.4	59%	0.587	56%	0.56	S	S	*	*	H	α-helix	trans	-69.7	-26.4	-177.5	58.2	0	0	0	0	113.7	D528 I534	D528-S530 VanDerWaalsContact C-N 3.26Å; D528-S530 PolarHBondContact O-N 3.44Å; S530-I534 WeakPolarHBondContact O-CG1 3.45Å
531	G	32	Very low	32.3	Very low	38 Å²	38	93.2 Å²	93.2	39%	0.392	53%	0.53	S	S	.	.	H	α-helix	trans	-74.5	-34	-179.7	0	0	0	0	0	113.6	Q529 N535	Q529-G531 VanDerWaalsContact C-N 3.33Å; Q529-G531 PolarHBondContact O-N 2.65Å; G531-N535 PolarHBondContact O-ND2 3.41Å
532	T	34.9	Very low	33	Very low	80 Å²	80	87 Å²	87	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-72.5	-42.7	179.1	37.6	0	0	0	0	112.3	Q529 I534 N535 L536	Q529-T532 PolarHBondContact O-OG1 3Å; T532-I534 PolarHBondContact O-N 2.71Å; T532-N535 PolarHBondContact O-N 3.23Å; T532-L536 PolarHBondContact O-N 3.39Å
533	D	32.9	Very low	33.9	Very low	85 Å²	85	88.9 Å²	88.9	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-39.1	-176.1	-70.9	1.2	0	0	0	111.7	N535 L536 V537	D533-N535 VanDerWaalsContact C-N 3.32Å; D533-N535 PolarHBondContact O-N 3.48Å; D533-L536 PolarHBondContact O-N 3.46Å; D533-V537 WeakPolarHBondContact O-CB 3.49Å; D533-V537 WeakPolarHBondContact O-CG2 3.3Å; D533-V537 PolarHBondContact O-N 2.82Å
534	I	35.5	Very low	34.9	Very low	78 Å²	78	85.1 Å²	85.1	40%	0.4	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-37.8	176.2	-66.4	171.7	0	0	0	111.4	S530 T532 A538	S530-I534 WeakPolarHBondContact O-CG1 3.45Å; T532-I534 PolarHBondContact O-N 2.71Å; I534-A538 WeakPolarHBondContact O-CB 3.33Å; I534-A538 PolarHBondContact O-N 2.61Å
535	N	36	Very low	35.6	Very low	39 Å²	39	83.1 Å²	83.1	21%	0.209	46%	0.462	C	S	.	.	H	α-helix	trans	-69.7	-35.7	174.6	-80.3	-77.2	0	0	0	112.2	S485 N489 G531 T532 D533 A538 N539	S485-N535 PolarHBondContact OG-OD1 3.2Å; N489-N535 PolarHBondContact ND2-OD1 2.92Å; G531-N535 PolarHBondContact O-ND2 3.41Å; T532-N535 PolarHBondContact O-N 3.23Å; D533-N535 VanDerWaalsContact C-N 3.32Å; D533-N535 PolarHBondContact O-N 3.48Å; N535-A538 PolarHBondContact O-N 2.83Å; N535-N539 WeakPolarHBondContact O-CB 3.32Å; N535-N539 VanDerWaalsContact O-CG 3.32Å; N535-N539 PolarHBondContact O-N 3.4Å; N535-N539 PolarHBondContact O-ND2 3.09Å
536	L	42.5	Very low	36.7	Very low	106 Å²	106	78.6 Å²	78.6	56%	0.555	44%	0.444	S	S	*	.	H	α-helix	trans	-68.9	-40.9	175.4	-154.4	74.7	0	0	0	111.6	T532 D533 N539 A540	T532-L536 PolarHBondContact O-N 3.39Å; D533-L536 PolarHBondContact O-N 3.46Å; L536-N539 PolarHBondContact O-N 2.89Å; L536-A540 VanDerWaalsContact O-CB 3.31Å; L536-A540 WeakPolarHBondContact O-CB 3.44Å; L536-A540 PolarHBondContact O-N 3.23Å
537	V	35.9	Very low	37.6	Very low	56 Å²	56	78.5 Å²	78.5	34%	0.339	44%	0.44	S	S	.	.	H	α-helix	trans	-57.7	-48.7	170.8	170.1	0	0	0	0	110.9	F425 D533 A540 F541	F425-V537 HydrophobicContact CD1-CG2 3.94Å; F425-V537 HydrophobicContact CE1-CB 3.96Å; F425-V537 HydrophobicContact CE1-CG1 4.31Å; F425-V537 HydrophobicContact CE1-CG2 3.37Å; F425-V537 HydrophobicContact CE2-CG1 4.48Å; F425-V537 HydrophobicContact CZ-CB 3.99Å; F425-V537 HydrophobicContact CZ-CG1 3.85Å; F425-V537 HydrophobicContact CZ-CG2 3.77Å; D533-V537 WeakPolarHBondContact O-CB 3.49Å; D533-V537 WeakPolarHBondContact O-CG2 3.3Å; D533-V537 PolarHBondContact O-N 2.82Å; V537-A540 PolarHBondContact O-N 3.1Å; V537-F541 HydrophobicContact CG1-CD2 4.43Å; V537-F541 PolarHBondContact O-N 3.42Å
538	A	37.2	Very low	38.3	Very low	7 Å²	7	77.7 Å²	77.7	6%	0.058	44%	0.435	C	S	.	.	H	α-helix	trans	-61.3	-46.3	180	0	0	0	0	0	112.2	I482 I534 N535 F541 A542	I482-A538 HydrophobicContact CG1-CB 3.93Å; I534-A538 WeakPolarHBondContact O-CB 3.33Å; I534-A538 PolarHBondContact O-N 2.61Å; N535-A538 PolarHBondContact O-N 2.83Å; A538-F541 PolarHBondContact O-N 3.12Å; A538-A542 WeakPolarHBondContact O-CB 3.4Å; A538-A542 PolarHBondContact O-N 3.15Å
539	N	39.5	Very low	39.1	Very low	87 Å²	87	74.6 Å²	74.6	47%	0.465	42%	0.417	S	S	.	.	H	α-helix	trans	-67.5	-40	178.5	-71.6	-25.1	0	0	0	112.2	N535 L536 F541 A542 H543	N535-N539 WeakPolarHBondContact O-CB 3.32Å; N535-N539 VanDerWaalsContact O-CG 3.32Å; N535-N539 PolarHBondContact O-N 3.4Å; N535-N539 PolarHBondContact O-ND2 3.09Å; L536-N539 PolarHBondContact O-N 2.89Å; N539-F541 VanDerWaalsContact C-N 3.34Å; N539-F541 PolarHBondContact O-N 3.49Å; N539-A542 PolarHBondContact O-N 2.78Å; N539-H543 PolarHBondContact O-CD2 3.47Å; N539-H543 PolarHBondContact O-N 2.71Å; N539-H543 VanDerWaalsContact O-N 3.15Å
540	A	41	Very low	39.8	Very low	30 Å²	30	72.8 Å²	72.8	25%	0.248	41%	0.411	C	S	.	.	H	α-helix	trans	-62	-40.9	174.4	0	0	0	0	0	112	F425 L536 V537 H543	F425-A540 HydrophobicContact CZ-CB 4.47Å; L536-A540 VanDerWaalsContact O-CB 3.31Å; L536-A540 WeakPolarHBondContact O-CB 3.44Å; L536-A540 PolarHBondContact O-N 3.23Å; V537-A540 PolarHBondContact O-N 3.1Å; A540-H543 PolarHBondContact O-N 3.05Å
541	F	36.2	Very low	40.7	Very low	27 Å²	27	74.5 Å²	74.5	12%	0.118	41%	0.408	C	S	.	.	H	α-helix	trans	-68.3	-37.2	173.3	-104.6	-86.3	0	0	0	113	A421 F425 I478 I482 V537 A538 N539 H543 L544 L545	A421-F541 HydrophobicContact CB-CE2 4.08Å; A421-F541 HydrophobicContact CB-CZ 4.1Å; F425-F541 HydrophobicContact CE2-CE2 4.2Å; F425-F541 HydrophobicContact CZ-CD2 4.48Å; I478-F541 HydrophobicContact CD1-CE1 4.49Å; I478-F541 HydrophobicContact CD1-CZ 4.46Å; I478-F541 HydrophobicContact CG2-CD1 4.37Å; I482-F541 HydrophobicContact CD1-CB 4.33Å; V537-F541 HydrophobicContact CG1-CD2 4.43Å; V537-F541 PolarHBondContact O-N 3.42Å; A538-F541 PolarHBondContact O-N 3.12Å; N539-F541 VanDerWaalsContact C-N 3.34Å; N539-F541 PolarHBondContact O-N 3.49Å; F541-H543 VanDerWaalsContact C-N 3.27Å; F541-H543 PolarHBondContact O-N 3.4Å; F541-L544 PolarHBondContact O-N 2.94Å; F541-L545 WeakPolarHBondContact O-CG 3.49Å; F541-L545 PolarHBondContact O-N 3.45Å
542	A	40.6	Very low	41.3	Very low	39 Å²	39	79.5 Å²	79.5	32%	0.322	42%	0.419	S	S	.	.	H	α-helix	trans	-61.4	-35.9	176.8	0	0	0	0	0	112.2	A538 N539 L544 L545	A538-A542 WeakPolarHBondContact O-CB 3.4Å; A538-A542 PolarHBondContact O-N 3.15Å; N539-A542 PolarHBondContact O-N 2.78Å; A542-L544 VanDerWaalsContact C-N 3.25Å; A542-L544 PolarHBondContact O-N 3.33Å; A542-L545 PolarHBondContact O-N 2.87Å
543	H	45.1	Very low	41.6	Very low	170 Å²	170	76.6 Å²	76.6	79%	0.787	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.8	174	-71.6	-58.8	0	0	0	114.8	N539 A540 F541	N539-H543 PolarHBondContact O-CD2 3.47Å; N539-H543 PolarHBondContact O-N 2.71Å; N539-H543 VanDerWaalsContact O-N 3.15Å; A540-H543 PolarHBondContact O-N 3.05Å; F541-H543 VanDerWaalsContact C-N 3.27Å; F541-H543 PolarHBondContact O-N 3.4Å
544	L	43.9	Very low	42.1	Very low	84 Å²	84	78.5 Å²	78.5	44%	0.44	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-2.1	175.6	-73.6	164.7	0	0	0	113.2	F541 A542	F541-L544 PolarHBondContact O-N 2.94Å; A542-L544 VanDerWaalsContact C-N 3.25Å; A542-L544 PolarHBondContact O-N 3.33Å
545	L	39.4	Very low	42.7	Very low	27 Å²	27	79.2 Å²	79.2	14%	0.141	40%	0.404	C	S	.	.	S	Bend	trans	-114.2	117	-176.8	-63.2	169.6	0	0	0	110.3	F541 A542 I549 L550 L553	F541-L545 WeakPolarHBondContact O-CG 3.49Å; F541-L545 PolarHBondContact O-N 3.45Å; A542-L545 PolarHBondContact O-N 2.87Å; L545-I549 HydrophobicContact CD2-CB 4.46Å; L545-I549 HydrophobicContact CD2-CG2 3.81Å; L545-L550 HydrophobicContact CB-CD1 4.47Å; L545-L550 HydrophobicContact CB-CG 4.05Å; L545-L553 HydrophobicContact CD1-CD1 4.01Å; L545-L553 HydrophobicContact CD2-CD1 4.35Å
546	D	48.7	Very low	42.8	Very low	98 Å²	98	79 Å²	79	52%	0.524	41%	0.407	S	S	.	.			trans	-63.4	156.2	171.3	176.6	54.3	0	0	0	111.7	S548 I549 L550	D546-S548 PolarHBondContact O-N 2.95Å; D546-S548 VanDerWaalsContact OD2-CB 3.27Å; D546-S548 WeakPolarHBondContact OD2-CB 3.43Å; D546-S548 PolarHBondContact OD2-N 2.94Å; D546-S548 VanDerWaalsContact OD2-N 3.14Å; D546-S548 PolarHBondContact OD2-OG 3.25Å; D546-I549 HydrophobicContact CB-CD1 4.4Å; D546-I549 HydrophobicContact CB-CG1 4.39Å; D546-I549 WeakPolarHBondContact O-CA 3.3Å; D546-I549 PolarHBondContact O-N 3.04Å; D546-L550 PolarHBondContact O-N 3.24Å
547	E	46.9	Very low	42.7	Very low	161 Å²	161	75.3 Å²	75.3	75%	0.752	39%	0.389	S	S	*	.	H	α-helix	trans	-54.6	-36.3	179.2	-173.6	178.6	-136.9	0	0	112	I549 L550 K551	E547-I549 VanDerWaalsContact C-N 3.33Å; E547-I549 PolarHBondContact O-N 3.19Å; E547-L550 PolarHBondContact O-N 2.55Å; E547-K551 WeakPolarHBondContact O-CB 3.27Å; E547-K551 PolarHBondContact O-N 2.99Å
548	S	42	Very low	42.9	Very low	77 Å²	77	75.5 Å²	75.5	54%	0.538	39%	0.388	S	S	.	.	H	α-helix	trans	-63.8	-36.2	175.7	66.4	0	0	0	0	113.2	D546 F552	D546-S548 PolarHBondContact O-N 2.95Å; D546-S548 VanDerWaalsContact OD2-CB 3.27Å; D546-S548 WeakPolarHBondContact OD2-CB 3.43Å; D546-S548 PolarHBondContact OD2-N 2.94Å; D546-S548 VanDerWaalsContact OD2-N 3.14Å; D546-S548 PolarHBondContact OD2-OG 3.25Å; S548-F552 PolarHBondContact O-N 2.8Å
549	I	47.1	Very low	43.2	Very low	72 Å²	72	80.2 Å²	80.2	37%	0.369	41%	0.409	S	S	.	.	H	α-helix	trans	-77.9	-41	178.1	-51.5	175.7	0	0	0	110	L545 D546 E547 K551 F552 L553	L545-I549 HydrophobicContact CD2-CB 4.46Å; L545-I549 HydrophobicContact CD2-CG2 3.81Å; D546-I549 HydrophobicContact CB-CD1 4.4Å; D546-I549 HydrophobicContact CB-CG1 4.39Å; D546-I549 WeakPolarHBondContact O-CA 3.3Å; D546-I549 PolarHBondContact O-N 3.04Å; E547-I549 VanDerWaalsContact C-N 3.33Å; E547-I549 PolarHBondContact O-N 3.19Å; I549-K551 VanDerWaalsContact C-N 3.32Å; I549-K551 PolarHBondContact O-N 3.17Å; I549-F552 PolarHBondContact O-N 3.49Å; I549-L553 HydrophobicContact CG2-CD1 4.03Å; I549-L553 HydrophobicContact CG2-CG 4.31Å; I549-L553 WeakPolarHBondContact O-CB 3.35Å; I549-L553 VanDerWaalsContact O-CG 3.29Å; I549-L553 WeakPolarHBondContact O-CG 3.34Å; I549-L553 PolarHBondContact O-N 3.25Å
550	L	47.4	Very low	43	Very low	84 Å²	84	81.4 Å²	81.4	44%	0.44	41%	0.412	S	S	.	.	H	α-helix	trans	-58	-43.8	172	-83.2	162.7	0	0	0	111.5	L545 D546 E547 L553 Y554	L545-L550 HydrophobicContact CB-CD1 4.47Å; L545-L550 HydrophobicContact CB-CG 4.05Å; D546-L550 PolarHBondContact O-N 3.24Å; E547-L550 PolarHBondContact O-N 2.55Å; L550-L553 PolarHBondContact O-N 3.08Å; L550-Y554 VanDerWaalsContact O-CB 3.3Å; L550-Y554 WeakPolarHBondContact O-CB 3.48Å; L550-Y554 PolarHBondContact O-N 2.67Å
551	K	49.4	Very low	42.7	Very low	119 Å²	119	85 Å²	85	52%	0.517	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-45.7	175.5	-170.1	178	-176.1	-62.4	0	111.6	E547 I549 L553 Y554 E555	E547-K551 WeakPolarHBondContact O-CB 3.27Å; E547-K551 PolarHBondContact O-N 2.99Å; I549-K551 VanDerWaalsContact C-N 3.32Å; I549-K551 PolarHBondContact O-N 3.17Å; K551-L553 PolarHBondContact O-N 2.91Å; K551-Y554 PolarHBondContact O-N 2.61Å; K551-E555 IonicContact NZ-OE2 3.63Å; K551-E555 PolarHBondContact NZ-OE2 3.26Å; K551-E555 WeakPolarHBondContact O-CB 3.29Å; K551-E555 PolarHBondContact O-N 2.92Å
552	F	44.4	Very low	42.6	Very low	144 Å²	144	90 Å²	90	63%	0.632	46%	0.459	S	S	*	.	H	α-helix	trans	-59.8	-44.3	175.2	173.3	-97.9	0	0	0	112.5	S548 I549 E555 A556	S548-F552 PolarHBondContact O-N 2.8Å; I549-F552 PolarHBondContact O-N 3.49Å; F552-E555 PolarHBondContact O-N 3.17Å; F552-A556 WeakPolarHBondContact O-CB 3.06Å; F552-A556 PolarHBondContact O-N 2.94Å
553	L	41.1	Very low	42.4	Very low	18 Å²	18	91.2 Å²	91.2	9%	0.094	46%	0.455	C	S	.	.	H	α-helix	trans	-66.3	-37.5	177.2	-71	171.7	0	0	0	111.9	A479 L545 I549 L550 K551 T557	A479-L553 HydrophobicContact CB-CB 4.32Å; A479-L553 HydrophobicContact CB-CD1 4.5Å; A479-L553 HydrophobicContact CB-CD2 4.37Å; L545-L553 HydrophobicContact CD1-CD1 4.01Å; L545-L553 HydrophobicContact CD2-CD1 4.35Å; I549-L553 HydrophobicContact CG2-CD1 4.03Å; I549-L553 HydrophobicContact CG2-CG 4.31Å; I549-L553 WeakPolarHBondContact O-CB 3.35Å; I549-L553 VanDerWaalsContact O-CG 3.29Å; I549-L553 WeakPolarHBondContact O-CG 3.34Å; I549-L553 PolarHBondContact O-N 3.25Å; L550-L553 PolarHBondContact O-N 3.08Å; K551-L553 PolarHBondContact O-N 2.91Å; L553-T557 VanDerWaalsContact O-CB 3.25Å; L553-T557 WeakPolarHBondContact O-CB 3.35Å; L553-T557 PolarHBondContact O-N 3Å; L553-T557 PolarHBondContact O-OG1 3.24Å
554	Y	44.3	Very low	41.8	Very low	126 Å²	126	87 Å²	87	49%	0.494	45%	0.445	S	S	.	.	H	α-helix	trans	-66.7	-44.3	174.7	-176	-107.3	0	0	0	111.8	L550 K551 A556 T557 N558	L550-Y554 VanDerWaalsContact O-CB 3.3Å; L550-Y554 WeakPolarHBondContact O-CB 3.48Å; L550-Y554 PolarHBondContact O-N 2.67Å; K551-Y554 PolarHBondContact O-N 2.61Å; Y554-A556 PolarHBondContact O-N 2.97Å; Y554-T557 PolarHBondContact O-N 2.98Å; Y554-N558 WeakPolarHBondContact CE1-ND2 3.42Å; Y554-N558 WeakPolarHBondContact O-CB 3.43Å; Y554-N558 PolarHBondContact O-N 3.47Å
555	E	47.8	Very low	41	Very low	92 Å²	92	86.9 Å²	86.9	43%	0.43	46%	0.464	S	S	.	.	H	α-helix	trans	-58.6	-47	174.3	-156.9	104.6	-141.3	0	0	110.8	K551 F552 N558 Q559	K551-E555 IonicContact NZ-OE2 3.63Å; K551-E555 PolarHBondContact NZ-OE2 3.26Å; K551-E555 WeakPolarHBondContact O-CB 3.29Å; K551-E555 PolarHBondContact O-N 2.92Å; F552-E555 PolarHBondContact O-N 3.17Å; E555-N558 PolarHBondContact O-N 3.21Å; E555-Q559 VanDerWaalsContact O-CG 3.29Å; E555-Q559 WeakPolarHBondContact O-CG 3.41Å; E555-Q559 PolarHBondContact O-N 3.45Å
556	A	38.5	Very low	40.5	Very low	35 Å²	35	90.2 Å²	90.2	29%	0.289	49%	0.489	S	S	.	.	H	α-helix	trans	-67	-35.6	175.5	0	0	0	0	0	113.1	F552 Y554 Q559 Q560	F552-A556 WeakPolarHBondContact O-CB 3.06Å; F552-A556 PolarHBondContact O-N 2.94Å; Y554-A556 PolarHBondContact O-N 2.97Å; A556-Q559 PolarHBondContact O-N 3.13Å; A556-Q560 WeakPolarHBondContact O-CG 3.33Å; A556-Q560 PolarHBondContact O-N 2.84Å; A556-Q560 VanDerWaalsContact O-N 3.1Å
557	T	39.9	Very low	39.4	Very low	29 Å²	29	92.6 Å²	92.6	18%	0.178	50%	0.501	C	S	.	.	H	α-helix	trans	-69.3	-39.8	176.7	-57.8	0	0	0	0	110.7	L553 Y554 Q560 L561	L553-T557 VanDerWaalsContact O-CB 3.25Å; L553-T557 WeakPolarHBondContact O-CB 3.35Å; L553-T557 PolarHBondContact O-N 3Å; L553-T557 PolarHBondContact O-OG1 3.24Å; Y554-T557 PolarHBondContact O-N 2.98Å; T557-Q560 CarbonylContact O-C 3.54Å; T557-Q560 PolarHBondContact O-N 3.28Å; T557-Q560 VanDerWaalsContact O-N 3.09Å; T557-L561 WeakPolarHBondContact O-CB 3.36Å; T557-L561 PolarHBondContact O-N 3.06Å
558	N	39.8	Very low	38.3	Very low	59 Å²	59	93.1 Å²	93.1	32%	0.316	51%	0.509	S	S	.	.	H	α-helix	trans	-64.9	-40.6	173.4	-72.6	-20	0	0	0	111.6	Y554 E555 Q560 L561 V562	Y554-N558 WeakPolarHBondContact CE1-ND2 3.42Å; Y554-N558 WeakPolarHBondContact O-CB 3.43Å; Y554-N558 PolarHBondContact O-N 3.47Å; E555-N558 PolarHBondContact O-N 3.21Å; N558-Q560 PolarHBondContact O-N 3.1Å; N558-L561 PolarHBondContact O-N 2.93Å; N558-L561 VanDerWaalsContact O-N 3.15Å; N558-V562 WeakPolarHBondContact O-CG2 3.41Å; N558-V562 PolarHBondContact O-N 3.33Å; N558-V562 VanDerWaalsContact O-N 3.12Å
559	Q	43.8	Very low	37.6	Very low	106 Å²	106	94.9 Å²	94.9	50%	0.495	51%	0.512	S	S	.	.	H	α-helix	trans	-61.8	-23.5	172	-70.7	172.6	32	0	0	113.2	E555 A556 R563	E555-Q559 VanDerWaalsContact O-CG 3.29Å; E555-Q559 WeakPolarHBondContact O-CG 3.41Å; E555-Q559 PolarHBondContact O-N 3.45Å; A556-Q559 PolarHBondContact O-N 3.13Å; Q559-R563 PolarHBondContact O-NH1 3.47Å
560	Q	35	Very low	36.5	Very low	113 Å²	113	98.8 Å²	98.8	53%	0.528	53%	0.527	S	S	.	.	H	α-helix	trans	-87.5	-36.3	170	-67.6	-69	3.1	0	0	112.9	A556 T557 N558 V562 R563	A556-Q560 WeakPolarHBondContact O-CG 3.33Å; A556-Q560 PolarHBondContact O-N 2.84Å; A556-Q560 VanDerWaalsContact O-N 3.1Å; T557-Q560 CarbonylContact O-C 3.54Å; T557-Q560 PolarHBondContact O-N 3.28Å; T557-Q560 VanDerWaalsContact O-N 3.09Å; N558-Q560 PolarHBondContact O-N 3.1Å; Q560-V562 VanDerWaalsContact C-N 3.27Å; Q560-V562 PolarHBondContact O-N 3.03Å; Q560-R563 VanDerWaalsContact O-CB 3.29Å; Q560-R563 WeakPolarHBondContact O-CB 3.36Å; Q560-R563 PolarHBondContact O-N 3.41Å
561	L	34.9	Very low	35.6	Very low	106 Å²	106	101 Å²	101	56%	0.555	54%	0.539	S	S	*	.	H	α-helix	trans	-65.2	-31.4	-178	-164.7	66	0	0	0	112.3	T557 N558 R563 S564	T557-L561 WeakPolarHBondContact O-CB 3.36Å; T557-L561 PolarHBondContact O-N 3.06Å; N558-L561 PolarHBondContact O-N 2.93Å; N558-L561 VanDerWaalsContact O-N 3.15Å; L561-R563 PolarHBondContact O-N 3.47Å; L561-S564 PolarHBondContact O-N 3.27Å; L561-S564 VanDerWaalsContact O-N 3.13Å
562	V	35.2	Very low	34.4	Very low	131 Å²	131	103.4 Å²	103.4	79%	0.794	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-13.5	169.5	169.8	0	0	0	0	113.2	N558 Q560	N558-V562 WeakPolarHBondContact O-CG2 3.41Å; N558-V562 PolarHBondContact O-N 3.33Å; N558-V562 VanDerWaalsContact O-N 3.12Å; Q560-V562 VanDerWaalsContact C-N 3.27Å; Q560-V562 PolarHBondContact O-N 3.03Å
563	R	36.2	Very low	33.6	Very low	65 Å²	65	101 Å²	101	25%	0.245	56%	0.556	C	S	.	*	T	Hydrogen-bonded Turn	trans	-95	-3.4	177.8	-60.8	178.8	157.4	80.5	3.6	114.6	Q559 Q560 L561 G565 L823	Q559-R563 PolarHBondContact O-NH1 3.47Å; Q560-R563 VanDerWaalsContact O-CB 3.29Å; Q560-R563 WeakPolarHBondContact O-CB 3.36Å; Q560-R563 PolarHBondContact O-N 3.41Å; L561-R563 PolarHBondContact O-N 3.47Å; R563-G565 PolarHBondContact O-N 3.02Å; R563-L823 HydrophobicContact CG-CD1 4.14Å
564	S	32.6	Very low	32.9	Very low	81 Å²	81	104.6 Å²	104.6	57%	0.566	59%	0.588	S	S	*	*			trans	-97.2	85.3	177.4	-65.2	0	0	0	0	110.8	L561 S566	L561-S564 PolarHBondContact O-N 3.27Å; L561-S564 VanDerWaalsContact O-N 3.13Å; S564-S566 PolarHBondContact O-N 2.82Å
565	G	27.1	Very low	32	Very low	82 Å²	82	108.4 Å²	108.4	85%	0.845	60%	0.603	S	S	*	*			trans	-70.6	43.2	-171.2	0	0	0	0	0	117	R563	R563-G565 PolarHBondContact O-N 3.02Å
566	S	28.2	Very low	31.1	Very low	96 Å²	96	110.7 Å²	110.7	67%	0.671	62%	0.617	S	S	*	*			trans	-138.5	37.2	-176.8	-51.2	0	0	0	0	114.2	S564	S564-S566 PolarHBondContact O-N 2.82Å
567	L	26.5	Very low	30.6	Very low	149 Å²	149	114.9 Å²	114.9	78%	0.78	64%	0.643	S	S	*	*			trans	-140.8	127.2	152.7	-76.7	-177.7	0	0	0	109.8	L569	L567-L569 PolarHBondContact O-N 3.43Å
568	N	23.6	Very low	29.9	Very low	171 Å²	171	116.5 Å²	116.5	91%	0.914	67%	0.666	S	S	*	*			trans	-71.7	109.6	166.3	-75.1	-53.4	0	0	0	108.4
569	L	26	Very low	29.3	Very low	115 Å²	115	120.8 Å²	120.8	60%	0.602	69%	0.688	S	S	*	*			trans	-147.5	59.8	175.5	-153	67.1	0	0	0	114.2	L567 D571	L567-L569 PolarHBondContact O-N 3.43Å; L569-D571 HydrophobicContact CD1-CB 4.08Å; L569-D571 VanDerWaalsContact CD1-O 3.29Å; L569-D571 WeakPolarHBondContact CD1-O 3.42Å; L569-D571 WeakPolarHBondContact CG-O 3.38Å; L569-D571 PolarHBondContact O-N 2.9Å; L569-D571 VanDerWaalsContact O-N 3.12Å
570	F	25.2	Very low	28.6	Very low	153 Å²	153	121 Å²	121	67%	0.671	70%	0.699	S	S	*	*			trans	-70.8	74.3	140.6	-79.2	-99.2	0	0	0	107.9
571	D	27.3	Very low	28.2	Very low	130 Å²	130	124.7 Å²	124.7	70%	0.695	72%	0.716	S	S	*	*	S	Bend	trans	-176.5	106.4	166.2	-96.8	-31.6	0	0	0	109.6	L569 P573	L569-D571 HydrophobicContact CD1-CB 4.08Å; L569-D571 VanDerWaalsContact CD1-O 3.29Å; L569-D571 WeakPolarHBondContact CD1-O 3.42Å; L569-D571 WeakPolarHBondContact CG-O 3.38Å; L569-D571 PolarHBondContact O-N 2.9Å; L569-D571 VanDerWaalsContact O-N 3.12Å; D571-P573 VanDerWaalsContact O-CD 3.26Å; D571-P573 WeakPolarHBondContact O-CD 3.44Å
572	L	25.7	Very low	27.9	Very low	171 Å²	171	127.2 Å²	127.2	90%	0.895	73%	0.73	S	S	*	*			trans	-85.8	114.5	-172.6	-169.7	79.8	0	0	0	112	A574	L572-A574 PolarHBondContact O-N 2.95Å
573	P	26.7	Very low	27.5	Very low	94 Å²	94	130 Å²	130	61%	0.61	73%	0.731	S	S	*	*			trans	-76.1	124.7	177.9	-14.1	31.9	0	0	0	111.2	D571 Y575	D571-P573 VanDerWaalsContact O-CD 3.26Å; D571-P573 WeakPolarHBondContact O-CD 3.44Å; P573-Y575 PolarHBondContact O-N 3.42Å
574	A	25.8	Very low	27.1	Very low	93 Å²	93	136.2 Å²	136.2	77%	0.769	76%	0.763	S	S	*	*			trans	-80.3	69.4	-169	0	0	0	0	0	114.3	L572	L572-A574 PolarHBondContact O-N 2.95Å
575	Y	26.6	Very low	26.8	Very low	205 Å²	205	140.1 Å²	140.1	80%	0.804	78%	0.777	S	S	*	*			trans	-117.1	12.2	-176.1	-146.9	-96.9	0	0	0	116.3	P573	P573-Y575 PolarHBondContact O-N 3.42Å
576	I	29.1	Very low	26.6	Very low	141 Å²	141	141 Å²	141	72%	0.723	77%	0.77	S	S	*	*	S	Bend	trans	-100.1	-7.3	176.9	-63.3	179	0	0	0	112.2	G578	I576-G578 VanDerWaalsContact C-N 3.33Å; I576-G578 PolarHBondContact O-N 3.49Å
577	S	27.4	Very low	26.6	Very low	122 Å²	122	145 Å²	145	85%	0.853	78%	0.783	S	S	*	*	S	Bend	trans	-87.9	22.8	-177.5	-48.2	0	0	0	0	115
578	G	26	Very low	26.6	Very low	63 Å²	63	143.6 Å²	143.6	65%	0.649	79%	0.786	S	S	*	*			trans	-145.9	6.6	-159.2	0	0	0	0	0	119.7	I576	I576-G578 VanDerWaalsContact C-N 3.33Å; I576-G578 PolarHBondContact O-N 3.49Å
579	L	27.5	Very low	26.9	Very low	150 Å²	150	138.5 Å²	138.5	79%	0.785	77%	0.773	S	S	*	*	S	Bend	trans	-109.5	149.2	171.9	-105.2	72.8	0	0	0	111.7
580	P	28.3	Very low	27.2	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-83	135	-149.7	30.3	-36.3	0	0	0	114.6	N582	P580-N582 PolarHBondContact O-N 2.8Å
581	Q	25.8	Very low	27.5	Very low	191 Å²	191	137.2 Å²	137.2	89%	0.893	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-63.3	125.6	158.1	-69.6	176.9	-23.7	0	0	109.3	K583	Q581-K583 PolarHBondContact O-N 3.33Å
582	N	28.8	Very low	27.8	Very low	159 Å²	159	138 Å²	138	85%	0.85	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-71.8	119.7	171.3	-82.8	-48.5	0	0	0	109.4	P580 E584	P580-N582 PolarHBondContact O-N 2.8Å; N582-E584 PolarHBondContact O-N 3Å
583	K	27.1	Very low	28.1	Very low	189 Å²	189	138.7 Å²	138.7	82%	0.822	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-53.9	123.3	-178.2	-65	171	176.5	176.7	0	111.6	Q581	Q581-K583 PolarHBondContact O-N 3.33Å
584	E	27.6	Very low	28.4	Very low	195 Å²	195	137.5 Å²	137.5	91%	0.911	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.8	132.8	145.6	-70.9	-162.6	129.4	0	0	108	N582 S586	N582-E584 PolarHBondContact O-N 3Å; E584-S586 PolarHBondContact O-N 3.03Å
585	L	27.2	Very low	28.5	Very low	163 Å²	163	139.4 Å²	139.4	85%	0.853	80%	0.798	S	S	*	*			trans	-84.1	106.6	-178	-87.9	161.3	0	0	0	109.9
586	S	22.4	Very low	28.6	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	79%	0.794	S	S	*	*			trans	-47.5	144.4	175.4	47.8	0	0	0	0	114.8	E584	E584-S586 PolarHBondContact O-N 3.03Å
587	L	28.1	Very low	28.6	Very low	179 Å²	179	136 Å²	136	94%	0.937	79%	0.794	S	S	*	*			trans	-126.2	157.4	146.9	-129	75.2	0	0	0	108.5
588	S	25.5	Very low	28.6	Very low	121 Å²	121	136.8 Å²	136.8	85%	0.846	78%	0.784	S	S	*	*			trans	-131.7	147.3	-142.9	55.7	0	0	0	0	117
589	G	30.3	Very low	28.8	Very low	63 Å²	63	140.9 Å²	140.9	65%	0.649	79%	0.786	S	S	*	*			trans	172.9	119.4	154.2	0	0	0	0	0	109.8
590	S	31.7	Very low	28.8	Very low	116 Å²	116	140.3 Å²	140.3	81%	0.811	78%	0.783	S	S	*	*				65.2	122.2	64	77.8	0	0	0	0	111.6
591	T	32.8	Very low	28.9	Very low	126 Å²	126	141.1 Å²	141.1	77%	0.773	78%	0.781	S	S	*	*			cis	-159.4	123.7	22.4	-55.6	0	0	0	0	106.9
592	D	32.4	Very low	29.2	Very low	146 Å²	146	137.8 Å²	137.8	78%	0.781	77%	0.769	S	S	*	*				85.6	148.9	78	-146.2	-2.9	0	0	0	115.7
593	E	32.7	Very low	29	Very low	185 Å²	185	139.9 Å²	139.9	86%	0.864	77%	0.767	S	S	*	*			trans	61	158.5	177.9	-55	-160.6	155	0	0	120.1
594	G	32.6	Very low	29.2	Very low	69 Å²	69	136.8 Å²	136.8	71%	0.711	76%	0.759	S	S	*	*			trans	171.8	-41.8	164	0	0	0	0	0	123.1
595	T	29.5	Very low	29.3	Very low	134 Å²	134	133.7 Å²	133.7	82%	0.822	75%	0.747	S	S	*	*			trans	50.8	98.3	165.3	-56.8	0	0	0	0	120.5
596	V	27.1	Very low	29.5	Very low	119 Å²	119	130.7 Å²	130.7	72%	0.721	74%	0.74	S	S	*	*				85.7	147.5	129.5	163.9	0	0	0	0	123.3
597	H	30.2	Very low	29.9	Very low	156 Å²	156	130.3 Å²	130.3	72%	0.722	74%	0.738	S	S	*	*			trans	83.5	104	162.9	-77.4	-51	0	0	0	122.9
598	Q	26.9	Very low	29.9	Very low	137 Å²	137	129 Å²	129	64%	0.64	73%	0.731	S	S	*	*				66.8	142.1	125.6	-97.2	163.1	-90.1	0	0	124.1
599	E	30.6	Very low	30.3	Very low	150 Å²	150	131.1 Å²	131.1	70%	0.701	73%	0.732	S	S	*	*			trans	70.8	149.1	149.6	-71.6	168	-141.9	0	0	118.2
600	I	28.1	Very low	30.4	Very low	138 Å²	138	134 Å²	134	71%	0.708	74%	0.742	S	S	*	*			cis	-161	161.9	-24.6	-124.7	173.9	0	0	0	108.5
601	D	28.7	Very low	30.6	Very low	126 Å²	126	134.9 Å²	134.9	67%	0.674	74%	0.738	S	S	*	*			trans	67.1	129.6	159.3	-81.8	10.7	0	0	0	125.6
602	N	32	Very low	30.6	Very low	121 Å²	121	138 Å²	138	65%	0.647	74%	0.737	S	S	*	*			trans	73.9	129.9	134.2	-66.5	-41.7	0	0	0	125.2
603	Y	26.4	Very low	30.8	Very low	203 Å²	203	138.4 Å²	138.4	80%	0.796	74%	0.74	S	S	*	*			trans	16.4	147.9	134.2	-68.3	-90.7	0	0	0	120.4
604	D	30	Very low	30.9	Very low	124 Å²	124	134 Å²	134	66%	0.663	72%	0.722	S	S	*	*			cis	-165.1	174.5	31.2	-144.5	-14.3	0	0	0	115.8
605	I	30.3	Very low	31.1	Very low	130 Å²	130	139.1 Å²	139.1	67%	0.667	73%	0.733	S	S	*	*			trans	61.8	91.5	148	-75.2	155.8	0	0	0	120.7
606	S	30.8	Very low	31.9	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	73%	0.726	S	S	*	*				88.2	143.3	119.1	82.7	0	0	0	0	125.2
607	S	31.6	Very low	32.5	Very low	93 Å²	93	139.8 Å²	139.8	65%	0.65	72%	0.72	S	S	*	*			trans	93.4	106.1	141.1	76.7	0	0	0	0	122.1
608	N	28.3	Very low	33	Very low	150 Å²	150	138.5 Å²	138.5	80%	0.802	71%	0.714	S	S	*	*			trans	80.9	148.2	139.3	-60.7	-30.5	0	0	0	122.4
609	L	34	Very low	33.6	Very low	166 Å²	166	137.2 Å²	137.2	87%	0.869	71%	0.708	S	S	*	*			trans	83	156.3	167.2	-91.5	67.3	0	0	0	120.1
610	S	32.9	Very low	34	Very low	123 Å²	123	135.5 Å²	135.5	86%	0.86	70%	0.7	S	S	*	*			trans	64.7	77	176.4	38.3	0	0	0	0	118.6
611	D	34.7	Very low	34.4	Very low	135 Å²	135	134.7 Å²	134.7	72%	0.722	69%	0.692	S	S	*	*			trans	-41.2	164.5	149.6	-158.3	-2.1	0	0	0	116.5
612	Y	33.3	Very low	35	Very low	191 Å²	191	133 Å²	133	75%	0.749	68%	0.68	S	S	*	*			trans	76.6	133.4	172.6	-71.9	-85.3	0	0	0	122.8
613	N	36.4	Very low	35.4	Very low	156 Å²	156	133 Å²	133	83%	0.834	68%	0.676	S	S	*	*			trans	79.7	129.1	169.4	-41.7	-81.3	0	0	0	115.6
614	D	34.6	Very low	36.3	Very low	92 Å²	92	128.9 Å²	128.9	49%	0.492	66%	0.662	S	S	.	*				-160.5	78.1	52.2	-178.1	41.7	0	0	0	114.4	K616 N617	D614-K616 PolarHBondContact O-N 3.3Å; D614-K616 IonicContact OD1-NZ 3.62Å; D614-N617 PolarHBondContact OD2-ND2 3.27Å
615	D	37.9	Very low	36.9	Very low	176 Å²	176	127.7 Å²	127.7	94%	0.941	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	76.2	176.5	-78.3	-56.2	0	0	0	113.7
616	K	44.7	Very low	37.2	Very low	158 Å²	158	128.9 Å²	128.9	69%	0.687	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.9	-24	175.4	-75.3	-176.9	-167.1	131.5	0	117.2	D614	D614-K616 PolarHBondContact O-N 3.3Å; D614-K616 IonicContact OD1-NZ 3.62Å
617	N	39.6	Very low	37.6	Very low	110 Å²	110	127.5 Å²	127.5	59%	0.588	64%	0.636	S	S	*	*	H	α-helix	trans	-87.1	-22.6	-161.5	-60.3	-55.6	0	0	0	114.4	D614 E619 E620 F621	D614-N617 PolarHBondContact OD2-ND2 3.27Å; N617-E619 PolarHBondContact O-N 3.46Å; N617-E620 PolarHBondContact O-N 2.99Å; N617-F621 PolarHBondContact O-N 3.29Å
618	E	41.4	Very low	37.8	Very low	129 Å²	129	125.8 Å²	125.8	60%	0.603	62%	0.624	S	S	*	*	H	α-helix	trans	-66.4	-36.7	-176.1	-166.4	57.9	-145	0	0	113.4	E620 F621 Q622	E618-E620 PolarHBondContact O-N 3.35Å; E618-F621 PolarHBondContact O-N 3.02Å; E618-Q622 PolarHBondContact O-N 2.98Å; E618-Q622 VanDerWaalsContact O-N 3.16Å
619	E	39.4	Very low	38.3	Very low	110 Å²	110	123.2 Å²	123.2	51%	0.514	61%	0.61	S	S	.	*	H	α-helix	trans	-69.3	-34.4	179.6	-65.5	-165.1	160.8	0	0	112.6	K378 N617 F621 Q622 Q623	K378-E619 WeakPolarHBondContact CE-OE1 3.48Å; K378-E619 IonicContact NZ-OE1 2.69Å; K378-E619 PolarHBondContact NZ-OE1 3.3Å; K378-E619 IonicContact NZ-OE2 2.74Å; K378-E619 PolarHBondContact NZ-OE2 3.42Å; N617-E619 PolarHBondContact O-N 3.46Å; E619-F621 VanDerWaalsContact C-N 3.31Å; E619-F621 PolarHBondContact O-N 3.07Å; E619-Q622 PolarHBondContact O-N 2.91Å; E619-Q623 WeakPolarHBondContact O-CB 3.33Å; E619-Q623 PolarHBondContact O-N 3.43Å
620	E	39	Very low	38.5	Very low	113 Å²	113	121 Å²	121	53%	0.528	60%	0.598	S	S	.	*	H	α-helix	trans	-70.2	-31.4	178.6	-138.4	-163.8	-127.8	0	0	111.4	N617 E618 Q623 K624	N617-E620 PolarHBondContact O-N 2.99Å; E618-E620 PolarHBondContact O-N 3.35Å; E620-Q623 PolarHBondContact O-N 3.46Å; E620-K624 WeakPolarHBondContact O-CB 3.36Å; E620-K624 VanDerWaalsContact O-CG 3.32Å; E620-K624 WeakPolarHBondContact O-CG 3.45Å; E620-K624 PolarHBondContact O-N 2.85Å; E620-K624 VanDerWaalsContact OE2-CE 3.32Å; E620-K624 WeakPolarHBondContact OE2-CE 3.41Å; E620-K624 IonicContact OE2-NZ 3.9Å; E620-K624 PolarHBondContact OE2-NZ 3.16Å
621	F	36.8	Very low	38.5	Very low	122 Å²	122	123.5 Å²	123.5	54%	0.535	59%	0.589	S	S	.	*	H	α-helix	trans	-68.8	-46.3	173.4	-169.2	-119.5	0	0	0	111.8	N617 E618 E619 Q623 K624 Q625	N617-F621 PolarHBondContact O-N 3.29Å; E618-F621 PolarHBondContact O-N 3.02Å; E619-F621 VanDerWaalsContact C-N 3.31Å; E619-F621 PolarHBondContact O-N 3.07Å; F621-Q623 VanDerWaalsContact C-N 3.28Å; F621-Q623 PolarHBondContact O-N 2.75Å; F621-K624 PolarHBondContact O-N 2.75Å; F621-Q625 PolarHBondContact O-N 2.85Å
622	Q	41.9	Very low	38.7	Very low	91 Å²	91	124.9 Å²	124.9	43%	0.425	59%	0.591	S	S	.	*	H	α-helix	trans	-62.8	-34.6	173	-68.7	-169.4	32.3	0	0	112.6	E618 E619 Q625 R626	E618-Q622 PolarHBondContact O-N 2.98Å; E618-Q622 VanDerWaalsContact O-N 3.16Å; E619-Q622 PolarHBondContact O-N 2.91Å; Q622-Q625 PolarHBondContact O-N 3.43Å; Q622-R626 WeakPolarHBondContact O-CG 3.47Å; Q622-R626 PolarHBondContact O-N 3.28Å
623	Q	40.1	Very low	39	Very low	119 Å²	119	121.1 Å²	121.1	56%	0.556	58%	0.583	S	S	*	*	H	α-helix	trans	-71.9	-35.4	176.6	-164.9	151.8	12.6	0	0	112.1	E619 E620 F621 R626 T627	E619-Q623 WeakPolarHBondContact O-CB 3.33Å; E619-Q623 PolarHBondContact O-N 3.43Å; E620-Q623 PolarHBondContact O-N 3.46Å; F621-Q623 VanDerWaalsContact C-N 3.28Å; F621-Q623 PolarHBondContact O-N 2.75Å; Q623-R626 PolarHBondContact O-N 3.33Å; Q623-T627 PolarHBondContact O-N 3.47Å
624	K	44.4	Very low	38.9	Very low	118 Å²	118	119.7 Å²	119.7	51%	0.513	57%	0.571	S	S	.	*	H	α-helix	trans	-62.3	-46	169.9	-76.9	165.1	-173.8	161.3	0	111.8	E620 F621 R626 T627 S628	E620-K624 WeakPolarHBondContact O-CB 3.36Å; E620-K624 VanDerWaalsContact O-CG 3.32Å; E620-K624 WeakPolarHBondContact O-CG 3.45Å; E620-K624 PolarHBondContact O-N 2.85Å; E620-K624 VanDerWaalsContact OE2-CE 3.32Å; E620-K624 WeakPolarHBondContact OE2-CE 3.41Å; E620-K624 IonicContact OE2-NZ 3.9Å; E620-K624 PolarHBondContact OE2-NZ 3.16Å; F621-K624 PolarHBondContact O-N 2.75Å; K624-R626 VanDerWaalsContact C-N 3.3Å; K624-R626 PolarHBondContact O-N 3.21Å; K624-T627 WeakPolarHBondContact O-CA 3.34Å; K624-T627 PolarHBondContact O-N 3.46Å; K624-T627 PolarHBondContact O-OG1 3.39Å; K624-S628 PolarHBondContact O-N 2.77Å
625	Q	42.6	Very low	38.7	Very low	99 Å²	99	118.9 Å²	118.9	46%	0.463	59%	0.585	S	S	.	*	H	α-helix	trans	-61.6	-33.8	174.7	-69.2	-171	23.7	0	0	113.4	F621 Q622 T627 S628 N629	F621-Q625 PolarHBondContact O-N 2.85Å; Q622-Q625 PolarHBondContact O-N 3.43Å; Q625-T627 PolarHBondContact O-N 2.93Å; Q625-S628 PolarHBondContact O-N 2.99Å; Q625-S628 PolarHBondContact O-OG 3Å; Q625-N629 PolarHBondContact O-N 3.11Å; Q625-N629 PolarHBondContact O-OD1 2.91Å
626	R	37.9	Very low	38.4	Very low	155 Å²	155	112.9 Å²	112.9	59%	0.585	56%	0.556	S	S	*	*	H	α-helix	trans	-63	-27.9	171.9	-72.2	169.1	-169.8	153	11.2	112.3	Q622 Q623 K624 L630	Q622-R626 WeakPolarHBondContact O-CG 3.47Å; Q622-R626 PolarHBondContact O-N 3.28Å; Q623-R626 PolarHBondContact O-N 3.33Å; K624-R626 VanDerWaalsContact C-N 3.3Å; K624-R626 PolarHBondContact O-N 3.21Å; R626-L630 WeakPolarHBondContact O-CD1 3.46Å
627	T	37.9	Very low	37.9	Very low	71 Å²	71	113.8 Å²	113.8	44%	0.436	56%	0.56	S	S	.	*	H	α-helix	trans	-87.3	-19.1	177.9	67.3	0	0	0	0	115.4	Q623 K624 Q625	Q623-T627 PolarHBondContact O-N 3.47Å; K624-T627 WeakPolarHBondContact O-CA 3.34Å; K624-T627 PolarHBondContact O-N 3.46Å; K624-T627 PolarHBondContact O-OG1 3.39Å; Q625-T627 PolarHBondContact O-N 2.93Å
628	S	36.1	Very low	37.5	Very low	57 Å²	57	112.6 Å²	112.6	40%	0.399	56%	0.561	S	S	.	*	H	α-helix	trans	-72.7	-48.7	171.8	48.9	0	0	0	0	111	K624 Q625 L630 R631 E632	K624-S628 PolarHBondContact O-N 2.77Å; Q625-S628 PolarHBondContact O-N 2.99Å; Q625-S628 PolarHBondContact O-OG 3Å; S628-L630 PolarHBondContact O-N 3.15Å; S628-L630 VanDerWaalsContact O-N 3.15Å; S628-R631 PolarHBondContact O-N 3.42Å; S628-E632 PolarHBondContact O-N 3.26Å
629	N	38.6	Very low	37.4	Very low	97 Å²	97	110.4 Å²	110.4	52%	0.519	56%	0.556	S	S	.	*	H	α-helix	trans	-68.6	-19	-174.4	-57.4	12.9	0	0	0	112.2	Q625	Q625-N629 PolarHBondContact O-N 3.11Å; Q625-N629 PolarHBondContact O-OD1 2.91Å
630	L	37.7	Very low	37.1	Very low	118 Å²	118	109.7 Å²	109.7	62%	0.618	56%	0.563	S	S	*	*	H	α-helix	trans	-78.7	-15.6	171.3	-86.2	168.5	0	0	0	114.4	R626 S628 Q634	R626-L630 WeakPolarHBondContact O-CD1 3.46Å; S628-L630 PolarHBondContact O-N 3.15Å; S628-L630 VanDerWaalsContact O-N 3.15Å; L630-Q634 PolarHBondContact O-NE2 3.37Å
631	R	34.4	Very low	36.8	Very low	176 Å²	176	110.9 Å²	110.9	66%	0.664	57%	0.569	S	S	*	*	H	α-helix	trans	-91.2	-35.5	175.1	-62.9	-177.1	-161.1	-150.1	4.4	112.3	S628 I633 Q634	S628-R631 PolarHBondContact O-N 3.42Å; R631-I633 PolarHBondContact O-N 3.17Å; R631-Q634 VanDerWaalsContact O-CB 3.26Å; R631-Q634 WeakPolarHBondContact O-CB 3.47Å; R631-Q634 WeakPolarHBondContact O-CG 3.45Å; R631-Q634 PolarHBondContact O-N 3.15Å
632	E	38.5	Very low	36.6	Very low	165 Å²	165	106.5 Å²	106.5	77%	0.771	56%	0.558	S	S	*	*	H	α-helix	trans	-65.5	-24.4	-177.5	-160	161.7	-144.5	0	0	113.2	S628 Q634	S628-E632 PolarHBondContact O-N 3.26Å; E632-Q634 VanDerWaalsContact C-N 3.27Å; E632-Q634 PolarHBondContact O-N 3.5Å
633	I	38.8	Very low	36.5	Very low	111 Å²	111	103.8 Å²	103.8	57%	0.569	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-74.5	-14.3	174.5	-62.9	171.1	0	0	0	112.5	R631 G635	R631-I633 PolarHBondContact O-N 3.17Å; I633-G635 VanDerWaalsContact C-N 3.27Å; I633-G635 PolarHBondContact O-N 3.48Å
634	Q	35	Very low	36.1	Very low	127 Å²	127	102.1 Å²	102.1	59%	0.593	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-76.5	-8.3	-171	-61.1	177.7	-17.2	0	0	114.2	L630 R631 E632	L630-Q634 PolarHBondContact O-NE2 3.37Å; R631-Q634 VanDerWaalsContact O-CB 3.26Å; R631-Q634 WeakPolarHBondContact O-CB 3.47Å; R631-Q634 WeakPolarHBondContact O-CG 3.45Å; R631-Q634 PolarHBondContact O-N 3.15Å; E632-Q634 VanDerWaalsContact C-N 3.27Å; E632-Q634 PolarHBondContact O-N 3.5Å
635	G	30.6	Very low	35.7	Very low	75 Å²	75	103.6 Å²	103.6	77%	0.773	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-98.3	-11.8	-177.9	0	0	0	0	0	116.7	I633	I633-G635 VanDerWaalsContact C-N 3.27Å; I633-G635 PolarHBondContact O-N 3.48Å
636	S	32.1	Very low	35.8	Very low	49 Å²	49	103.1 Å²	103.1	34%	0.343	55%	0.552	S	S	.	*			trans	-118.7	83.7	-159.5	60.8	0	0	0	0	114.7	S638 V639	S636-S638 PolarHBondContact O-N 3.26Å; S636-S638 VanDerWaalsContact O-N 3.1Å; S636-V639 WeakPolarHBondContact OG-CG2 3.22Å
637	K	33.1	Very low	36.1	Very low	178 Å²	178	96.6 Å²	96.6	77%	0.774	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-5.6	175.2	-82.1	-177.8	175.3	174.5	0	115.5
638	S	32.5	Very low	36.5	Very low	85 Å²	85	97 Å²	97	59%	0.594	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-10.2	-176.2	48.8	0	0	0	0	115.6	S636 G642	S636-S638 PolarHBondContact O-N 3.26Å; S636-S638 VanDerWaalsContact O-N 3.1Å; S638-G642 PolarHBondContact O-N 3.38Å
639	V	37.6	Very low	37.4	Very low	83 Å²	83	100.7 Å²	100.7	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-73.9	-32.7	-167.3	179.1	0	0	0	0	113.4	S636 G642 L643	S636-V639 WeakPolarHBondContact OG-CG2 3.22Å; V639-G642 PolarHBondContact O-N 2.88Å; V639-L643 PolarHBondContact O-N 2.83Å
640	S	34.6	Very low	38.2	Very low	94 Å²	94	96.7 Å²	96.7	66%	0.657	52%	0.518	S	S	*	.	H	α-helix	trans	-68.7	-36.9	-179	46.1	0	0	0	0	113.2
641	E	32.7	Very low	38.7	Very low	139 Å²	139	92 Å²	92	65%	0.65	50%	0.498	S	S	*	.	H	α-helix	trans	-72.4	-37.3	174.9	-63.1	-171.7	133.2	0	0	111.6	L643 C644 Q645	E641-L643 VanDerWaalsContact C-N 3.31Å; E641-L643 PolarHBondContact O-N 2.95Å; E641-C644 WeakPolarHBondContact O-CB 3.48Å; E641-C644 PolarHBondContact O-N 3Å; E641-Q645 PolarHBondContact O-N 3.02Å; E641-Q645 VanDerWaalsContact O-N 3.15Å
642	G	31.5	Very low	39.5	Very low	30 Å²	30	84.6 Å²	84.6	31%	0.309	47%	0.472	S	S	.	.	H	α-helix	trans	-59.8	-36.4	176.8	0	0	0	0	0	113.8	S638 V639 Q645 K646	S638-G642 PolarHBondContact O-N 3.38Å; V639-G642 PolarHBondContact O-N 2.88Å; G642-Q645 PolarHBondContact O-N 3.33Å; G642-K646 PolarHBondContact O-N 3Å
643	L	40.2	Very low	39.6	Very low	33 Å²	33	78.4 Å²	78.4	17%	0.173	45%	0.453	C	S	.	.	H	α-helix	trans	-67.5	-40.8	177.3	-165.8	67.4	0	0	0	111.8	V639 E641 Q645 K646 T647 Y699	V639-L643 PolarHBondContact O-N 2.83Å; E641-L643 VanDerWaalsContact C-N 3.31Å; E641-L643 PolarHBondContact O-N 2.95Å; L643-Q645 VanDerWaalsContact C-N 3.32Å; L643-Q645 PolarHBondContact O-N 3.2Å; L643-K646 PolarHBondContact O-N 3.37Å; L643-T647 PolarHBondContact O-N 3.11Å; L643-T647 VanDerWaalsContact O-N 3.09Å; L643-Y699 HydrophobicContact CD2-CE1 4.17Å
644	C	31.6	Very low	39.8	Very low	85 Å²	85	78.2 Å²	78.2	57%	0.574	47%	0.468	S	S	*	.	H	α-helix	trans	-59.9	-42.8	174.9	-168.7	0	0	0	0	111.2	E641 T647	E641-C644 WeakPolarHBondContact O-CB 3.48Å; E641-C644 PolarHBondContact O-N 3Å; C644-T647 PolarHBondContact O-N 3.32Å; C644-T647 PolarHBondContact O-OG1 3.49Å
645	Q	35.9	Very low	40	Very low	148 Å²	148	81.8 Å²	81.8	69%	0.692	49%	0.485	S	S	*	.	H	α-helix	trans	-67	-41.2	175.2	-65	-179.9	11.4	0	0	112.4	E641 G642 L643 T647 S648	E641-Q645 PolarHBondContact O-N 3.02Å; E641-Q645 VanDerWaalsContact O-N 3.15Å; G642-Q645 PolarHBondContact O-N 3.33Å; L643-Q645 VanDerWaalsContact C-N 3.32Å; L643-Q645 PolarHBondContact O-N 3.2Å; Q645-T647 VanDerWaalsContact C-N 3.34Å; Q645-T647 PolarHBondContact O-N 3.3Å; Q645-S648 VanDerWaalsContact O-CB 3.23Å; Q645-S648 WeakPolarHBondContact O-CB 3.46Å; Q645-S648 PolarHBondContact O-N 3.45Å
646	K	44.7	Very low	40.5	Very low	90 Å²	90	81.1 Å²	81.1	39%	0.391	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-40.2	176	-85.4	-159.4	173.4	-154.5	0	113	G642 L643 S648 R649 E841	G642-K646 PolarHBondContact O-N 3Å; L643-K646 PolarHBondContact O-N 3.37Å; K646-S648 PolarHBondContact O-N 2.88Å; K646-R649 WeakPolarHBondContact O-CB 3.41Å; K646-R649 PolarHBondContact O-N 3.12Å; K646-E841 IonicContact NZ-OE1 3.48Å; K646-E841 PolarHBondContact NZ-OE1 3.5Å; K646-E841 IonicContact NZ-OE2 2.8Å; K646-E841 PolarHBondContact NZ-OE2 3.41Å
647	T	44.6	Very low	40.9	Very low	17 Å²	17	80.8 Å²	80.8	10%	0.104	48%	0.478	C	S	.	.	H	α-helix	trans	-60.7	-19.6	-179.5	58.3	0	0	0	0	114.3	L643 C644 Q645 R649 F650	L643-T647 PolarHBondContact O-N 3.11Å; L643-T647 VanDerWaalsContact O-N 3.09Å; C644-T647 PolarHBondContact O-N 3.32Å; C644-T647 PolarHBondContact O-OG1 3.49Å; Q645-T647 VanDerWaalsContact C-N 3.34Å; Q645-T647 PolarHBondContact O-N 3.3Å; T647-R649 VanDerWaalsContact C-N 3.28Å; T647-R649 PolarHBondContact O-N 2.65Å; T647-F650 PolarHBondContact O-N 3.45Å
648	S	46.6	Very low	41.5	Very low	80 Å²	80	79.9 Å²	79.9	56%	0.559	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-61.8	-31.8	172.5	-162.5	0	0	0	0	113	Q645 K646 F650 G651	Q645-S648 VanDerWaalsContact O-CB 3.23Å; Q645-S648 WeakPolarHBondContact O-CB 3.46Å; Q645-S648 PolarHBondContact O-N 3.45Å; K646-S648 PolarHBondContact O-N 2.88Å; S648-F650 PolarHBondContact O-N 2.86Å; S648-F650 VanDerWaalsContact O-N 3.15Å; S648-G651 PolarHBondContact O-N 2.99Å
649	R	54.9	Low	42.9	Very low	134 Å²	134	82.6 Å²	82.6	51%	0.506	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-59.3	-27.1	177.9	-175	-176.8	-88.8	168.1	-9.7	112.7	K646 T647 G651 W840 E841	K646-R649 WeakPolarHBondContact O-CB 3.41Å; K646-R649 PolarHBondContact O-N 3.12Å; T647-R649 VanDerWaalsContact C-N 3.28Å; T647-R649 PolarHBondContact O-N 2.65Å; R649-G651 VanDerWaalsContact C-N 3.35Å; R649-W840 HydrophobicContact CG-CH2 4.09Å; R649-W840 HydrophobicContact CG-CZ3 4.28Å; R649-E841 IonicContact NH1-OE1 3.23Å; R649-E841 PolarHBondContact NH1-OE1 3.01Å
650	F	54.1	Low	44.5	Very low	14 Å²	14	80.4 Å²	80.4	6%	0.061	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-91.1	10.6	177.6	-60.4	-72.8	0	0	0	113.9	T647 S648 V652 F689 I692 T693 E837 W840	T647-F650 PolarHBondContact O-N 3.45Å; S648-F650 PolarHBondContact O-N 2.86Å; S648-F650 VanDerWaalsContact O-N 3.15Å; F650-V652 HydrophobicContact CB-CG2 4.02Å; F650-V652 PolarHBondContact O-N 3.33Å; F650-F689 HydrophobicContact CD1-CE2 4.02Å; F650-F689 AromaticContact CD1-CZ 3.95Å; F650-F689 HydrophobicContact CD1-CZ 3.95Å; F650-F689 HydrophobicContact CE1-CE2 4.03Å; F650-F689 HydrophobicContact CE1-CZ 4.42Å; F650-I692 HydrophobicContact CE1-CG2 4.18Å; F650-I692 HydrophobicContact CZ-CG2 4.28Å; F650-T693 HydrophobicContact CD1-CG2 4.31Å; F650-E837 HydrophobicContact CE2-CG 3.94Å; F650-E837 WeakPolarHBondContact CE2-OE1 3.41Å; F650-E837 HydrophobicContact CZ-CG 4.01Å; F650-W840 HydrophobicContact CD1-CH2 4.47Å; F650-W840 HydrophobicContact CD1-CZ3 4.29Å; F650-W840 HydrophobicContact CE1-CD2 4Å; F650-W840 AromaticContact CE1-CE3 3.45Å; F650-W840 HydrophobicContact CE1-CE3 3.45Å; F650-W840 VanDerWaalsContact CE1-CE3 3.45Å; F650-W840 AromaticContact CE1-CH2 3.85Å; F650-W840 HydrophobicContact CE1-CH2 3.85Å; F650-W840 HydrophobicContact CE1-CZ2 4.37Å; F650-W840 AromaticContact CE1-CZ3 3.34Å; F650-W840 HydrophobicContact CE1-CZ3 3.34Å; F650-W840 HydrophobicContact CE2-CZ3 4.41Å; F650-W840 HydrophobicContact CZ-CD2 4.33Å; F650-W840 AromaticContact CZ-CE3 3.43Å; F650-W840 HydrophobicContact CZ-CE3 3.43Å; F650-W840 VanDerWaalsContact CZ-CE3 3.43Å; F650-W840 HydrophobicContact CZ-CH2 4.35Å; F650-W840 AromaticContact CZ-CZ3 3.43Å; F650-W840 HydrophobicContact CZ-CZ3 3.43Å; F650-W840 VanDerWaalsContact CZ-CZ3 3.43Å
651	G	48.6	Very low	46.7	Very low	20 Å²	20	77.6 Å²	77.6	21%	0.206	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	9.1	-176	0	0	0	0	0	114.5	S648 R649 G653 A657 F658	S648-G651 PolarHBondContact O-N 2.99Å; R649-G651 VanDerWaalsContact C-N 3.35Å; G651-G653 PolarHBondContact O-N 3.44Å; G651-A657 VanDerWaalsContact O-CA 3.32Å; G651-A657 WeakPolarHBondContact O-CA 3.44Å; G651-F658 PolarHBondContact O-N 3.27Å
652	V	52.2	Low	49.4	Very low	19 Å²	19	71.1 Å²	71.1	12%	0.115	41%	0.41	C	S	.	.			trans	-85.7	57.1	-177.7	-167.2	0	0	0	0	110.5	F650	F650-V652 HydrophobicContact CB-CG2 4.02Å; F650-V652 PolarHBondContact O-N 3.33Å
653	G	39	Very low	52	Low	36 Å²	36	71.1 Å²	71.1	37%	0.371	41%	0.406	S	S	.	.			trans	-70.5	154.9	175.6	0	0	0	0	0	113.2	G651 Q655 G656	G651-G653 PolarHBondContact O-N 3.44Å; G653-Q655 PolarHBondContact O-N 3.04Å; G653-G656 PolarHBondContact O-N 3.14Å
654	A	43.5	Very low	54.1	Low	106 Å²	106	75.2 Å²	75.2	88%	0.876	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-5.4	-177.8	0	0	0	0	0	115.4
655	Q	40.1	Very low	56.6	Low	202 Å²	202	71.5 Å²	71.5	94%	0.944	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	22.7	-179	-63.5	-174	-4.9	0	0	113.3	G653	G653-Q655 PolarHBondContact O-N 3.04Å
656	G	40.4	Very low	58.8	Low	61 Å²	61	68.2 Å²	68.2	63%	0.629	39%	0.39	S	S	*	.			trans	96.3	131.2	-178.3	0	0	0	0	0	111.4	G653 F658	G653-G656 PolarHBondContact O-N 3.14Å; G656-F658 PolarHBondContact O-N 2.9Å
657	A	40.8	Very low	60.8	Low	42 Å²	42	66.1 Å²	66.1	35%	0.347	38%	0.382	S	S	.	.			trans	-71.7	118.9	-169.2	0	0	0	0	0	112.3	G651 R659	G651-A657 VanDerWaalsContact O-CA 3.32Å; G651-A657 WeakPolarHBondContact O-CA 3.44Å; A657-R659 VanDerWaalsContact C-N 3.29Å; A657-R659 HydrophobicContact CB-CG 4.1Å; A657-R659 PolarHBondContact O-N 3.28Å
658	F	44.8	Very low	62.8	Low	159 Å²	159	65.4 Å²	65.4	70%	0.697	38%	0.377	S	S	*	.			trans	-72.7	91.3	157.3	-173.1	-91.5	0	0	0	106.8	G651 G656 V660	G651-F658 PolarHBondContact O-N 3.27Å; G656-F658 PolarHBondContact O-N 2.9Å; F658-V660 VanDerWaalsContact C-N 3.35Å; F658-V660 HydrophobicContact CD1-CG2 3.73Å; F658-V660 HydrophobicContact CE1-CG2 3.99Å; F658-V660 PolarHBondContact O-N 3.46Å
659	R	63.1	Low	64.7	Low	142 Å²	142	65.2 Å²	65.2	54%	0.536	37%	0.373	S	S	.	.			trans	-73	89.5	180	-69.3	-168.1	-176.5	-73.9	-9	110	A657 A661 S697	A657-R659 VanDerWaalsContact C-N 3.29Å; A657-R659 HydrophobicContact CB-CG 4.1Å; A657-R659 PolarHBondContact O-N 3.28Å; R659-A661 PolarHBondContact O-N 2.91Å; R659-S697 PolarHBondContact NH1-OG 2.97Å; R659-S697 PolarHBondContact NH2-OG 3.37Å
660	V	70.9	Confident	66.3	Low	38 Å²	38	65.9 Å²	65.9	23%	0.23	38%	0.381	C	S	.	.			trans	-58.2	126.4	165.8	-166.9	0	0	0	0	108.1	F658 E664 M665	F658-V660 VanDerWaalsContact C-N 3.35Å; F658-V660 HydrophobicContact CD1-CG2 3.73Å; F658-V660 HydrophobicContact CE1-CG2 3.99Å; F658-V660 PolarHBondContact O-N 3.46Å; V660-E664 HydrophobicContact CG1-CB 3.61Å; V660-M665 HydrophobicContact CG1-CG 3.98Å
661	A	81.4	Confident	67.8	Low	35 Å²	35	67 Å²	67	29%	0.289	39%	0.391	S	S	.	.			trans	-66.8	154.5	168.2	0	0	0	0	0	109.8	R659 S663 E664 M665	R659-A661 PolarHBondContact O-N 2.91Å; A661-S663 PolarHBondContact O-N 3.36Å; A661-S663 VanDerWaalsContact O-N 3.16Å; A661-E664 HydrophobicContact CB-CB 4.36Å; A661-E664 HydrophobicContact CB-CG 4.01Å; A661-E664 WeakPolarHBondContact CB-OE2 3.33Å; A661-E664 PolarHBondContact N-OE2 3.43Å; A661-E664 PolarHBondContact O-N 2.96Å; A661-M665 PolarHBondContact O-N 3.47Å
662	W	88.7	Confident	69.5	Low	2 Å²	2	70.2 Å²	70.2	1%	0.008	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-54.6	-38.5	175.7	173.6	84	0	0	0	111.4	E664 M665 V668 L674 L677 I682 Q685 E686 F689 P845	W662-E664 PolarHBondContact O-N 2.9Å; W662-M665 PolarHBondContact O-N 3.45Å; W662-V668 HydrophobicContact CD2-CG1 4.14Å; W662-V668 HydrophobicContact CD2-CG2 4.2Å; W662-V668 HydrophobicContact CE3-CG1 4.17Å; W662-V668 HydrophobicContact CG-CG2 4.39Å; W662-V668 HydrophobicContact CH2-CG1 3.74Å; W662-V668 HydrophobicContact CZ2-CG1 3.72Å; W662-V668 HydrophobicContact CZ2-CG2 3.98Å; W662-V668 HydrophobicContact CZ3-CG1 3.98Å; W662-V668 WeakPolarHBondContact O-CB 3.15Å; W662-V668 WeakPolarHBondContact O-CG1 3.38Å; W662-V668 WeakPolarHBondContact O-CG2 3.33Å; W662-L674 HydrophobicContact CE3-CD2 4.3Å; W662-L674 HydrophobicContact CH2-CD2 4.06Å; W662-L674 HydrophobicContact CZ3-CD2 3.52Å; W662-L677 HydrophobicContact CH2-CD1 3.58Å; W662-L677 HydrophobicContact CZ3-CD1 4.09Å; W662-I682 HydrophobicContact CZ3-CG2 4.38Å; W662-Q685 HydrophobicContact CD2-CB 3.53Å; W662-Q685 HydrophobicContact CD2-CG 4.36Å; W662-Q685 HydrophobicContact CE3-CB 3.51Å; W662-Q685 HydrophobicContact CE3-CG 4.27Å; W662-Q685 HydrophobicContact CG-CB 4.2Å; W662-Q685 HydrophobicContact CH2-CB 3.94Å; W662-Q685 HydrophobicContact CH2-CG 3.76Å; W662-Q685 HydrophobicContact CZ2-CB 3.94Å; W662-Q685 HydrophobicContact CZ2-CG 3.83Å; W662-Q685 HydrophobicContact CZ3-CB 3.72Å; W662-Q685 HydrophobicContact CZ3-CG 3.98Å; W662-E686 HydrophobicContact CB-CG 4.02Å; W662-E686 HydrophobicContact CE3-CG 4.45Å; W662-F689 HydrophobicContact CB-CB 3.92Å; W662-F689 HydrophobicContact CB-CD1 3.81Å; W662-F689 HydrophobicContact CB-CG 3.96Å; W662-F689 HydrophobicContact CG-CB 4.32Å; W662-F689 HydrophobicContact CG-CG 4.44Å; W662-P845 WeakPolarHBondContact CZ2-O 3.42Å; W662-P845 PolarHBondContact NE1-O 3.1Å
663	S	85.5	Confident	71.1	Confident	31 Å²	31	69.3 Å²	69.3	22%	0.217	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-69.6	-8.7	175.9	48.1	0	0	0	0	115.5	A661 L674 E686	A661-S663 PolarHBondContact O-N 3.36Å; A661-S663 VanDerWaalsContact O-N 3.16Å; S663-L674 WeakPolarHBondContact O-CD1 3.28Å; S663-E686 WeakPolarHBondContact CB-OE1 3.48Å; S663-E686 PolarHBondContact OG-OE1 2.62Å
664	E	84.1	Confident	73.3	Confident	119 Å²	119	69.8 Å²	69.8	56%	0.556	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-106.2	-4.7	177.4	-65.9	173	148.8	0	0	112.9	V660 A661 W662	V660-E664 HydrophobicContact CG1-CB 3.61Å; A661-E664 HydrophobicContact CB-CB 4.36Å; A661-E664 HydrophobicContact CB-CG 4.01Å; A661-E664 WeakPolarHBondContact CB-OE2 3.33Å; A661-E664 PolarHBondContact N-OE2 3.43Å; A661-E664 PolarHBondContact O-N 2.96Å; W662-E664 PolarHBondContact O-N 2.9Å
665	M	84.1	Confident	75.2	Confident	6 Å²	6	71.8 Å²	71.8	3%	0.03	38%	0.383	C	S	.	.			trans	-68.2	137.8	-178.6	-64	-165.5	74.9	0	0	111.9	V660 A661 W662 E667 V668 V669 F689 W840	V660-M665 HydrophobicContact CG1-CG 3.98Å; A661-M665 PolarHBondContact O-N 3.47Å; W662-M665 PolarHBondContact O-N 3.45Å; M665-E667 VanDerWaalsContact C-N 3.29Å; M665-E667 PolarHBondContact O-N 2.95Å; M665-V668 HydrophobicContact CB-CB 4.12Å; M665-V668 HydrophobicContact CB-CG2 3.92Å; M665-V668 PolarHBondContact O-N 3.28Å; M665-V669 WeakPolarHBondContact O-CG2 3.32Å; M665-V669 PolarHBondContact O-N 2.87Å; M665-F689 HydrophobicContact CE-CE2 4.39Å; M665-F689 HydrophobicContact CE-CZ 3.92Å; M665-F689 HydrophobicContact CG-CZ 4.45Å; M665-F689 HydrophobicContact SD-CD2 4.5Å; M665-F689 HydrophobicContact SD-CE1 3.75Å; M665-F689 HydrophobicContact SD-CE2 3.64Å; M665-F689 HydrophobicContact SD-CZ 3.21Å; M665-F689 WeakPolarHBondContact SD-CZ 3.1Å; M665-W840 HydrophobicContact CE-CH2 3.75Å; M665-W840 HydrophobicContact CE-CZ2 3.5Å; M665-W840 VanDerWaalsContact CE-CZ2 3.5Å; M665-W840 HydrophobicContact SD-CZ2 4.01Å
666	P	83.6	Confident	77.4	Confident	79 Å²	79	67.5 Å²	67.5	51%	0.513	36%	0.358	S	S	.	.	H	α-helix	trans	-50.8	-47.4	178.5	-27.6	35	0	0	0	112.9	V668 V669 E670	P666-V668 VanDerWaalsContact C-N 3.26Å; P666-V668 PolarHBondContact O-N 2.98Å; P666-V669 PolarHBondContact O-N 3.05Å; P666-E670 VanDerWaalsContact O-CB 3.31Å; P666-E670 WeakPolarHBondContact O-CB 3.45Å; P666-E670 VanDerWaalsContact O-CG 3.24Å; P666-E670 WeakPolarHBondContact O-CG 3.28Å; P666-E670 PolarHBondContact O-N 3.12Å
667	E	85.7	Confident	79.7	Confident	47 Å²	47	64.8 Å²	64.8	22%	0.22	33%	0.329	C	S	.	.	H	α-helix	trans	-67.1	-28.1	-176.3	-49.2	96.4	141.2	0	0	112.3	M665 S671 M844	M665-E667 VanDerWaalsContact C-N 3.29Å; M665-E667 PolarHBondContact O-N 2.95Å; E667-S671 VanDerWaalsContact O-CB 3.31Å; E667-S671 WeakPolarHBondContact O-CB 3.43Å; E667-S671 PolarHBondContact O-N 2.84Å; E667-S671 PolarHBondContact O-OG 2.66Å; E667-M844 HydrophobicContact CB-CE 3.92Å; E667-M844 HydrophobicContact CB-CG 4.23Å; E667-M844 HydrophobicContact CB-SD 3.73Å; E667-M844 HydrophobicContact CG-CE 3.79Å; E667-M844 HydrophobicContact CG-SD 3.67Å
668	V	86.9	Confident	82.1	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.012	32%	0.315	C	S	.	.	H	α-helix	trans	-78.7	-42.8	176.3	175.2	0	0	0	0	110.5	W662 M665 P666 S671 L674 P845	W662-V668 HydrophobicContact CD2-CG1 4.14Å; W662-V668 HydrophobicContact CD2-CG2 4.2Å; W662-V668 HydrophobicContact CE3-CG1 4.17Å; W662-V668 HydrophobicContact CG-CG2 4.39Å; W662-V668 HydrophobicContact CH2-CG1 3.74Å; W662-V668 HydrophobicContact CZ2-CG1 3.72Å; W662-V668 HydrophobicContact CZ2-CG2 3.98Å; W662-V668 HydrophobicContact CZ3-CG1 3.98Å; W662-V668 WeakPolarHBondContact O-CB 3.15Å; W662-V668 WeakPolarHBondContact O-CG1 3.38Å; W662-V668 WeakPolarHBondContact O-CG2 3.33Å; M665-V668 HydrophobicContact CB-CB 4.12Å; M665-V668 HydrophobicContact CB-CG2 3.92Å; M665-V668 PolarHBondContact O-N 3.28Å; P666-V668 VanDerWaalsContact C-N 3.26Å; P666-V668 PolarHBondContact O-N 2.98Å; V668-S671 PolarHBondContact O-OG 3.07Å; V668-L674 HydrophobicContact CG1-CD1 4.42Å; V668-L674 HydrophobicContact CG1-CD2 3.88Å; V668-L674 HydrophobicContact CG1-CG 4.08Å; V668-P845 HydrophobicContact CG2-CB 3.96Å
669	V	86.7	Confident	84.3	Confident	76 Å²	76	64.4 Å²	64.4	46%	0.461	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-49.2	176.4	174.1	0	0	0	0	111	M665 P666 S671 N672	M665-V669 WeakPolarHBondContact O-CG2 3.32Å; M665-V669 PolarHBondContact O-N 2.87Å; P666-V669 PolarHBondContact O-N 3.05Å; V669-S671 VanDerWaalsContact C-N 3.33Å; V669-S671 PolarHBondContact O-N 3.12Å; V669-N672 PolarHBondContact O-N 3.16Å
670	E	87.2	Confident	85.7	Confident	147 Å²	147	60.1 Å²	60.1	69%	0.687	30%	0.301	S	S	*	.	H	α-helix	trans	-59.8	-39.9	178.5	-73.2	170.3	-167.1	0	0	112.2	P666 N672	P666-E670 VanDerWaalsContact O-CB 3.31Å; P666-E670 WeakPolarHBondContact O-CB 3.45Å; P666-E670 VanDerWaalsContact O-CG 3.24Å; P666-E670 WeakPolarHBondContact O-CG 3.28Å; P666-E670 PolarHBondContact O-N 3.12Å; E670-N672 PolarHBondContact O-N 3.28Å; E670-N672 VanDerWaalsContact O-N 3.09Å; E670-N672 PolarHBondContact O-ND2 3.14Å
671	S	86.6	Confident	86.8	Confident	38 Å²	38	58.7 Å²	58.7	27%	0.266	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-9.5	176.2	80.5	0	0	0	0	115	E667 V668 V669 C673	E667-S671 VanDerWaalsContact O-CB 3.31Å; E667-S671 WeakPolarHBondContact O-CB 3.43Å; E667-S671 PolarHBondContact O-N 2.84Å; E667-S671 PolarHBondContact O-OG 2.66Å; V668-S671 PolarHBondContact O-OG 3.07Å; V669-S671 VanDerWaalsContact C-N 3.33Å; V669-S671 PolarHBondContact O-N 3.12Å; S671-C673 PolarHBondContact O-N 3.05Å; S671-C673 WeakPolarHBondContact OG-CB 3.48Å; S671-C673 PolarHBondContact OG-N 3.33Å; S671-C673 PolarHBondContact OG-SG 3.43Å; S671-C673 VanDerWaalsContact OG-SG 3.33Å
672	N	84.1	Confident	87.4	Confident	88 Å²	88	58.7 Å²	58.7	47%	0.471	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	20.5	-175.9	-76	-96.9	0	0	0	114.1	V669 E670 L674 Q675	V669-N672 PolarHBondContact O-N 3.16Å; E670-N672 PolarHBondContact O-N 3.28Å; E670-N672 VanDerWaalsContact O-N 3.09Å; E670-N672 PolarHBondContact O-ND2 3.14Å; N672-L674 VanDerWaalsContact C-N 3.28Å; N672-L674 PolarHBondContact O-N 3.25Å; N672-Q675 PolarHBondContact O-N 2.84Å; N672-Q675 PolarHBondContact OD1-NE2 2.81Å
673	C	85.8	Confident	87.7	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-68.4	-25.8	-173.8	69.9	0	0	0	0	113.3	S671 Q675 R676 L677 I846	S671-C673 PolarHBondContact O-N 3.05Å; S671-C673 WeakPolarHBondContact OG-CB 3.48Å; S671-C673 PolarHBondContact OG-N 3.33Å; S671-C673 PolarHBondContact OG-SG 3.43Å; S671-C673 VanDerWaalsContact OG-SG 3.33Å; C673-Q675 PolarHBondContact O-N 3.42Å; C673-R676 WeakPolarHBondContact O-CA 3.43Å; C673-R676 WeakPolarHBondContact O-CB 3.16Å; C673-R676 PolarHBondContact O-N 2.85Å; C673-L677 PolarHBondContact O-N 2.71Å; C673-I846 HydrophobicContact CB-CD1 4.27Å
674	L	85.4	Confident	88.1	Confident	46 Å²	46	61 Å²	61	24%	0.241	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-56.6	-34.8	176.1	-57.5	175.6	0	0	0	112.4	W662 S663 V668 N672 R676 I682	W662-L674 HydrophobicContact CE3-CD2 4.3Å; W662-L674 HydrophobicContact CH2-CD2 4.06Å; W662-L674 HydrophobicContact CZ3-CD2 3.52Å; S663-L674 WeakPolarHBondContact O-CD1 3.28Å; V668-L674 HydrophobicContact CG1-CD1 4.42Å; V668-L674 HydrophobicContact CG1-CD2 3.88Å; V668-L674 HydrophobicContact CG1-CG 4.08Å; N672-L674 VanDerWaalsContact C-N 3.28Å; N672-L674 PolarHBondContact O-N 3.25Å; L674-R676 PolarHBondContact O-N 2.98Å; L674-I682 HydrophobicContact CD2-CD1 4.41Å; L674-I682 HydrophobicContact CD2-CG1 4.36Å
675	Q	83.4	Confident	88.6	Confident	147 Å²	147	55.9 Å²	55.9	69%	0.687	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-68.3	-22	175.6	-60.4	-171.7	25.6	0	0	112.5	N672 C673 K946	N672-Q675 PolarHBondContact O-N 2.84Å; N672-Q675 PolarHBondContact OD1-NE2 2.81Å; C673-Q675 PolarHBondContact O-N 3.42Å; Q675-K946 VanDerWaalsContact O-CE 3.29Å; Q675-K946 WeakPolarHBondContact O-CE 3.12Å; Q675-K946 PolarHBondContact O-NZ 3.16Å
676	R	85.4	Confident	89.1	Confident	113 Å²	113	58.6 Å²	58.6	43%	0.426	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-33.9	-179.8	-65.2	-178.3	-77.5	130.7	-8.2	113.8	C673 L674 K946	C673-R676 WeakPolarHBondContact O-CA 3.43Å; C673-R676 WeakPolarHBondContact O-CB 3.16Å; C673-R676 PolarHBondContact O-N 2.85Å; L674-R676 PolarHBondContact O-N 2.98Å; R676-K946 WeakPolarHBondContact O-CE 3.36Å
677	L	89.5	Confident	89.6	Confident	4 Å²	4	55 Å²	55	2%	0.021	26%	0.26	C	S	.	.	S	Bend	trans	-78.8	146.7	-177.3	-61.6	-176.9	0	0	0	113.8	W662 C673 E681 I682 Q685 K946 F949	W662-L677 HydrophobicContact CH2-CD1 3.58Å; W662-L677 HydrophobicContact CZ3-CD1 4.09Å; C673-L677 PolarHBondContact O-N 2.71Å; L677-E681 HydrophobicContact CB-CB 4.04Å; L677-E681 HydrophobicContact CD2-CB 4.25Å; L677-I682 HydrophobicContact CB-CD1 4.4Å; L677-I682 HydrophobicContact CB-CG1 3.79Å; L677-I682 HydrophobicContact CD1-CG1 4.33Å; L677-Q685 HydrophobicContact CD1-CG 4.15Å; L677-K946 VanDerWaalsContact O-CE 3.26Å; L677-K946 WeakPolarHBondContact O-CE 3.35Å; L677-K946 PolarHBondContact O-NZ 3.47Å; L677-F949 HydrophobicContact CD2-CB 3.86Å; L677-F949 HydrophobicContact CD2-CD1 4.08Å; L677-F949 HydrophobicContact CD2-CG 4.27Å
678	T	91	Very high	90.1	Very high	8 Å²	8	53 Å²	53	5%	0.049	25%	0.251	C	S	.	.			trans	-72.9	166.3	168.7	58.8	0	0	0	0	112.2	H680 E681 I682 K946 R947 P948	T678-H680 VanDerWaalsContact C-N 3.33Å; T678-H680 PolarHBondContact O-N 3.21Å; T678-E681 WeakPolarHBondContact CB-OE2 3.4Å; T678-E681 WeakPolarHBondContact CG2-OE2 3.32Å; T678-E681 PolarHBondContact N-OE2 3.18Å; T678-E681 PolarHBondContact O-N 2.88Å; T678-E681 WeakPolarHBondContact OG1-CB 3.27Å; T678-E681 VanDerWaalsContact OG1-CG 3.26Å; T678-E681 WeakPolarHBondContact OG1-CG 3.29Å; T678-E681 PolarHBondContact OG1-N 2.92Å; T678-E681 PolarHBondContact OG1-OE2 2.91Å; T678-I682 WeakPolarHBondContact O-CG1 3.35Å; T678-I682 PolarHBondContact O-N 3.45Å; T678-K946 HydrophobicContact CG2-CG 4.21Å; T678-K946 WeakPolarHBondContact CG2-O 3.45Å; T678-R947 VanDerWaalsContact CG2-C 3.48Å; T678-R947 WeakPolarHBondContact CG2-O 3.39Å; T678-P948 HydrophobicContact CG2-CG 4.29Å
679	R	91.2	Very high	90.4	Very high	185 Å²	185	53.4 Å²	53.4	70%	0.698	25%	0.252	S	S	*	.	H	α-helix	trans	-58.1	-43	177.9	-175.1	-176.8	179.5	-163.1	1.6	112.5	I682 Q683	R679-I682 PolarHBondContact O-N 2.84Å; R679-Q683 WeakPolarHBondContact O-CG 3.45Å; R679-Q683 PolarHBondContact O-N 3.11Å; R679-Q683 VanDerWaalsContact O-N 3.08Å
680	H	93.5	Very high	90.7	Very high	52 Å²	52	53.3 Å²	53.3	24%	0.241	25%	0.247	C	C	.	.	H	α-helix	trans	-72	-30.8	179.3	-64.7	126	0	0	0	112.3	T678 L684 A934 V935 D938	T678-H680 VanDerWaalsContact C-N 3.33Å; T678-H680 PolarHBondContact O-N 3.21Å; H680-L684 VanDerWaalsContact O-CB 3.27Å; H680-L684 WeakPolarHBondContact O-CB 3.43Å; H680-L684 PolarHBondContact O-N 3.29Å; H680-A934 HydrophobicContact CB-CB 4.12Å; H680-V935 HydrophobicContact CB-CG2 3.78Å; H680-D938 IonicContact CE1-OD1 3.53Å; H680-D938 IonicContact CE1-OD2 2.79Å; H680-D938 IonicContact CG-OD2 3.2Å; H680-D938 IonicContact ND1-OD1 3.43Å; H680-D938 PolarHBondContact ND1-OD1 2.83Å; H680-D938 IonicContact ND1-OD2 2.71Å; H680-D938 PolarHBondContact ND1-OD2 2.71Å
681	E	93.7	Very high	91.2	Very high	7 Å²	7	46.3 Å²	46.3	3%	0.033	22%	0.215	C	C	.	.	H	α-helix	trans	-68.1	-42.6	171.1	-75	169.3	118.2	0	0	112.6	L677 T678 Q683 L684 Q685 V935 P948 F949 R950	L677-E681 HydrophobicContact CB-CB 4.04Å; L677-E681 HydrophobicContact CD2-CB 4.25Å; T678-E681 WeakPolarHBondContact CB-OE2 3.4Å; T678-E681 WeakPolarHBondContact CG2-OE2 3.32Å; T678-E681 PolarHBondContact N-OE2 3.18Å; T678-E681 PolarHBondContact O-N 2.88Å; T678-E681 WeakPolarHBondContact OG1-CB 3.27Å; T678-E681 VanDerWaalsContact OG1-CG 3.26Å; T678-E681 WeakPolarHBondContact OG1-CG 3.29Å; T678-E681 PolarHBondContact OG1-N 2.92Å; T678-E681 PolarHBondContact OG1-OE2 2.91Å; E681-Q683 VanDerWaalsContact C-N 3.33Å; E681-Q683 PolarHBondContact O-N 3.4Å; E681-L684 WeakPolarHBondContact O-CB 3.41Å; E681-L684 PolarHBondContact O-N 2.96Å; E681-L684 VanDerWaalsContact O-N 3.14Å; E681-Q685 WeakPolarHBondContact O-CG 3.41Å; E681-Q685 PolarHBondContact O-N 3.16Å; E681-V935 HydrophobicContact CG-CG1 4Å; E681-V935 HydrophobicContact CG-CG2 3.87Å; E681-P948 WeakPolarHBondContact OE2-CA 3.39Å; E681-F949 WeakPolarHBondContact OE1-CA 3.27Å; E681-F949 WeakPolarHBondContact OE1-CB 3.44Å; E681-F949 PolarHBondContact OE1-N 3.2Å; E681-F949 PolarHBondContact OE2-N 2.77Å; E681-F949 VanDerWaalsContact OE2-N 3.17Å; E681-R950 PolarHBondContact OE1-N 2.86Å
682	I	92.8	Very high	91.5	Very high	36 Å²	36	44.5 Å²	44.5	19%	0.185	20%	0.202	C	C	.	.	H	α-helix	trans	-60	-46.5	175.5	-66.7	167.5	0	0	0	109.8	W662 L674 L677 T678 R679 L684 Q685 E686	W662-I682 HydrophobicContact CZ3-CG2 4.38Å; L674-I682 HydrophobicContact CD2-CD1 4.41Å; L674-I682 HydrophobicContact CD2-CG1 4.36Å; L677-I682 HydrophobicContact CB-CD1 4.4Å; L677-I682 HydrophobicContact CB-CG1 3.79Å; L677-I682 HydrophobicContact CD1-CG1 4.33Å; T678-I682 WeakPolarHBondContact O-CG1 3.35Å; T678-I682 PolarHBondContact O-N 3.45Å; R679-I682 PolarHBondContact O-N 2.84Å; I682-L684 VanDerWaalsContact C-N 3.29Å; I682-L684 PolarHBondContact O-N 2.93Å; I682-Q685 PolarHBondContact O-N 2.84Å; I682-E686 HydrophobicContact CG2-CG 4.47Å; I682-E686 WeakPolarHBondContact O-CG 3.4Å; I682-E686 PolarHBondContact O-N 3.43Å
683	Q	94.4	Very high	91.9	Very high	66 Å²	66	41.2 Å²	41.2	31%	0.308	19%	0.185	S	C	.	.	H	α-helix	trans	-62.8	-34	175.5	-72.1	179.1	-24	0	0	112.8	R679 E681 A687 L931	R679-Q683 WeakPolarHBondContact O-CG 3.45Å; R679-Q683 PolarHBondContact O-N 3.11Å; R679-Q683 VanDerWaalsContact O-N 3.08Å; E681-Q683 VanDerWaalsContact C-N 3.33Å; E681-Q683 PolarHBondContact O-N 3.4Å; Q683-A687 VanDerWaalsContact O-CB 3.3Å; Q683-A687 WeakPolarHBondContact O-CB 3.36Å; Q683-A687 PolarHBondContact O-N 2.93Å; Q683-L931 HydrophobicContact CB-CD1 4.16Å; Q683-L931 HydrophobicContact CB-CD2 3.73Å; Q683-L931 WeakPolarHBondContact O-CD1 3.45Å
684	L	95.3	Very high	92.3	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.073	19%	0.188	C	C	.	.	H	α-helix	trans	-68.2	-41.4	175.5	-179.5	58.2	0	0	0	111.5	H680 E681 I682 A687 M688 I928 L931 Q932 V935 P952	H680-L684 VanDerWaalsContact O-CB 3.27Å; H680-L684 WeakPolarHBondContact O-CB 3.43Å; H680-L684 PolarHBondContact O-N 3.29Å; E681-L684 WeakPolarHBondContact O-CB 3.41Å; E681-L684 PolarHBondContact O-N 2.96Å; E681-L684 VanDerWaalsContact O-N 3.14Å; I682-L684 VanDerWaalsContact C-N 3.29Å; I682-L684 PolarHBondContact O-N 2.93Å; L684-A687 PolarHBondContact O-N 3.13Å; L684-M688 HydrophobicContact CG-CE 4.1Å; L684-M688 WeakPolarHBondContact O-CG 3.46Å; L684-M688 PolarHBondContact O-N 3.44Å; L684-I928 HydrophobicContact CD1-CB 4.47Å; L684-I928 HydrophobicContact CD1-CG2 3.96Å; L684-L931 HydrophobicContact CB-CB 4.16Å; L684-L931 HydrophobicContact CD1-CB 4.02Å; L684-Q932 HydrophobicContact CD1-CG 4.06Å; L684-Q932 HydrophobicContact CD2-CG 4.14Å; L684-V935 HydrophobicContact CD2-CG2 4.33Å; L684-P952 HydrophobicContact CD2-CG 4.32Å
685	Q	94.6	Very high	92.8	Very high	13 Å²	13	39.4 Å²	39.4	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-47.3	172	-65.7	-59.7	-48.5	0	0	111.4	W662 L677 E681 I682 A687 M688 F689 L847	W662-Q685 HydrophobicContact CD2-CB 3.53Å; W662-Q685 HydrophobicContact CD2-CG 4.36Å; W662-Q685 HydrophobicContact CE3-CB 3.51Å; W662-Q685 HydrophobicContact CE3-CG 4.27Å; W662-Q685 HydrophobicContact CG-CB 4.2Å; W662-Q685 HydrophobicContact CH2-CB 3.94Å; W662-Q685 HydrophobicContact CH2-CG 3.76Å; W662-Q685 HydrophobicContact CZ2-CB 3.94Å; W662-Q685 HydrophobicContact CZ2-CG 3.83Å; W662-Q685 HydrophobicContact CZ3-CB 3.72Å; W662-Q685 HydrophobicContact CZ3-CG 3.98Å; L677-Q685 HydrophobicContact CD1-CG 4.15Å; E681-Q685 WeakPolarHBondContact O-CG 3.41Å; E681-Q685 PolarHBondContact O-N 3.16Å; I682-Q685 PolarHBondContact O-N 2.84Å; Q685-A687 VanDerWaalsContact C-N 3.34Å; Q685-A687 PolarHBondContact O-N 2.88Å; Q685-M688 PolarHBondContact O-N 3.09Å; Q685-F689 WeakPolarHBondContact O-CB 3.28Å; Q685-F689 PolarHBondContact O-N 2.87Å; Q685-L847 PolarHBondContact NE2-O 3.39Å; Q685-L847 PolarHBondContact OE1-O 2.68Å
686	E	93.7	Very high	93.3	Very high	62 Å²	62	32.5 Å²	32.5	29%	0.29	14%	0.144	S	C	.	.	H	α-helix	trans	-58.2	-42.9	176.3	-72.8	168.1	170.1	0	0	111.9	W662 S663 I682 F689 E690	W662-E686 HydrophobicContact CB-CG 4.02Å; W662-E686 HydrophobicContact CE3-CG 4.45Å; S663-E686 WeakPolarHBondContact CB-OE1 3.48Å; S663-E686 PolarHBondContact OG-OE1 2.62Å; I682-E686 HydrophobicContact CG2-CG 4.47Å; I682-E686 WeakPolarHBondContact O-CG 3.4Å; I682-E686 PolarHBondContact O-N 3.43Å; E686-F689 PolarHBondContact O-N 2.75Å; E686-E690 WeakPolarHBondContact O-CB 3.3Å; E686-E690 PolarHBondContact O-N 3.44Å
687	A	95.2	Very high	93.7	Very high	5 Å²	5	27.9 Å²	27.9	4%	0.041	13%	0.129	C	C	.	.	H	α-helix	trans	-67.5	-38	177.3	0	0	0	0	0	113.2	Q683 L684 Q685 E690 V691 V927 I928 L931	Q683-A687 VanDerWaalsContact O-CB 3.3Å; Q683-A687 WeakPolarHBondContact O-CB 3.36Å; Q683-A687 PolarHBondContact O-N 2.93Å; L684-A687 PolarHBondContact O-N 3.13Å; Q685-A687 VanDerWaalsContact C-N 3.34Å; Q685-A687 PolarHBondContact O-N 2.88Å; A687-E690 PolarHBondContact O-N 3.37Å; A687-V691 PolarHBondContact O-N 2.88Å; A687-V927 HydrophobicContact CB-CG1 4.01Å; A687-I928 HydrophobicContact CB-CG1 3.98Å; A687-L931 HydrophobicContact CB-CD1 3.8Å
688	M	95.1	Very high	94	Very high	5 Å²	5	28.4 Å²	28.4	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-68.8	-38.9	173.7	-70.5	-171.8	-65.1	0	0	111.7	L684 Q685 E690 V691 L847 V850 I928	L684-M688 HydrophobicContact CG-CE 4.1Å; L684-M688 WeakPolarHBondContact O-CG 3.46Å; L684-M688 PolarHBondContact O-N 3.44Å; Q685-M688 PolarHBondContact O-N 3.09Å; M688-E690 VanDerWaalsContact C-N 3.34Å; M688-V691 WeakPolarHBondContact O-CB 3.37Å; M688-V691 PolarHBondContact O-N 3.07Å; M688-L847 HydrophobicContact CB-CD1 4.16Å; M688-L847 HydrophobicContact CE-CB 3.98Å; M688-L847 WeakPolarHBondContact CE-O 3.39Å; M688-L847 HydrophobicContact SD-CB 4.48Å; M688-V850 HydrophobicContact CB-CG1 4.13Å; M688-V850 HydrophobicContact CB-CG2 4.13Å; M688-V850 HydrophobicContact CG-CG2 3.94Å; M688-I928 HydrophobicContact CG-CD1 3.98Å; M688-I928 HydrophobicContact CG-CG1 4.22Å
689	F	93.7	Very high	94.2	Very high	9 Å²	9	29.2 Å²	29.2	4%	0.039	13%	0.133	C	C	.	.	H	α-helix	trans	-70.3	-28.9	175	-168.8	-111.5	0	0	0	112.6	F650 W662 M665 Q685 E686 V691 I692 T693 W840	F650-F689 HydrophobicContact CD1-CE2 4.02Å; F650-F689 AromaticContact CD1-CZ 3.95Å; F650-F689 HydrophobicContact CD1-CZ 3.95Å; F650-F689 HydrophobicContact CE1-CE2 4.03Å; F650-F689 HydrophobicContact CE1-CZ 4.42Å; W662-F689 HydrophobicContact CB-CB 3.92Å; W662-F689 HydrophobicContact CB-CD1 3.81Å; W662-F689 HydrophobicContact CB-CG 3.96Å; W662-F689 HydrophobicContact CG-CB 4.32Å; W662-F689 HydrophobicContact CG-CG 4.44Å; M665-F689 HydrophobicContact CE-CE2 4.39Å; M665-F689 HydrophobicContact CE-CZ 3.92Å; M665-F689 HydrophobicContact CG-CZ 4.45Å; M665-F689 HydrophobicContact SD-CD2 4.5Å; M665-F689 HydrophobicContact SD-CE1 3.75Å; M665-F689 HydrophobicContact SD-CE2 3.64Å; M665-F689 HydrophobicContact SD-CZ 3.21Å; M665-F689 WeakPolarHBondContact SD-CZ 3.1Å; Q685-F689 WeakPolarHBondContact O-CB 3.28Å; Q685-F689 PolarHBondContact O-N 2.87Å; E686-F689 PolarHBondContact O-N 2.75Å; F689-V691 VanDerWaalsContact C-N 3.27Å; F689-V691 PolarHBondContact O-N 3.04Å; F689-I692 PolarHBondContact O-N 3Å; F689-T693 HydrophobicContact CD1-CG2 3.77Å; F689-T693 HydrophobicContact CD2-CG2 4.48Å; F689-T693 HydrophobicContact CE1-CG2 3.34Å; F689-T693 HydrophobicContact CE2-CG2 4.12Å; F689-T693 HydrophobicContact CG-CG2 4.32Å; F689-T693 HydrophobicContact CZ-CG2 3.52Å; F689-T693 PolarHBondContact O-N 2.92Å; F689-T693 PolarHBondContact O-OG1 2.93Å; F689-W840 HydrophobicContact CE2-CZ2 4.26Å
690	E	93.9	Very high	94.3	Very high	75 Å²	75	23.9 Å²	23.9	35%	0.35	12%	0.116	S	C	.	.	H	α-helix	trans	-64.2	-30	170.6	-171.3	176.9	-176.5	0	0	111.8	E686 A687 M688 S694 R920 L924	E686-E690 WeakPolarHBondContact O-CB 3.3Å; E686-E690 PolarHBondContact O-N 3.44Å; A687-E690 PolarHBondContact O-N 3.37Å; M688-E690 VanDerWaalsContact C-N 3.34Å; E690-S694 VanDerWaalsContact O-CB 3.22Å; E690-S694 WeakPolarHBondContact O-CB 3.25Å; E690-S694 PolarHBondContact O-N 3.43Å; E690-S694 VanDerWaalsContact O-N 3.08Å; E690-S694 PolarHBondContact O-OG 3.29Å; E690-R920 VanDerWaalsContact CD-NH2 3.33Å; E690-R920 IonicContact OE1-CZ 3.5Å; E690-R920 VanDerWaalsContact OE1-CZ 3.3Å; E690-R920 IonicContact OE1-NH1 3.54Å; E690-R920 PolarHBondContact OE1-NH1 3.22Å; E690-R920 VanDerWaalsContact OE1-NH1 3.07Å; E690-R920 IonicContact OE1-NH2 2.69Å; E690-R920 PolarHBondContact OE1-NH2 3.22Å; E690-L924 HydrophobicContact CB-CD2 4.21Å; E690-L924 VanDerWaalsContact CD-CD2 3.47Å; E690-L924 HydrophobicContact CG-CD1 4.45Å; E690-L924 HydrophobicContact CG-CD2 3.77Å; E690-L924 WeakPolarHBondContact OE2-CD2 3.49Å
691	V	95.9	Very high	94.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.5	-47.3	171.7	179.3	0	0	0	0	110.8	A687 M688 F689 E695 F832 L836 V850 I854 R917 L921 L924 I928	A687-V691 PolarHBondContact O-N 2.88Å; M688-V691 WeakPolarHBondContact O-CB 3.37Å; M688-V691 PolarHBondContact O-N 3.07Å; F689-V691 VanDerWaalsContact C-N 3.27Å; F689-V691 PolarHBondContact O-N 3.04Å; V691-E695 PolarHBondContact O-N 3.44Å; V691-F832 HydrophobicContact CG1-CZ 4.46Å; V691-L836 HydrophobicContact CG1-CD1 4.31Å; V691-L836 HydrophobicContact CG1-CD2 4.49Å; V691-V850 HydrophobicContact CB-CG2 4.37Å; V691-V850 HydrophobicContact CG2-CG2 4.19Å; V691-I854 HydrophobicContact CG1-CD1 4.38Å; V691-R917 PolarHBondContact O-NH2 3.49Å; V691-L921 HydrophobicContact CG1-CD2 4.3Å; V691-L924 HydrophobicContact CG2-CB 4.02Å; V691-L924 HydrophobicContact CG2-CD1 4.05Å; V691-I928 HydrophobicContact CG2-CD1 3.94Å
692	I	94.1	Very high	94.3	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68.1	-56.8	-178.4	-50.1	-174.2	0	0	0	110.8	F650 F689 S694 E695 A696 L836 W840 L847	F650-I692 HydrophobicContact CE1-CG2 4.18Å; F650-I692 HydrophobicContact CZ-CG2 4.28Å; F689-I692 PolarHBondContact O-N 3Å; I692-S694 PolarHBondContact O-N 3.48Å; I692-E695 WeakPolarHBondContact O-CB 3.36Å; I692-E695 PolarHBondContact O-N 3.27Å; I692-A696 PolarHBondContact O-N 3.18Å; I692-L836 HydrophobicContact CG1-CB 4.19Å; I692-L836 HydrophobicContact CG1-CD2 4.28Å; I692-L836 HydrophobicContact CG2-CB 4.34Å; I692-W840 HydrophobicContact CD1-CB 3.87Å; I692-W840 HydrophobicContact CD1-CG 4.31Å; I692-L847 HydrophobicContact CD1-CD1 3.78Å
693	T	92.8	Very high	94.4	Very high	18 Å²	18	22.6 Å²	22.6	11%	0.11	12%	0.115	C	C	.	.	H	α-helix	trans	-64.1	-25.7	-176.9	55	0	0	0	0	113.2	F650 F689 S697	F650-T693 HydrophobicContact CD1-CG2 4.31Å; F689-T693 HydrophobicContact CD1-CG2 3.77Å; F689-T693 HydrophobicContact CD2-CG2 4.48Å; F689-T693 HydrophobicContact CE1-CG2 3.34Å; F689-T693 HydrophobicContact CE2-CG2 4.12Å; F689-T693 HydrophobicContact CG-CG2 4.32Å; F689-T693 HydrophobicContact CZ-CG2 3.52Å; F689-T693 PolarHBondContact O-N 2.92Å; F689-T693 PolarHBondContact O-OG1 2.93Å; T693-S697 WeakPolarHBondContact O-CB 3.33Å; T693-S697 PolarHBondContact O-N 3.41Å; T693-S697 VanDerWaalsContact O-N 3.17Å; T693-S697 PolarHBondContact O-OG 3.42Å
694	S	94.6	Very high	94.3	Very high	9 Å²	9	20.9 Å²	20.9	6%	0.063	11%	0.109	C	C	.	.	H	α-helix	trans	-88.8	-18.9	172.3	72.2	0	0	0	0	115.2	E690 I692 Y698 R920	E690-S694 VanDerWaalsContact O-CB 3.22Å; E690-S694 WeakPolarHBondContact O-CB 3.25Å; E690-S694 PolarHBondContact O-N 3.43Å; E690-S694 VanDerWaalsContact O-N 3.08Å; E690-S694 PolarHBondContact O-OG 3.29Å; I692-S694 PolarHBondContact O-N 3.48Å; S694-Y698 VanDerWaalsContact O-CB 3.22Å; S694-Y698 WeakPolarHBondContact O-CB 3.37Å; S694-Y698 PolarHBondContact O-N 2.86Å; S694-Y698 VanDerWaalsContact O-N 3.12Å; S694-R920 PolarHBondContact OG-NE 2.98Å; S694-R920 VanDerWaalsContact OG-NE 3.14Å; S694-R920 PolarHBondContact OG-NH2 3.18Å; S694-R920 VanDerWaalsContact OG-NH2 3.12Å
695	E	95.9	Very high	94.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.5	-51.4	161.2	-172.8	61.5	-147.3	0	0	110	V691 I692 S697 Y698 Y699 S829 F832 L833 L836 R917	V691-E695 PolarHBondContact O-N 3.44Å; I692-E695 WeakPolarHBondContact O-CB 3.36Å; I692-E695 PolarHBondContact O-N 3.27Å; E695-S697 VanDerWaalsContact C-N 3.27Å; E695-S697 PolarHBondContact O-N 2.89Å; E695-Y698 CarbonylContact O-C 3.54Å; E695-Y698 WeakPolarHBondContact O-CA 3.41Å; E695-Y698 WeakPolarHBondContact O-CB 3.32Å; E695-Y698 PolarHBondContact O-N 3.26Å; E695-Y699 PolarHBondContact O-N 3.41Å; E695-S829 WeakPolarHBondContact OE1-CA 3.39Å; E695-S829 WeakPolarHBondContact OE1-CB 3.49Å; E695-S829 PolarHBondContact OE1-OG 3.31Å; E695-F832 HydrophobicContact CG-CD1 3.99Å; E695-F832 HydrophobicContact CG-CE1 4.44Å; E695-F832 WeakPolarHBondContact OE2-CD1 3.5Å; E695-L833 HydrophobicContact CB-CD1 4.12Å; E695-L833 HydrophobicContact CG-CB 3.82Å; E695-L833 HydrophobicContact CG-CD1 3.99Å; E695-L833 HydrophobicContact CG-CG 4.42Å; E695-L836 HydrophobicContact CB-CD1 4.05Å; E695-L836 HydrophobicContact CG-CD1 4.26Å; E695-R917 IonicContact OE2-CZ 3.61Å; E695-R917 IonicContact OE2-NE 2.8Å; E695-R917 PolarHBondContact OE2-NE 2.73Å; E695-R917 IonicContact OE2-NH2 3.66Å; E695-R917 PolarHBondContact OE2-NH2 3.01Å
696	A	93.9	Very high	94.2	Very high	1 Å²	1	20 Å²	20	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-55.9	-42.1	178.1	0	0	0	0	0	112.4	I692 Y698 Q700 L833	I692-A696 PolarHBondContact O-N 3.18Å; A696-Y698 VanDerWaalsContact C-N 3.33Å; A696-Y698 PolarHBondContact O-N 2.72Å; A696-Q700 WeakPolarHBondContact O-CB 3.49Å; A696-Q700 PolarHBondContact O-N 3.41Å; A696-L833 HydrophobicContact CB-CD1 3.99Å; A696-L833 HydrophobicContact CB-CD2 4.36Å
697	S	92.3	Very high	94.1	Very high	17 Å²	17	22 Å²	22	12%	0.119	12%	0.118	C	C	.	.	H	α-helix	trans	-64.7	-36	175	-57.4	0	0	0	0	113.1	R659 T693 E695 S701	R659-S697 PolarHBondContact NH1-OG 2.97Å; R659-S697 PolarHBondContact NH2-OG 3.37Å; T693-S697 WeakPolarHBondContact O-CB 3.33Å; T693-S697 PolarHBondContact O-N 3.41Å; T693-S697 VanDerWaalsContact O-N 3.17Å; T693-S697 PolarHBondContact O-OG 3.42Å; E695-S697 VanDerWaalsContact C-N 3.27Å; E695-S697 PolarHBondContact O-N 2.89Å; S697-S701 WeakPolarHBondContact O-CB 3.42Å; S697-S701 PolarHBondContact O-N 3.21Å; S697-S701 PolarHBondContact O-OG 3.31Å
698	Y	96	Very high	93.9	Very high	14 Å²	14	22.6 Å²	22.6	6%	0.055	12%	0.119	C	C	.	.	H	α-helix	trans	-75.1	-47.3	180	165.8	-106.8	0	0	0	111.3	S694 E695 A696 Q700 S701 L702 V825 S829 Y866 L913 R917	S694-Y698 VanDerWaalsContact O-CB 3.22Å; S694-Y698 WeakPolarHBondContact O-CB 3.37Å; S694-Y698 PolarHBondContact O-N 2.86Å; S694-Y698 VanDerWaalsContact O-N 3.12Å; E695-Y698 CarbonylContact O-C 3.54Å; E695-Y698 WeakPolarHBondContact O-CA 3.41Å; E695-Y698 WeakPolarHBondContact O-CB 3.32Å; E695-Y698 PolarHBondContact O-N 3.26Å; A696-Y698 VanDerWaalsContact C-N 3.33Å; A696-Y698 PolarHBondContact O-N 2.72Å; Y698-Q700 VanDerWaalsContact C-N 3.33Å; Y698-Q700 PolarHBondContact O-N 3.3Å; Y698-S701 CarbonylContact O-C 3.59Å; Y698-S701 WeakPolarHBondContact O-CA 3.32Å; Y698-S701 WeakPolarHBondContact O-CB 3.47Å; Y698-S701 PolarHBondContact O-N 3.14Å; Y698-L702 HydrophobicContact CD1-CD1 4.4Å; Y698-L702 HydrophobicContact CD2-CG 4.5Å; Y698-L702 HydrophobicContact CE1-CD1 3.66Å; Y698-L702 HydrophobicContact CE1-CG 4.16Å; Y698-L702 HydrophobicContact CE2-CD1 4.3Å; Y698-L702 HydrophobicContact CE2-CD2 3.98Å; Y698-L702 HydrophobicContact CE2-CG 4.02Å; Y698-L702 PolarHBondContact O-N 3.4Å; Y698-V825 WeakPolarHBondContact OH-CG1 3.32Å; Y698-S829 WeakPolarHBondContact CD1-OG 3.38Å; Y698-S829 WeakPolarHBondContact CE1-OG 3.34Å; Y698-Y866 WeakPolarHBondContact CE1-OH 3.06Å; Y698-Y866 WeakPolarHBondContact OH-CE1 3.49Å; Y698-Y866 PolarHBondContact OH-OH 3.19Å; Y698-L913 HydrophobicContact CD2-CB 4.15Å; Y698-L913 HydrophobicContact CE2-CB 3.76Å; Y698-R917 HydrophobicContact CD1-CB 4.29Å; Y698-R917 HydrophobicContact CD1-CG 3.72Å; Y698-R917 HydrophobicContact CD2-CB 3.8Å; Y698-R917 HydrophobicContact CD2-CG 4.13Å; Y698-R917 HydrophobicContact CE1-CB 4.08Å; Y698-R917 HydrophobicContact CE1-CG 3.65Å; Y698-R917 HydrophobicContact CE2-CB 3.56Å; Y698-R917 HydrophobicContact CE2-CG 4.07Å; Y698-R917 HydrophobicContact CG-CB 4.16Å; Y698-R917 HydrophobicContact CG-CG 3.95Å
699	Y	95.7	Very high	93.8	Very high	25 Å²	25	22.3 Å²	22.3	10%	0.098	12%	0.118	C	C	.	.	H	α-helix	trans	-56.6	-46.1	174.5	-178.5	-121.2	0	0	0	111.3	L643 E695 S701 L702 N703 S829 E830 L833	L643-Y699 HydrophobicContact CD2-CE1 4.17Å; E695-Y699 PolarHBondContact O-N 3.41Å; Y699-S701 PolarHBondContact O-N 3.1Å; Y699-L702 CarbonylContact O-C 3.54Å; Y699-L702 WeakPolarHBondContact O-CB 3.47Å; Y699-L702 PolarHBondContact O-N 2.68Å; Y699-L702 VanDerWaalsContact O-N 3.1Å; Y699-N703 VanDerWaalsContact CE1-ND2 3.27Å; Y699-N703 WeakPolarHBondContact CE1-ND2 3.43Å; Y699-N703 PolarHBondContact O-N 2.96Å; Y699-N703 PolarHBondContact O-ND2 3.45Å; Y699-S829 WeakPolarHBondContact CB-OG 3.18Å; Y699-E830 HydrophobicContact CD2-CB 4.28Å; Y699-E830 HydrophobicContact CE1-CG 4.22Å; Y699-E830 HydrophobicContact CE2-CB 3.58Å; Y699-E830 HydrophobicContact CE2-CG 4.06Å; Y699-E830 WeakPolarHBondContact OH-CG 3.49Å; Y699-E830 PolarHBondContact OH-OE1 3.37Å; Y699-L833 HydrophobicContact CD1-CD2 3.7Å; Y699-L833 HydrophobicContact CG-CD2 4.12Å
700	Q	92.6	Very high	93.8	Very high	73 Å²	73	23.4 Å²	23.4	34%	0.341	12%	0.122	S	C	.	.	H	α-helix	trans	-62.4	-31.7	175	-175.3	61.7	-6.6	0	0	112.9	A696 Y698 N703 V704	A696-Q700 WeakPolarHBondContact O-CB 3.49Å; A696-Q700 PolarHBondContact O-N 3.41Å; Y698-Q700 VanDerWaalsContact C-N 3.33Å; Y698-Q700 PolarHBondContact O-N 3.3Å; Q700-N703 PolarHBondContact O-N 2.94Å; Q700-V704 PolarHBondContact O-N 2.84Å; Q700-V704 VanDerWaalsContact O-N 3.16Å
701	S	93.7	Very high	93.7	Very high	40 Å²	40	23.8 Å²	23.8	28%	0.28	12%	0.124	S	C	.	.	H	α-helix	trans	-74.8	-32.5	174.8	-55.4	0	0	0	0	112.5	S697 Y698 Y699 V704 L705 F910	S697-S701 WeakPolarHBondContact O-CB 3.42Å; S697-S701 PolarHBondContact O-N 3.21Å; S697-S701 PolarHBondContact O-OG 3.31Å; Y698-S701 CarbonylContact O-C 3.59Å; Y698-S701 WeakPolarHBondContact O-CA 3.32Å; Y698-S701 WeakPolarHBondContact O-CB 3.47Å; Y698-S701 PolarHBondContact O-N 3.14Å; Y699-S701 PolarHBondContact O-N 3.1Å; S701-V704 PolarHBondContact O-N 2.83Å; S701-L705 PolarHBondContact O-N 2.9Å; S701-L705 VanDerWaalsContact O-N 3.13Å; S701-F910 WeakPolarHBondContact O-CD1 3.22Å
702	L	94.5	Very high	93.4	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.7	-39.4	167.8	-67.8	-173.4	0	0	0	111.5	Y698 Y699 V704 L705 V706 V825 C826	Y698-L702 HydrophobicContact CD1-CD1 4.4Å; Y698-L702 HydrophobicContact CD2-CG 4.5Å; Y698-L702 HydrophobicContact CE1-CD1 3.66Å; Y698-L702 HydrophobicContact CE1-CG 4.16Å; Y698-L702 HydrophobicContact CE2-CD1 4.3Å; Y698-L702 HydrophobicContact CE2-CD2 3.98Å; Y698-L702 HydrophobicContact CE2-CG 4.02Å; Y698-L702 PolarHBondContact O-N 3.4Å; Y699-L702 CarbonylContact O-C 3.54Å; Y699-L702 WeakPolarHBondContact O-CB 3.47Å; Y699-L702 PolarHBondContact O-N 2.68Å; Y699-L702 VanDerWaalsContact O-N 3.1Å; L702-V704 PolarHBondContact O-N 3.49Å; L702-L705 HydrophobicContact CD2-CD2 4.49Å; L702-L705 CarbonylContact O-C 3.58Å; L702-L705 WeakPolarHBondContact O-CA 3.29Å; L702-L705 WeakPolarHBondContact O-CB 3.4Å; L702-L705 PolarHBondContact O-N 3.42Å; L702-V706 WeakPolarHBondContact O-CG2 3.1Å; L702-V706 PolarHBondContact O-N 2.94Å; L702-V825 HydrophobicContact CD1-CG1 4.32Å; L702-C826 HydrophobicContact CD1-CB 4.36Å
703	N	93.6	Very high	93	Very high	29 Å²	29	28.3 Å²	28.3	16%	0.155	15%	0.154	C	C	.	.	H	α-helix	trans	-62.3	-32.1	175.6	-71.7	-26.5	0	0	0	112.1	Y699 Q700 N707	Y699-N703 VanDerWaalsContact CE1-ND2 3.27Å; Y699-N703 WeakPolarHBondContact CE1-ND2 3.43Å; Y699-N703 PolarHBondContact O-N 2.96Å; Y699-N703 PolarHBondContact O-ND2 3.45Å; Q700-N703 PolarHBondContact O-N 2.94Å; N703-N707 WeakPolarHBondContact O-CB 3.4Å; N703-N707 PolarHBondContact O-N 3.21Å; N703-N707 PolarHBondContact O-ND2 3.17Å
704	V	92.7	Very high	92.6	Very high	29 Å²	29	29.5 Å²	29.5	18%	0.176	16%	0.158	C	C	.	.	H	α-helix	trans	-68.3	-46.8	168.4	175.4	0	0	0	0	111.2	Q700 S701 L702 V706 H708 F709 R901 F910	Q700-V704 PolarHBondContact O-N 2.84Å; Q700-V704 VanDerWaalsContact O-N 3.16Å; S701-V704 PolarHBondContact O-N 2.83Å; L702-V704 PolarHBondContact O-N 3.49Å; V704-V706 VanDerWaalsContact C-N 3.26Å; V704-V706 PolarHBondContact O-N 3.41Å; V704-H708 HydrophobicContact CG1-CB 4.18Å; V704-H708 WeakPolarHBondContact O-CA 3.47Å; V704-H708 VanDerWaalsContact O-CB 3.22Å; V704-H708 WeakPolarHBondContact O-CB 3.36Å; V704-H708 PolarHBondContact O-N 3.34Å; V704-F709 HydrophobicContact CG1-CE2 4.31Å; V704-R901 WeakPolarHBondContact CG1-O 3.4Å; V704-F910 HydrophobicContact CB-CE1 3.84Å; V704-F910 HydrophobicContact CB-CZ 4.25Å; V704-F910 HydrophobicContact CG1-CD1 4.47Å; V704-F910 HydrophobicContact CG1-CE1 3.62Å; V704-F910 HydrophobicContact CG1-CE2 4.31Å; V704-F910 HydrophobicContact CG1-CZ 3.53Å
705	L	94.1	Very high	92.3	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-56.3	-40.1	175.9	179	56	0	0	0	112.4	S701 L702 F709 Y710 F819 V822 F910 L911	S701-L705 PolarHBondContact O-N 2.9Å; S701-L705 VanDerWaalsContact O-N 3.13Å; L702-L705 HydrophobicContact CD2-CD2 4.49Å; L702-L705 CarbonylContact O-C 3.58Å; L702-L705 WeakPolarHBondContact O-CA 3.29Å; L702-L705 WeakPolarHBondContact O-CB 3.4Å; L702-L705 PolarHBondContact O-N 3.42Å; L705-F709 HydrophobicContact CD1-CB 4.41Å; L705-F709 WeakPolarHBondContact O-CB 3.47Å; L705-F709 PolarHBondContact O-N 3.35Å; L705-Y710 PolarHBondContact O-N 2.81Å; L705-F819 HydrophobicContact CD1-CD1 4.15Å; L705-F819 HydrophobicContact CD1-CE1 3.82Å; L705-V822 HydrophobicContact CD2-CG2 3.8Å; L705-V822 HydrophobicContact CG-CG2 4.31Å; L705-F910 HydrophobicContact CB-CB 4.15Å; L705-F910 HydrophobicContact CB-CD1 4.39Å; L705-F910 HydrophobicContact CD1-CB 3.87Å; L705-F910 HydrophobicContact CD2-CB 4.3Å; L705-F910 HydrophobicContact CG-CB 4.32Å; L705-L911 HydrophobicContact CD1-CD2 4.16Å; L705-L911 HydrophobicContact CD2-CD2 4.4Å
706	V	94.2	Very high	91.5	Very high	9 Å²	9	33.4 Å²	33.4	6%	0.055	18%	0.175	C	C	.	.	I	π-helix	trans	-77.2	-60.7	179.6	174.2	0	0	0	0	111.3	L702 V704 H708 Y710 H711 V822 L823 C826	L702-V706 WeakPolarHBondContact O-CG2 3.1Å; L702-V706 PolarHBondContact O-N 2.94Å; V704-V706 VanDerWaalsContact C-N 3.26Å; V704-V706 PolarHBondContact O-N 3.41Å; V706-H708 PolarHBondContact O-N 2.92Å; V706-Y710 WeakPolarHBondContact O-CA 3.48Å; V706-Y710 WeakPolarHBondContact O-CB 3.46Å; V706-Y710 PolarHBondContact O-N 3.1Å; V706-Y710 VanDerWaalsContact O-N 3.11Å; V706-H711 PolarHBondContact O-CD2 3.45Å; V706-H711 PolarHBondContact O-N 3.29Å; V706-V822 HydrophobicContact CG2-CG2 4.32Å; V706-L823 HydrophobicContact CB-CD2 4.27Å; V706-L823 HydrophobicContact CG1-CD2 3.5Å; V706-L823 HydrophobicContact CG2-CD2 3.71Å; V706-C826 HydrophobicContact CG2-CB 4.5Å
707	N	92.5	Very high	90.5	Very high	104 Å²	104	34.9 Å²	34.9	56%	0.556	19%	0.185	S	C	*	.	I	π-helix	trans	-77.9	-20.8	-169.4	-59.1	-28.6	0	0	0	113.8	N703	N703-N707 WeakPolarHBondContact O-CB 3.4Å; N703-N707 PolarHBondContact O-N 3.21Å; N703-N707 PolarHBondContact O-ND2 3.17Å
708	H	91	Very high	88.6	Confident	17 Å²	17	40.9 Å²	40.9	8%	0.079	21%	0.211	C	C	.	.	I	π-helix	trans	-107.1	-23.8	-179.7	-169.7	72.7	0	0	0	113.9	V704 V706 L896 H899 S902	V704-H708 HydrophobicContact CG1-CB 4.18Å; V704-H708 WeakPolarHBondContact O-CA 3.47Å; V704-H708 VanDerWaalsContact O-CB 3.22Å; V704-H708 WeakPolarHBondContact O-CB 3.36Å; V704-H708 PolarHBondContact O-N 3.34Å; V706-H708 PolarHBondContact O-N 2.92Å; H708-L896 PolarHBondContact NE2-O 3.49Å; H708-H899 VanDerWaalsContact CE1-CB 3.45Å; H708-H899 WeakPolarHBondContact CE1-CB 3.32Å; H708-H899 AromaticContact CE1-CG 3.43Å; H708-H899 VanDerWaalsContact CE1-CG 3.43Å; H708-H899 AromaticContact CE1-ND1 3.07Å; H708-H899 PolarHBondContact CE1-ND1 3.23Å; H708-H899 AromaticContact ND1-ND1 3.37Å; H708-H899 PolarHBondContact ND1-ND1 3.35Å; H708-H899 AromaticContact NE2-ND1 3.97Å; H708-S902 PolarHBondContact CD2-OG 3.41Å; H708-S902 VanDerWaalsContact CD2-OG 3.23Å; H708-S902 PolarHBondContact NE2-OG 2.79Å
709	F	93	Very high	86.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-115.2	-50.1	176.3	-60.6	-89.5	0	0	0	113.3	V704 L705 H711 A712 F715 F819 L893 L896 H897 S902 I907 F910	V704-F709 HydrophobicContact CG1-CE2 4.31Å; L705-F709 HydrophobicContact CD1-CB 4.41Å; L705-F709 WeakPolarHBondContact O-CB 3.47Å; L705-F709 PolarHBondContact O-N 3.35Å; F709-H711 VanDerWaalsContact C-N 3.35Å; F709-H711 PolarHBondContact O-N 2.87Å; F709-A712 WeakPolarHBondContact O-CB 3.44Å; F709-A712 PolarHBondContact O-N 3.2Å; F709-F715 VanDerWaalsContact O-CD2 3.26Å; F709-F715 WeakPolarHBondContact O-CD2 3.22Å; F709-F819 HydrophobicContact CB-CE1 4.12Å; F709-F819 HydrophobicContact CB-CZ 4.12Å; F709-L893 HydrophobicContact CD1-CD1 4.34Å; F709-L893 HydrophobicContact CE1-CD1 4.21Å; F709-L896 HydrophobicContact CD1-CB 4.24Å; F709-L896 HydrophobicContact CD1-CD1 4.35Å; F709-L896 HydrophobicContact CE1-CB 3.97Å; F709-H897 AromaticContact CE1-CD2 3.9Å; F709-S902 WeakPolarHBondContact CZ-OG 3.46Å; F709-I907 HydrophobicContact CB-CD1 4.23Å; F709-I907 HydrophobicContact CD1-CB 4.12Å; F709-I907 HydrophobicContact CD1-CD1 3.92Å; F709-I907 HydrophobicContact CD1-CG1 4.07Å; F709-I907 HydrophobicContact CE1-CB 3.98Å; F709-I907 HydrophobicContact CE1-CG1 4.43Å; F709-I907 HydrophobicContact CG-CD1 4.26Å; F709-I907 HydrophobicContact CG-CG1 4.3Å; F709-I907 HydrophobicContact CZ-CB 4.45Å; F709-F910 AromaticContact CE2-CD2 3.76Å; F709-F910 HydrophobicContact CE2-CD2 3.76Å; F709-F910 AromaticContact CE2-CE2 3.72Å; F709-F910 HydrophobicContact CE2-CE2 3.72Å; F709-F910 HydrophobicContact CE2-CZ 4.44Å; F709-F910 HydrophobicContact CZ-CD2 4.26Å; F709-F910 HydrophobicContact CZ-CE2 4.17Å
710	Y	92.6	Very high	83.6	Confident	31 Å²	31	51.6 Å²	51.6	12%	0.122	27%	0.274	C	S	.	.	I	π-helix	trans	-65.4	-37.5	-179.2	-172.5	-89.6	0	0	0	112.6	L705 V706 K815 F819 V822 L823	L705-Y710 PolarHBondContact O-N 2.81Å; V706-Y710 WeakPolarHBondContact O-CA 3.48Å; V706-Y710 WeakPolarHBondContact O-CB 3.46Å; V706-Y710 PolarHBondContact O-N 3.1Å; V706-Y710 VanDerWaalsContact O-N 3.11Å; Y710-K815 HydrophobicContact CE2-CG 4.36Å; Y710-K815 WeakPolarHBondContact O-CE 3.31Å; Y710-K815 PolarHBondContact O-NZ 3.4Å; Y710-F819 HydrophobicContact CD2-CB 3.71Å; Y710-F819 HydrophobicContact CD2-CD1 4.14Å; Y710-F819 AromaticContact CD2-CD2 3.7Å; Y710-F819 HydrophobicContact CD2-CD2 3.7Å; Y710-F819 HydrophobicContact CD2-CE2 4.29Å; Y710-F819 AromaticContact CD2-CG 3.61Å; Y710-F819 HydrophobicContact CD2-CG 3.61Å; Y710-F819 HydrophobicContact CE2-CB 3.96Å; Y710-F819 HydrophobicContact CE2-CD2 4.27Å; Y710-F819 HydrophobicContact CE2-CG 4.27Å; Y710-V822 HydrophobicContact CD2-CG1 4.08Å; Y710-V822 HydrophobicContact CE2-CG1 4.4Å; Y710-L823 HydrophobicContact CD1-CD2 4.36Å; Y710-L823 HydrophobicContact CE1-CD1 3.82Å; Y710-L823 HydrophobicContact CE1-CD2 4.46Å; Y710-L823 HydrophobicContact CE1-CG 4.37Å
711	H	91.8	Very high	81.1	Confident	83 Å²	83	56.2 Å²	56.2	38%	0.384	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	20.5	175.3	-67.6	-73	0	0	0	113.8	V706 F709 E716	V706-H711 PolarHBondContact O-CD2 3.45Å; V706-H711 PolarHBondContact O-N 3.29Å; F709-H711 VanDerWaalsContact C-N 3.35Å; F709-H711 PolarHBondContact O-N 2.87Å; H711-E716 IonicContact ND1-OE1 3.36Å
712	A	89.6	Confident	78	Confident	4 Å²	4	59 Å²	59	3%	0.033	32%	0.315	C	S	.	.			trans	-66.8	129	168.5	0	0	0	0	0	109.5	F709 E714 F715 E716 L896	F709-A712 WeakPolarHBondContact O-CB 3.44Å; F709-A712 PolarHBondContact O-N 3.2Å; A712-E714 PolarHBondContact O-N 3.48Å; A712-E714 VanDerWaalsContact O-N 3.16Å; A712-F715 HydrophobicContact CB-CB 4.33Å; A712-F715 HydrophobicContact CB-CD2 4.42Å; A712-F715 HydrophobicContact CB-CG 4.37Å; A712-F715 CarbonylContact O-C 3.41Å; A712-F715 WeakPolarHBondContact O-CA 3.45Å; A712-F715 PolarHBondContact O-N 2.88Å; A712-E716 PolarHBondContact O-N 3.19Å; A712-E716 VanDerWaalsContact O-N 3.11Å; A712-L896 HydrophobicContact CB-CD1 3.72Å; A712-L896 HydrophobicContact CB-CD2 3.8Å; A712-L896 HydrophobicContact CB-CG 4.44Å
713	P	86.4	Confident	75	Confident	92 Å²	92	63.8 Å²	63.8	60%	0.597	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-54.1	-36.1	-179.9	-29.1	36.7	0	0	0	113.4	F715 E716	P713-F715 PolarHBondContact O-N 2.98Å; P713-E716 PolarHBondContact O-N 3.19Å; P713-E716 VanDerWaalsContact O-N 3.16Å
714	E	85.1	Confident	71.9	Confident	42 Å²	42	68.6 Å²	68.6	20%	0.196	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-60.2	-26.3	174.8	-67.9	74.9	-162.8	0	0	113.4	A712 R806 L809 A892	A712-E714 PolarHBondContact O-N 3.48Å; A712-E714 VanDerWaalsContact O-N 3.16Å; E714-R806 IonicContact OE1-NH1 3.15Å; E714-R806 PolarHBondContact OE1-NH1 3.18Å; E714-L809 HydrophobicContact CB-CD1 4.03Å; E714-L809 HydrophobicContact CG-CD1 4.47Å; E714-L809 VanDerWaalsContact O-CB 3.31Å; E714-L809 WeakPolarHBondContact O-CB 3.19Å; E714-L809 WeakPolarHBondContact O-CG 3.38Å; E714-L809 PolarHBondContact O-N 3.14Å; E714-A892 HydrophobicContact CB-CB 3.9Å; E714-A892 HydrophobicContact CG-CB 3.84Å
715	F	86.7	Confident	69.1	Low	0 Å²	0	75.6 Å²	75.6	0%	0	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-107.2	5.1	-179.5	-64.9	0.1	0	0	0	112.3	F709 A712 P713 L810 K815 F819 F889 A892 L893 L896 I907	F709-F715 VanDerWaalsContact O-CD2 3.26Å; F709-F715 WeakPolarHBondContact O-CD2 3.22Å; A712-F715 HydrophobicContact CB-CB 4.33Å; A712-F715 HydrophobicContact CB-CD2 4.42Å; A712-F715 HydrophobicContact CB-CG 4.37Å; A712-F715 CarbonylContact O-C 3.41Å; A712-F715 WeakPolarHBondContact O-CA 3.45Å; A712-F715 PolarHBondContact O-N 2.88Å; P713-F715 PolarHBondContact O-N 2.98Å; F715-L810 HydrophobicContact CB-CD1 3.76Å; F715-L810 HydrophobicContact CB-CG 4.45Å; F715-L810 HydrophobicContact CD1-CD1 4.07Å; F715-L810 HydrophobicContact CD1-CG 4.25Å; F715-L810 HydrophobicContact CD2-CD1 4.23Å; F715-L810 HydrophobicContact CG-CD1 3.76Å; F715-L810 HydrophobicContact CG-CG 4.4Å; F715-K815 VanDerWaalsContact O-CD 3.32Å; F715-K815 WeakPolarHBondContact O-CD 3.39Å; F715-K815 WeakPolarHBondContact O-CE 3.45Å; F715-K815 PolarHBondContact O-NZ 3.41Å; F715-F819 HydrophobicContact CD2-CE2 4.24Å; F715-F819 HydrophobicContact CD2-CZ 4.06Å; F715-F819 HydrophobicContact CE2-CZ 4.45Å; F715-F889 HydrophobicContact CD1-CD2 4.23Å; F715-F889 AromaticContact CD1-CE2 3.97Å; F715-F889 HydrophobicContact CD1-CE2 3.97Å; F715-F889 AromaticContact CE1-CD2 3.56Å; F715-F889 HydrophobicContact CE1-CD2 3.56Å; F715-F889 AromaticContact CE1-CE2 3.26Å; F715-F889 HydrophobicContact CE1-CE2 3.26Å; F715-F889 HydrophobicContact CE1-CZ 4.13Å; F715-F889 HydrophobicContact CE2-CE2 4.09Å; F715-F889 HydrophobicContact CE2-CZ 4.43Å; F715-F889 HydrophobicContact CZ-CD2 4.07Å; F715-F889 AromaticContact CZ-CE2 3.33Å; F715-F889 HydrophobicContact CZ-CE2 3.33Å; F715-F889 AromaticContact CZ-CZ 3.76Å; F715-F889 HydrophobicContact CZ-CZ 3.76Å; F715-A892 HydrophobicContact CE1-CB 4.43Å; F715-L893 HydrophobicContact CE2-CD1 4.43Å; F715-L893 HydrophobicContact CZ-CB 4.4Å; F715-L893 HydrophobicContact CZ-CD1 4.05Å; F715-L896 HydrophobicContact CD2-CD1 4.4Å; F715-L896 HydrophobicContact CE1-CD1 4.16Å; F715-L896 HydrophobicContact CE2-CD1 3.86Å; F715-L896 HydrophobicContact CZ-CD1 3.71Å; F715-I907 HydrophobicContact CE2-CD1 4.3Å
716	E	79.6	Confident	66	Low	91 Å²	91	78.7 Å²	78.7	43%	0.425	44%	0.442	S	S	.	.			trans	-74.1	144	169.5	-64.2	-156.2	128.7	0	0	110.5	H711 A712 P713 P808	H711-E716 IonicContact ND1-OE1 3.36Å; A712-E716 PolarHBondContact O-N 3.19Å; A712-E716 VanDerWaalsContact O-N 3.11Å; P713-E716 PolarHBondContact O-N 3.19Å; P713-E716 VanDerWaalsContact O-N 3.16Å; E716-P808 VanDerWaalsContact O-CB 3.29Å; E716-P808 WeakPolarHBondContact O-CB 3.25Å
717	C	72.5	Confident	62.9	Low	32 Å²	32	83 Å²	83	22%	0.216	47%	0.472	C	S	.	.			trans	-110.5	109.3	178.6	-57.8	0	0	0	0	106.7	L810 P812	C717-L810 PolarHBondContact SG-O 3.42Å; C717-P812 HydrophobicContact CB-CG 3.93Å
718	E	53.9	Low	60	Low	144 Å²	144	87.1 Å²	87.1	67%	0.673	49%	0.488	S	S	*	.			trans	-48.3	127.8	173.6	-77.7	-66.6	171.2	0	0	110.6	P808	E718-P808 HydrophobicContact CB-CG 3.93Å; E718-P808 HydrophobicContact CG-CG 3.7Å
719	P	49.5	Very low	57	Low	76 Å²	76	92 Å²	92	49%	0.494	51%	0.514	S	S	.	.			trans	-55.9	149.3	169	-22.8	33.9	0	0	0	110.3	H721	P719-H721 PolarHBondContact O-N 3.43Å
720	L	35.9	Very low	54.1	Low	187 Å²	187	99.4 Å²	99.4	98%	0.979	55%	0.552	S	S	*	*			trans	-73.4	67.1	175.4	-73.2	171.8	0	0	0	111.3
721	H	39.9	Very low	51	Low	170 Å²	170	104.2 Å²	104.2	79%	0.787	58%	0.579	S	S	*	*			trans	-78.8	122.5	166.6	-118.1	-89.4	0	0	0	109.3	P719 S723	P719-H721 PolarHBondContact O-N 3.43Å; H721-S723 PolarHBondContact O-N 3.23Å; H721-S723 VanDerWaalsContact O-N 3.09Å
722	S	29.1	Very low	48.3	Very low	99 Å²	99	109.7 Å²	109.7	69%	0.692	60%	0.602	S	S	*	*			trans	-66.2	107.1	176.7	52.7	0	0	0	0	110.4	V724	S722-V724 VanDerWaalsContact C-N 3.25Å; S722-V724 PolarHBondContact O-N 2.94Å
723	S	31	Very low	45.5	Very low	101 Å²	101	116.1 Å²	116.1	71%	0.706	64%	0.641	S	S	*	*			trans	-74.4	80.7	172.9	-167.3	0	0	0	0	110.7	H721 Q725	H721-S723 PolarHBondContact O-N 3.23Å; H721-S723 VanDerWaalsContact O-N 3.09Å; S723-Q725 VanDerWaalsContact C-N 3.29Å; S723-Q725 PolarHBondContact O-N 2.87Å
724	V	30.1	Very low	42.8	Very low	129 Å²	129	115.2 Å²	115.2	78%	0.782	65%	0.648	S	S	*	*			trans	-90.9	71.5	161.5	-174.8	0	0	0	0	107.3	S722 G726	S722-V724 VanDerWaalsContact C-N 3.25Å; S722-V724 PolarHBondContact O-N 2.94Å; V724-G726 PolarHBondContact O-N 3.1Å
725	Q	33	Very low	40.3	Very low	176 Å²	176	121.8 Å²	121.8	82%	0.822	68%	0.676	S	S	*	*			trans	-82.1	90.8	167.1	-80.1	-169	-34	0	0	109.3	S723 S727	S723-Q725 VanDerWaalsContact C-N 3.29Å; S723-Q725 PolarHBondContact O-N 2.87Å; Q725-S727 PolarHBondContact O-N 3.41Å
726	G	28.8	Very low	37.6	Very low	66 Å²	66	128.4 Å²	128.4	68%	0.68	71%	0.711	S	S	*	*			trans	-68	119	169.7	0	0	0	0	0	111.3	V724	V724-G726 PolarHBondContact O-N 3.1Å
727	S	29.6	Very low	35.1	Very low	98 Å²	98	129.8 Å²	129.8	69%	0.685	73%	0.73	S	S	*	*			trans	30.4	112.2	147.8	-55.1	0	0	0	0	119.3	Q725	Q725-S727 PolarHBondContact O-N 3.41Å
728	Q	32.2	Very low	33.1	Very low	191 Å²	191	138.7 Å²	138.7	89%	0.893	76%	0.761	S	S	*	*			trans	-97.8	119.9	134.6	-77.1	-159.3	1.6	0	0	109.4
729	I	27.8	Very low	31.6	Very low	121 Å²	121	136.9 Å²	136.9	62%	0.621	76%	0.764	S	S	*	*			trans	-95.7	120.7	176.1	-62	169.2	0	0	0	107.9	N731	I729-N731 WeakPolarHBondContact CG2-OD1 3.42Å
730	I	32	Very low	30.8	Very low	155 Å²	155	138.5 Å²	138.5	80%	0.795	77%	0.774	S	S	*	*			trans	-127.9	103.7	158.9	-59.9	-176.5	0	0	0	107.7
731	N	27.6	Very low	30.4	Very low	132 Å²	132	137.3 Å²	137.3	71%	0.706	76%	0.764	S	S	*	*			trans	-77.7	136.2	-178.8	-67	-40.7	0	0	0	111.4	I729	I729-N731 WeakPolarHBondContact CG2-OD1 3.42Å
732	K	34.1	Very low	29.8	Very low	198 Å²	198	134.6 Å²	134.6	86%	0.861	76%	0.755	S	S	*	*			trans	-152.1	73.9	155.8	-115.7	170.3	-173.1	179.1	0	112.9
733	T	30	Very low	29.6	Very low	138 Å²	138	139.5 Å²	139.5	85%	0.847	76%	0.76	S	S	*	*			trans	24.7	115.5	137.8	55.1	0	0	0	0	118.2
734	G	30.2	Very low	29.4	Very low	73 Å²	73	140.3 Å²	140.3	75%	0.753	76%	0.761	S	S	*	*			trans	-159.4	15.8	-174.6	0	0	0	0	0	121.4
735	K	32.2	Very low	29.3	Very low	181 Å²	181	141.1 Å²	141.1	79%	0.787	77%	0.766	S	S	*	*			trans	63.2	121	167.6	-67.9	-165.5	166.2	-165.8	0	118.1
736	D	30.4	Very low	29.1	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	76%	0.763	S	S	*	*				78.1	132.5	99.9	-51.6	-22.4	0	0	0	112.7
737	C	27.9	Very low	29.2	Very low	120 Å²	120	141.1 Å²	141.1	81%	0.811	77%	0.768	S	S	*	*			cis	-152	-171.6	9.4	-143.6	0	0	0	0	113.1
738	Y	29.1	Very low	29.2	Very low	220 Å²	220	143.1 Å²	143.1	86%	0.863	77%	0.766	S	S	*	*			trans	-86.9	167.5	-167.1	-83.7	-110.1	0	0	0	116.7
739	S	23.3	Very low	28.9	Very low	105 Å²	105	140.1 Å²	140.1	73%	0.734	76%	0.757	S	S	*	*			trans	-55.5	-179	160.2	-38.7	0	0	0	0	113.5
740	P	32.8	Very low	29.1	Very low	111 Å²	111	140.3 Å²	140.3	72%	0.721	76%	0.763	S	S	*	*			cis	-149.1	-173.5	13.4	46.3	-26.2	0	0	0	118.9
741	Q	27.4	Very low	29	Very low	162 Å²	162	139.4 Å²	139.4	76%	0.757	76%	0.759	S	S	*	*			trans	79.2	135	150.9	-78	-161.5	10.1	0	0	123
742	N	26.7	Very low	29.1	Very low	113 Å²	113	139.6 Å²	139.6	60%	0.604	76%	0.759	S	S	*	*			trans	75.3	113.6	139.7	-64.9	-8.2	0	0	0	123.1
743	Y	24.5	Very low	29	Very low	201 Å²	201	136 Å²	136	79%	0.788	76%	0.755	S	S	*	*			trans	56.7	125.7	135.4	-67.6	-74.1	0	0	0	122.8
744	T	27.3	Very low	29.1	Very low	119 Å²	119	135.6 Å²	135.6	73%	0.73	75%	0.747	S	S	*	*			trans	67.3	112.5	145.1	53.2	0	0	0	0	121
745	T	28.1	Very low	29.3	Very low	146 Å²	146	137.9 Å²	137.9	90%	0.896	74%	0.742	S	S	*	*				63.7	111	128.4	-46.8	0	0	0	0	119.4
746	G	29.6	Very low	29.4	Very low	73 Å²	73	137 Å²	137	75%	0.753	74%	0.741	S	S	*	*			trans	165.3	78.5	163.5	0	0	0	0	0	117.4
747	Q	30.4	Very low	29.4	Very low	169 Å²	169	136.1 Å²	136.1	79%	0.79	74%	0.74	S	S	*	*			trans	25.8	126	147.8	-77.2	174.4	-94.5	0	0	122.8
748	Q	29.2	Very low	29.6	Very low	139 Å²	139	137.5 Å²	137.5	65%	0.65	74%	0.739	S	S	*	*				84.6	107.2	129.2	-64.8	-171.6	-95.3	0	0	123.4
749	D	26.6	Very low	29.8	Very low	129 Å²	129	132.2 Å²	132.2	69%	0.69	73%	0.734	S	S	*	*				75.9	151.8	115.7	-55.4	-33.2	0	0	0	124.2
750	V	32	Very low	30.2	Very low	124 Å²	124	136 Å²	136	75%	0.752	74%	0.74	S	S	*	*			trans	98.7	83.2	154.4	-169.5	0	0	0	0	120.2
751	I	30	Very low	30.3	Very low	137 Å²	137	136.2 Å²	136.2	70%	0.703	74%	0.741	S	S	*	*				67.7	122.3	114.9	-67.5	166.9	0	0	0	122.2
752	N	28.2	Very low	30.6	Very low	135 Å²	135	133.3 Å²	133.3	72%	0.722	74%	0.739	S	S	*	*			trans	48.1	154.9	140.6	-53.7	-2.8	0	0	0	120.7
753	T	33.1	Very low	30.7	Very low	124 Å²	124	134.2 Å²	134.2	76%	0.761	75%	0.749	S	S	*	*			cis	-163	137.7	48	45.3	0	0	0	0	116
754	N	31.9	Very low	31.4	Very low	128 Å²	128	129.8 Å²	129.8	68%	0.684	74%	0.744	S	S	*	*				44.9	128	127.7	-71.3	50.8	0	0	0	125.1
755	D	33.6	Very low	31.5	Very low	121 Å²	121	131.3 Å²	131.3	65%	0.647	75%	0.747	S	S	*	*				127.8	148.3	99.9	-105.3	-40.8	0	0	0	122.4
756	Q	34.6	Very low	31.5	Very low	163 Å²	163	129.5 Å²	129.5	76%	0.762	74%	0.736	S	S	*	*			trans	71.4	151.5	149.2	-73.1	172.4	54	0	0	123.5
757	V	31.9	Very low	31.4	Very low	120 Å²	120	132.3 Å²	132.3	73%	0.727	73%	0.734	S	S	*	*			cis	-172.4	157.9	-34	105.9	0	0	0	0	114.5
758	L	31	Very low	31.5	Very low	149 Å²	149	130.6 Å²	130.6	78%	0.78	74%	0.735	S	S	*	*			trans	86	132.2	153.2	-121.8	69.8	0	0	0	127.5
759	S	32.8	Very low	31.6	Very low	108 Å²	108	130 Å²	130	76%	0.755	74%	0.74	S	S	*	*			trans	84.9	136.7	134.1	46.4	0	0	0	0	125.7
760	E	32.2	Very low	32.2	Very low	185 Å²	185	129 Å²	129	86%	0.864	74%	0.741	S	S	*	*			trans	-95.4	179.7	168.6	-45.1	174.2	118.4	0	0	111.8
761	P	35.7	Very low	32.3	Very low	115 Å²	115	131.4 Å²	131.4	75%	0.747	75%	0.748	S	S	*	*				-160	164.2	81.7	41.6	-20.2	0	0	0	120.4
762	S	32.3	Very low	32.2	Very low	102 Å²	102	127.9 Å²	127.9	71%	0.713	75%	0.745	S	S	*	*			trans	52.1	112.9	140.8	-59.4	0	0	0	0	126
763	T	30.7	Very low	32.8	Very low	132 Å²	132	127 Å²	127	81%	0.81	75%	0.747	S	S	*	*				34.9	169.2	116.5	60.3	0	0	0	0	123.7
764	P	37.9	Very low	32.9	Very low	107 Å²	107	127.5 Å²	127.5	70%	0.695	75%	0.75	S	S	*	*			cis	-141.1	-167.8	-47.9	40.7	-21.9	0	0	0	115.7
765	L	29	Very low	33	Very low	151 Å²	151	126.6 Å²	126.6	79%	0.791	75%	0.754	S	S	*	*			trans	99.7	125.6	141.9	-122.4	80.7	0	0	0	125.1
766	V	29.7	Very low	33	Very low	108 Å²	108	124.1 Å²	124.1	66%	0.655	75%	0.75	S	S	*	*				90.2	126.1	127.6	134.1	0	0	0	0	125.9
767	N	26.5	Very low	32.9	Very low	133 Å²	133	126.6 Å²	126.6	71%	0.711	75%	0.754	S	S	*	*			trans	40.8	147.7	145.3	-51.9	-8.9	0	0	0	122.8
768	T	32.4	Very low	32.8	Very low	133 Å²	133	125.3 Å²	125.3	82%	0.816	75%	0.75	S	S	*	*				-167.7	170.8	65.1	-58.7	0	0	0	0	114.4
769	V	31.6	Very low	32.8	Very low	126 Å²	126	123.7 Å²	123.7	76%	0.764	75%	0.747	S	S	*	*			trans	-98.5	-154	-156.4	-152.6	0	0	0	0	113.8
770	P	38.7	Very low	32.7	Very low	109 Å²	109	125.1 Å²	125.1	71%	0.708	75%	0.746	S	S	*	*				-114.8	-162.5	-120.1	44.8	-28	0	0	0	116
771	I	34.8	Very low	32.4	Very low	173 Å²	173	122.1 Å²	122.1	89%	0.887	74%	0.74	S	S	*	*			trans	-171.1	153.5	139.6	-98	150.3	0	0	0	112.2
772	G	28.1	Very low	32.2	Very low	63 Å²	63	122.7 Å²	122.7	65%	0.649	74%	0.741	S	S	*	*			trans	-109.2	-137.9	174.9	0	0	0	0	0	112.9
773	P	40.8	Very low	32.1	Very low	116 Å²	116	124.7 Å²	124.7	75%	0.753	74%	0.743	S	S	*	*			cis	-145.4	-162.3	-3.1	34.9	-9.5	0	0	0	115.9
774	T	35.1	Very low	31.9	Very low	136 Å²	136	125 Å²	125	83%	0.834	74%	0.739	S	S	*	*			trans	76.1	150.3	166.7	75.2	0	0	0	0	117.3
775	S	34.2	Very low	31.5	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	75%	0.748	S	S	*	*			cis	-169	159.6	-0	136.4	0	0	0	0	108.6
776	A	32.6	Very low	31.4	Very low	70 Å²	70	127.3 Å²	127.3	58%	0.579	75%	0.747	S	S	*	*			cis	-174.2	-177	-15.5	0	0	0	0	0	109.6
777	Y	32.4	Very low	31.6	Very low	215 Å²	215	128.2 Å²	128.2	84%	0.843	75%	0.752	S	S	*	*			trans	70.3	136	174.5	-47.6	-70.4	0	0	0	117.7
778	S	31.4	Very low	31.8	Very low	92 Å²	92	128.2 Å²	128.2	64%	0.643	75%	0.753	S	S	*	*			cis	-161.6	131.5	-10.6	-99.5	0	0	0	0	113.1
779	T	30.8	Very low	31.8	Very low	116 Å²	116	131.6 Å²	131.6	71%	0.712	76%	0.756	S	S	*	*			trans	42.9	148.8	139.4	63.9	0	0	0	0	123.3
780	N	28.9	Very low	31.7	Very low	138 Å²	138	131.3 Å²	131.3	74%	0.738	76%	0.755	S	S	*	*			cis	-172.8	130.1	-19.1	-98.7	-7.1	0	0	0	106.2
781	T	27.3	Very low	31.4	Very low	121 Å²	121	132.5 Å²	132.5	74%	0.742	76%	0.755	S	S	*	*				85.4	156.7	80	-48.6	0	0	0	0	114.8
782	V	30.6	Very low	31.3	Very low	127 Å²	127	133.1 Å²	133.1	77%	0.77	75%	0.752	S	S	*	*			trans	92.9	123	172.8	-177.5	0	0	0	0	115
783	I	31.1	Very low	31.6	Very low	144 Å²	144	134.9 Å²	134.9	74%	0.738	75%	0.753	S	S	*	*			cis	-149.4	152.5	-9.1	-117	172.1	0	0	0	109.3
784	N	25.9	Very low	30.9	Very low	138 Å²	138	134.4 Å²	134.4	74%	0.738	75%	0.753	S	S	*	*			trans	-96.2	156.8	173.3	-76.2	-5.9	0	0	0	112.5
785	N	30.2	Very low	30.7	Very low	166 Å²	166	135 Å²	135	89%	0.888	75%	0.751	S	S	*	*			trans	-139.2	131.4	152.3	-87.9	-37.4	0	0	0	108.9
786	N	26.6	Very low	30.6	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	76%	0.755	S	S	*	*			trans	-114.1	129.7	-179.3	-72.1	-4.6	0	0	0	110.8
787	T	34.2	Very low	30.3	Very low	127 Å²	127	142.5 Å²	142.5	78%	0.779	77%	0.772	S	S	*	*			trans	-159.6	148.9	156.5	46.6	0	0	0	0	108
788	D	31.1	Very low	30.1	Very low	134 Å²	134	138.9 Å²	138.9	72%	0.717	77%	0.767	S	S	*	*			cis	-154.1	145.3	-20.6	-90.5	-35.9	0	0	0	108.4
789	F	31.1	Very low	29.9	Very low	204 Å²	204	139.8 Å²	139.8	90%	0.895	77%	0.769	S	S	*	*			trans	152.8	100.2	142.6	-100.3	-82.2	0	0	0	112.7
790	T	28.9	Very low	29.8	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	77%	0.773	S	S	*	*			trans	-126.5	-178.6	161.7	58.5	0	0	0	0	109.9
791	D	33	Very low	29.7	Very low	134 Å²	134	142.7 Å²	142.7	72%	0.717	78%	0.78	S	S	*	*			trans	74.8	142.5	179.4	-40.8	-7.6	0	0	0	112.6
792	F	33.1	Very low	29.9	Very low	187 Å²	187	144.6 Å²	144.6	82%	0.82	78%	0.781	S	S	*	*	S	Bend	cis	-127.8	159	10.4	-93.4	-106	0	0	0	109.8
793	C	33.8	Very low	29.8	Very low	99 Å²	99	145 Å²	145	67%	0.669	78%	0.784	S	S	*	*			cis	-151.8	154.1	-6.8	-158.2	0	0	0	0	109.4
794	S	27.5	Very low	30	Very low	107 Å²	107	142.7 Å²	142.7	75%	0.748	78%	0.776	S	S	*	*			trans	-95.8	121.6	165.8	55	0	0	0	0	110.8
795	D	29.7	Very low	30.6	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	77%	0.773	S	S	*	*			trans	-163.1	94.5	164	-112	-28.2	0	0	0	112.1
796	L	32.5	Very low	31.8	Very low	162 Å²	162	142.3 Å²	142.3	85%	0.848	76%	0.764	S	S	*	*				168.3	106.2	128.6	-112.2	68.7	0	0	0	110.7	N798	L796-N798 PolarHBondContact O-N 3.35Å
797	N	27	Very low	33.4	Very low	173 Å²	173	142.8 Å²	142.8	93%	0.925	76%	0.762	S	S	*	*			trans	-86.7	94.2	161.5	-88.7	-33.5	0	0	0	109.4
798	N	27.7	Very low	35.1	Very low	139 Å²	139	139.2 Å²	139.2	74%	0.743	74%	0.741	S	S	*	*			trans	-162.3	140.1	146.1	-132.1	-13.3	0	0	0	115.9	L796	L796-N798 PolarHBondContact O-N 3.35Å
799	T	26.9	Very low	37.5	Very low	111 Å²	111	135.1 Å²	135.1	68%	0.681	72%	0.719	S	S	*	*			trans	57.4	134.1	156.9	48.3	0	0	0	0	121.8
800	N	29.5	Very low	40.1	Very low	148 Å²	148	125.5 Å²	125.5	79%	0.791	68%	0.677	S	S	*	*			trans	84.7	99.9	154.4	-58.7	-15.8	0	0	0	118.9	Q802	N800-Q802 PolarHBondContact O-N 3.28Å
801	N	26.4	Very low	42.9	Very low	167 Å²	167	126.2 Å²	126.2	89%	0.893	67%	0.67	S	S	*	*			trans	-59.8	117.9	165.6	-62.1	-29.3	0	0	0	111.4
802	Q	31.1	Very low	45.4	Very low	162 Å²	162	124.2 Å²	124.2	76%	0.757	66%	0.664	S	S	*	*			trans	-133.7	88.5	155.8	-75.1	-164.5	0.8	0	0	110.2	N800 T804	N800-Q802 PolarHBondContact O-N 3.28Å; Q802-T804 HydrophobicContact CB-CG2 4.42Å; Q802-T804 PolarHBondContact O-N 3.19Å
803	T	29.7	Very low	48	Very low	136 Å²	136	119.4 Å²	119.4	83%	0.834	65%	0.646	S	S	*	*			trans	-65.7	81	158.7	47.1	0	0	0	0	108.4	T805	T803-T805 PolarHBondContact O-N 2.82Å
804	T	34.6	Very low	50.7	Low	94 Å²	94	116.1 Å²	116.1	58%	0.577	62%	0.621	S	S	*	*			trans	-69.6	101.1	179.6	28.7	0	0	0	0	109.3	Q802 R806	Q802-T804 HydrophobicContact CB-CG2 4.42Å; Q802-T804 PolarHBondContact O-N 3.19Å; T804-R806 VanDerWaalsContact C-N 3.25Å; T804-R806 PolarHBondContact O-N 3.08Å
805	T	38.4	Very low	53.7	Low	111 Å²	111	112 Å²	112	68%	0.681	59%	0.59	S	S	*	*			trans	-65	83.2	173	51.6	0	0	0	0	109.7	T803 H807	T803-T805 PolarHBondContact O-N 2.82Å; T805-H807 PolarHBondContact O-N 3.43Å
806	R	55.9	Low	56.7	Low	185 Å²	185	107.7 Å²	107.7	70%	0.698	57%	0.565	S	S	*	*			trans	-65.6	104.9	179.2	-72	-172.4	176.9	-166.9	-0.2	109.4	E714 T804	E714-R806 IonicContact OE1-NH1 3.15Å; E714-R806 PolarHBondContact OE1-NH1 3.18Å; T804-R806 VanDerWaalsContact C-N 3.25Å; T804-R806 PolarHBondContact O-N 3.08Å
807	H	59.1	Low	59.4	Low	151 Å²	151	102.9 Å²	102.9	70%	0.699	54%	0.538	S	S	*	.			trans	-62	139.5	178	-61	-64.6	0	0	0	111.5	T805 L809	T805-H807 PolarHBondContact O-N 3.43Å; H807-L809 PolarHBondContact O-N 2.93Å
808	P	70.5	Confident	62.6	Low	53 Å²	53	94.7 Å²	94.7	34%	0.344	49%	0.494	S	S	.	.			trans	-47.8	121.8	173.4	-34.7	39	0	0	0	113.7	E716 E718 L810	E716-P808 VanDerWaalsContact O-CB 3.29Å; E716-P808 WeakPolarHBondContact O-CB 3.25Å; E718-P808 HydrophobicContact CB-CG 3.93Å; E718-P808 HydrophobicContact CG-CG 3.7Å; P808-L810 VanDerWaalsContact C-N 3.28Å
809	L	81.2	Confident	65.8	Low	47 Å²	47	88 Å²	88	25%	0.246	46%	0.458	C	S	.	.	S	Bend	trans	-78.7	-16.4	176.8	-54.7	-175.9	0	0	0	112.7	E714 H807 A892	E714-L809 HydrophobicContact CB-CD1 4.03Å; E714-L809 HydrophobicContact CG-CD1 4.47Å; E714-L809 VanDerWaalsContact O-CB 3.31Å; E714-L809 WeakPolarHBondContact O-CB 3.19Å; E714-L809 WeakPolarHBondContact O-CG 3.38Å; E714-L809 PolarHBondContact O-N 3.14Å; H807-L809 PolarHBondContact O-N 2.93Å; L809-A892 HydrophobicContact CD1-CB 3.48Å; L809-A892 VanDerWaalsContact CD1-CB 3.48Å
810	L	85.1	Confident	68.9	Low	3 Å²	3	83.2 Å²	83.2	2%	0.016	43%	0.429	C	S	.	.	S	Bend	trans	-117.2	137.1	178.1	-62.7	-174.9	0	0	0	111.2	F715 C717 P808 E814 K815 L818 L883 F889	F715-L810 HydrophobicContact CB-CD1 3.76Å; F715-L810 HydrophobicContact CB-CG 4.45Å; F715-L810 HydrophobicContact CD1-CD1 4.07Å; F715-L810 HydrophobicContact CD1-CG 4.25Å; F715-L810 HydrophobicContact CD2-CD1 4.23Å; F715-L810 HydrophobicContact CG-CD1 3.76Å; F715-L810 HydrophobicContact CG-CG 4.4Å; C717-L810 PolarHBondContact SG-O 3.42Å; P808-L810 VanDerWaalsContact C-N 3.28Å; L810-E814 HydrophobicContact CD2-CB 4.48Å; L810-K815 HydrophobicContact CB-CB 4.43Å; L810-K815 HydrophobicContact CD1-CB 4.22Å; L810-K815 HydrophobicContact CD1-CG 4.43Å; L810-L818 HydrophobicContact CD1-CD2 4.3Å; L810-L883 HydrophobicContact CD2-CD1 3.6Å; L810-L883 HydrophobicContact CD2-CD2 3.57Å; L810-L883 HydrophobicContact CD2-CG 4.21Å; L810-F889 HydrophobicContact CD1-CE2 4.41Å; L810-F889 HydrophobicContact CD2-CD2 3.72Å; L810-F889 HydrophobicContact CD2-CE2 3.71Å; L810-F889 HydrophobicContact CG-CD2 4.41Å; L810-F889 HydrophobicContact CG-CE2 4.33Å
811	K	87.5	Confident	72	Confident	134 Å²	134	77 Å²	77	58%	0.583	40%	0.396	S	S	*	.			trans	-76.3	152.9	163.7	-61.1	173.8	-177	174.7	0	109.7	L813 E814 K815	K811-L813 PolarHBondContact O-N 2.84Å; K811-L813 VanDerWaalsContact O-N 3.13Å; K811-E814 HydrophobicContact CB-CB 4.38Å; K811-E814 HydrophobicContact CB-CG 4.03Å; K811-E814 PolarHBondContact N-OE2 3.42Å; K811-E814 VanDerWaalsContact N-OE2 3.12Å; K811-E814 WeakPolarHBondContact O-CA 3.48Å; K811-E814 WeakPolarHBondContact O-CB 3.37Å; K811-E814 PolarHBondContact O-N 2.9Å; K811-K815 PolarHBondContact O-N 3.19Å
812	P	86.9	Confident	75.3	Confident	92 Å²	92	69.1 Å²	69.1	60%	0.597	35%	0.354	S	S	*	.	H	α-helix	trans	-51.5	-40.7	178.2	-28.8	34	0	0	0	113.9	C717 K815 H816	C717-P812 HydrophobicContact CB-CG 3.93Å; P812-K815 PolarHBondContact O-N 2.85Å; P812-H816 WeakPolarHBondContact O-CB 3.22Å; P812-H816 PolarHBondContact O-N 2.79Å
813	L	86.7	Confident	78.4	Confident	85 Å²	85	63.3 Å²	63.3	45%	0.445	33%	0.327	S	S	.	.	H	α-helix	trans	-66.7	-34.8	176.1	-173.8	64.2	0	0	0	112.8	K811 H816 H817	K811-L813 PolarHBondContact O-N 2.84Å; K811-L813 VanDerWaalsContact O-N 3.13Å; L813-H816 PolarHBondContact O-N 3.47Å; L813-H817 WeakPolarHBondContact CD1-NE2 3.31Å; L813-H817 WeakPolarHBondContact O-CB 3.4Å; L813-H817 PolarHBondContact O-N 3.11Å
814	E	90.2	Very high	81.5	Confident	31 Å²	31	59.4 Å²	59.4	15%	0.145	30%	0.301	C	S	.	.	H	α-helix	trans	-73.2	-39.4	177.9	-63.7	171.9	164.2	0	0	110.9	L810 K811 H817 L818 R886	L810-E814 HydrophobicContact CD2-CB 4.48Å; K811-E814 HydrophobicContact CB-CB 4.38Å; K811-E814 HydrophobicContact CB-CG 4.03Å; K811-E814 PolarHBondContact N-OE2 3.42Å; K811-E814 VanDerWaalsContact N-OE2 3.12Å; K811-E814 WeakPolarHBondContact O-CA 3.48Å; K811-E814 WeakPolarHBondContact O-CB 3.37Å; K811-E814 PolarHBondContact O-N 2.9Å; E814-H817 PolarHBondContact O-N 3.2Å; E814-L818 VanDerWaalsContact O-CB 3.3Å; E814-L818 WeakPolarHBondContact O-CB 3.48Å; E814-L818 PolarHBondContact O-N 2.96Å; E814-R886 IonicContact OE1-CZ 2.73Å; E814-R886 IonicContact OE1-NH1 3.38Å; E814-R886 PolarHBondContact OE1-NH1 2.88Å; E814-R886 IonicContact OE1-NH2 2.75Å; E814-R886 PolarHBondContact OE1-NH2 3.14Å; E814-R886 IonicContact OE2-CZ 2.63Å; E814-R886 IonicContact OE2-NH1 3.63Å; E814-R886 PolarHBondContact OE2-NH1 2.8Å; E814-R886 IonicContact OE2-NH2 3.22Å
815	K	91.7	Very high	84.4	Confident	21 Å²	21	55 Å²	55	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-61.5	-44.5	170.5	-169.6	174.8	-169.4	156.8	0	111.2	Y710 F715 L810 K811 P812 L818 F819	Y710-K815 HydrophobicContact CE2-CG 4.36Å; Y710-K815 WeakPolarHBondContact O-CE 3.31Å; Y710-K815 PolarHBondContact O-NZ 3.4Å; F715-K815 VanDerWaalsContact O-CD 3.32Å; F715-K815 WeakPolarHBondContact O-CD 3.39Å; F715-K815 WeakPolarHBondContact O-CE 3.45Å; F715-K815 PolarHBondContact O-NZ 3.41Å; L810-K815 HydrophobicContact CB-CB 4.43Å; L810-K815 HydrophobicContact CD1-CB 4.22Å; L810-K815 HydrophobicContact CD1-CG 4.43Å; K811-K815 PolarHBondContact O-N 3.19Å; P812-K815 PolarHBondContact O-N 2.85Å; K815-L818 PolarHBondContact O-N 2.72Å; K815-F819 HydrophobicContact CG-CD2 3.91Å; K815-F819 HydrophobicContact CG-CE2 4.29Å; K815-F819 WeakPolarHBondContact O-CD2 3.4Å; K815-F819 PolarHBondContact O-N 2.96Å
816	H	91.3	Very high	87.2	Confident	57 Å²	57	50.2 Å²	50.2	26%	0.264	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-42.2	174.8	179.2	-101.6	0	0	0	112.5	Q473 P812 L813 L818 S820	Q473-H816 PolarHBondContact NE2-CE1 3.17Å; P812-H816 WeakPolarHBondContact O-CB 3.22Å; P812-H816 PolarHBondContact O-N 2.79Å; L813-H816 PolarHBondContact O-N 3.47Å; H816-L818 VanDerWaalsContact C-N 3.34Å; H816-L818 PolarHBondContact O-N 3.09Å; H816-S820 WeakPolarHBondContact O-CA 3.14Å; H816-S820 PolarHBondContact O-N 3.16Å
817	H	91	Very high	89	Confident	61 Å²	61	45.8 Å²	45.8	28%	0.282	24%	0.235	S	C	.	.	H	α-helix	trans	-68.4	-30.9	176.1	-69.5	169.1	0	0	0	113.4	L813 E814 Q876 T879	L813-H817 WeakPolarHBondContact CD1-NE2 3.31Å; L813-H817 WeakPolarHBondContact O-CB 3.4Å; L813-H817 PolarHBondContact O-N 3.11Å; E814-H817 PolarHBondContact O-N 3.2Å; H817-Q876 VanDerWaalsContact O-CA 3.26Å; H817-Q876 WeakPolarHBondContact O-CA 3.49Å; H817-Q876 WeakPolarHBondContact O-CG 3.41Å; H817-T879 HydrophobicContact CB-CG2 3.99Å; H817-T879 WeakPolarHBondContact CB-OG1 3.26Å
818	L	93.2	Very high	90.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-76.2	-40.1	178.8	-179.1	59.5	0	0	0	113.1	L810 E814 K815 H816 Q876 T879 L880 L883 F889 I907 L911	L810-L818 HydrophobicContact CD1-CD2 4.3Å; E814-L818 VanDerWaalsContact O-CB 3.3Å; E814-L818 WeakPolarHBondContact O-CB 3.48Å; E814-L818 PolarHBondContact O-N 2.96Å; K815-L818 PolarHBondContact O-N 2.72Å; H816-L818 VanDerWaalsContact C-N 3.34Å; H816-L818 PolarHBondContact O-N 3.09Å; L818-Q876 WeakPolarHBondContact O-CG 3.42Å; L818-T879 HydrophobicContact CB-CG2 4.37Å; L818-L880 HydrophobicContact CD1-CB 3.72Å; L818-L880 HydrophobicContact CD1-CD1 4.12Å; L818-L880 HydrophobicContact CD1-CG 4.34Å; L818-L883 HydrophobicContact CD2-CD1 4.04Å; L818-F889 HydrophobicContact CD2-CZ 4.33Å; L818-I907 HydrophobicContact CD2-CD1 4.42Å; L818-L911 HydrophobicContact CD1-CD1 3.86Å; L818-L911 WeakPolarHBondContact O-CD2 3.17Å
819	F	94.3	Very high	92	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-112.9	-8.7	-172.4	-64.3	-75.7	0	0	0	114.8	L705 F709 Y710 F715 K815 N821 V822 I907 L911	L705-F819 HydrophobicContact CD1-CD1 4.15Å; L705-F819 HydrophobicContact CD1-CE1 3.82Å; F709-F819 HydrophobicContact CB-CE1 4.12Å; F709-F819 HydrophobicContact CB-CZ 4.12Å; Y710-F819 HydrophobicContact CD2-CB 3.71Å; Y710-F819 HydrophobicContact CD2-CD1 4.14Å; Y710-F819 AromaticContact CD2-CD2 3.7Å; Y710-F819 HydrophobicContact CD2-CD2 3.7Å; Y710-F819 HydrophobicContact CD2-CE2 4.29Å; Y710-F819 AromaticContact CD2-CG 3.61Å; Y710-F819 HydrophobicContact CD2-CG 3.61Å; Y710-F819 HydrophobicContact CE2-CB 3.96Å; Y710-F819 HydrophobicContact CE2-CD2 4.27Å; Y710-F819 HydrophobicContact CE2-CG 4.27Å; F715-F819 HydrophobicContact CD2-CE2 4.24Å; F715-F819 HydrophobicContact CD2-CZ 4.06Å; F715-F819 HydrophobicContact CE2-CZ 4.45Å; K815-F819 HydrophobicContact CG-CD2 3.91Å; K815-F819 HydrophobicContact CG-CE2 4.29Å; K815-F819 WeakPolarHBondContact O-CD2 3.4Å; K815-F819 PolarHBondContact O-N 2.96Å; F819-N821 PolarHBondContact O-N 2.82Å; F819-V822 HydrophobicContact CB-CG1 3.98Å; F819-V822 VanDerWaalsContact O-CB 3.31Å; F819-V822 WeakPolarHBondContact O-CB 3.26Å; F819-V822 PolarHBondContact O-N 3.28Å; F819-V822 VanDerWaalsContact O-N 3.1Å; F819-I907 HydrophobicContact CE1-CD1 4.11Å; F819-I907 HydrophobicContact CZ-CD1 4.07Å; F819-L911 HydrophobicContact CD1-CD2 4.08Å
820	S	93	Very high	92.8	Very high	9 Å²	9	35.6 Å²	35.6	6%	0.063	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-135.2	-176.7	-166.1	0	0	0	0	111.5	H816 N872	H816-S820 WeakPolarHBondContact O-CA 3.14Å; H816-S820 PolarHBondContact O-N 3.16Å; S820-N872 PolarHBondContact OG-ND2 3.3Å
821	N	94.4	Very high	93.3	Very high	18 Å²	18	39.3 Å²	39.3	10%	0.096	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	29.4	175.9	63.1	-47.9	0	0	0	113.6	F819 L823 L824 P865 T868 Y869	F819-N821 PolarHBondContact O-N 2.82Å; N821-L823 PolarHBondContact O-N 3.16Å; N821-L824 HydrophobicContact CB-CD1 4.31Å; N821-L824 HydrophobicContact CB-CG 4.43Å; N821-L824 WeakPolarHBondContact O-CB 3.27Å; N821-L824 PolarHBondContact O-N 3.23Å; N821-P865 PolarHBondContact ND2-O 3.27Å; N821-T868 HydrophobicContact CB-CG2 4.48Å; N821-Y869 WeakPolarHBondContact OD1-CA 3.34Å; N821-Y869 WeakPolarHBondContact OD1-CB 3.4Å; N821-Y869 PolarHBondContact OD1-N 3.5Å
822	V	95.2	Very high	93.7	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-46.4	-37.7	-174	65.2	0	0	0	0	114.5	L705 V706 Y710 F819 L824 V825 C826 Y869	L705-V822 HydrophobicContact CD2-CG2 3.8Å; L705-V822 HydrophobicContact CG-CG2 4.31Å; V706-V822 HydrophobicContact CG2-CG2 4.32Å; Y710-V822 HydrophobicContact CD2-CG1 4.08Å; Y710-V822 HydrophobicContact CE2-CG1 4.4Å; F819-V822 HydrophobicContact CB-CG1 3.98Å; F819-V822 VanDerWaalsContact O-CB 3.31Å; F819-V822 WeakPolarHBondContact O-CB 3.26Å; F819-V822 PolarHBondContact O-N 3.28Å; F819-V822 VanDerWaalsContact O-N 3.1Å; V822-L824 VanDerWaalsContact C-N 3.27Å; V822-L824 PolarHBondContact O-N 2.72Å; V822-V825 WeakPolarHBondContact O-CB 3.46Å; V822-V825 PolarHBondContact O-N 2.98Å; V822-C826 PolarHBondContact O-N 3.19Å; V822-Y869 HydrophobicContact CB-CD2 4.47Å; V822-Y869 HydrophobicContact CB-CE2 4.02Å; V822-Y869 HydrophobicContact CG2-CE2 4.38Å
823	L	95.8	Very high	94.2	Very high	40 Å²	40	28.7 Å²	28.7	21%	0.209	15%	0.145	C	C	.	.	H	α-helix	trans	-63.8	-28.3	179.3	-56	179.4	0	0	0	113.3	R563 V706 Y710 N821 L827	R563-L823 HydrophobicContact CG-CD1 4.14Å; V706-L823 HydrophobicContact CB-CD2 4.27Å; V706-L823 HydrophobicContact CG1-CD2 3.5Å; V706-L823 HydrophobicContact CG2-CD2 3.71Å; Y710-L823 HydrophobicContact CD1-CD2 4.36Å; Y710-L823 HydrophobicContact CE1-CD1 3.82Å; Y710-L823 HydrophobicContact CE1-CD2 4.46Å; Y710-L823 HydrophobicContact CE1-CG 4.37Å; N821-L823 PolarHBondContact O-N 3.16Å; L823-L827 PolarHBondContact O-N 3.3Å
824	L	95.7	Very high	94.6	Very high	55 Å²	55	30.1 Å²	30.1	29%	0.288	15%	0.145	S	C	.	.	H	α-helix	trans	-74.9	-34.5	172.2	-59.1	-172.8	0	0	0	111.9	N821 V822 C826 L827 A828 P865	N821-L824 HydrophobicContact CB-CD1 4.31Å; N821-L824 HydrophobicContact CB-CG 4.43Å; N821-L824 WeakPolarHBondContact O-CB 3.27Å; N821-L824 PolarHBondContact O-N 3.23Å; V822-L824 VanDerWaalsContact C-N 3.27Å; V822-L824 PolarHBondContact O-N 2.72Å; L824-C826 VanDerWaalsContact C-N 3.32Å; L824-L827 PolarHBondContact O-N 2.95Å; L824-A828 WeakPolarHBondContact O-CB 3.23Å; L824-A828 PolarHBondContact O-N 3.27Å; L824-P865 HydrophobicContact CB-CB 3.8Å; L824-P865 HydrophobicContact CB-CG 4.09Å
825	V	96.3	Very high	94.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.1	-38.2	174.6	-174.9	0	0	0	0	110.1	Y698 L702 V822 A828 S829 P865 Y866 Y869 P914	Y698-V825 WeakPolarHBondContact OH-CG1 3.32Å; L702-V825 HydrophobicContact CD1-CG1 4.32Å; V822-V825 WeakPolarHBondContact O-CB 3.46Å; V822-V825 PolarHBondContact O-N 2.98Å; V825-A828 PolarHBondContact O-N 3.4Å; V825-S829 WeakPolarHBondContact O-CB 3.2Å; V825-S829 PolarHBondContact O-N 3.43Å; V825-P865 HydrophobicContact CG2-CB 4.35Å; V825-Y866 HydrophobicContact CG1-CD1 4.06Å; V825-Y866 HydrophobicContact CG1-CD2 4.24Å; V825-Y866 HydrophobicContact CG1-CE1 3.72Å; V825-Y866 HydrophobicContact CG1-CE2 3.93Å; V825-Y866 HydrophobicContact CG1-CG 4.31Å; V825-Y869 HydrophobicContact CG2-CD2 4.13Å; V825-Y869 HydrophobicContact CG2-CG 4.17Å; V825-P914 HydrophobicContact CG1-CB 4.22Å; V825-P914 HydrophobicContact CG1-CG 4.1Å
826	C	95.8	Very high	95.1	Very high	12 Å²	12	29.7 Å²	29.7	8%	0.081	14%	0.144	C	C	.	.	H	α-helix	trans	-62	-49.8	172.4	-158	0	0	0	0	111.8	L702 V706 V822 L824 A828 S829 E830	L702-C826 HydrophobicContact CD1-CB 4.36Å; V706-C826 HydrophobicContact CG2-CB 4.5Å; V822-C826 PolarHBondContact O-N 3.19Å; L824-C826 VanDerWaalsContact C-N 3.32Å; C826-A828 VanDerWaalsContact C-N 3.34Å; C826-A828 PolarHBondContact O-N 2.8Å; C826-S829 WeakPolarHBondContact O-CB 3.19Å; C826-S829 PolarHBondContact O-N 2.92Å; C826-E830 PolarHBondContact O-N 3.17Å
827	L	95.2	Very high	95.2	Very high	91 Å²	91	27.5 Å²	27.5	48%	0.476	13%	0.134	S	C	.	.	H	α-helix	trans	-59.3	-42.3	176.2	-169.3	78.9	0	0	0	112.4	L823 L824 E830 M831	L823-L827 PolarHBondContact O-N 3.3Å; L824-L827 PolarHBondContact O-N 2.95Å; L827-E830 PolarHBondContact O-N 2.87Å; L827-M831 HydrophobicContact CG-SD 4.36Å; L827-M831 WeakPolarHBondContact O-CG 3.31Å; L827-M831 PolarHBondContact O-N 2.81Å
828	A	96.1	Very high	95.3	Very high	4 Å²	4	27.1 Å²	27.1	3%	0.033	14%	0.142	C	C	.	.	H	α-helix	trans	-63.2	-42.6	177	0	0	0	0	0	112.6	L824 V825 C826 F832 N862 Y866	L824-A828 WeakPolarHBondContact O-CB 3.23Å; L824-A828 PolarHBondContact O-N 3.27Å; V825-A828 PolarHBondContact O-N 3.4Å; C826-A828 VanDerWaalsContact C-N 3.34Å; C826-A828 PolarHBondContact O-N 2.8Å; A828-F832 WeakPolarHBondContact O-CB 3.41Å; A828-F832 PolarHBondContact O-N 3.02Å; A828-N862 WeakPolarHBondContact CB-O 3.43Å; A828-Y866 HydrophobicContact CB-CE2 4.06Å
829	S	96.5	Very high	95.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-44.9	173.6	180	0	0	0	0	111.3	E695 Y698 Y699 V825 C826 F832 L833	E695-S829 WeakPolarHBondContact OE1-CA 3.39Å; E695-S829 WeakPolarHBondContact OE1-CB 3.49Å; E695-S829 PolarHBondContact OE1-OG 3.31Å; Y698-S829 WeakPolarHBondContact CD1-OG 3.38Å; Y698-S829 WeakPolarHBondContact CE1-OG 3.34Å; Y699-S829 WeakPolarHBondContact CB-OG 3.18Å; V825-S829 WeakPolarHBondContact O-CB 3.2Å; V825-S829 PolarHBondContact O-N 3.43Å; C826-S829 WeakPolarHBondContact O-CB 3.19Å; C826-S829 PolarHBondContact O-N 2.92Å; S829-F832 PolarHBondContact O-N 2.84Å; S829-L833 WeakPolarHBondContact O-CB 3.26Å; S829-L833 PolarHBondContact O-N 2.81Å
830	E	96	Very high	95.1	Very high	33 Å²	33	29.5 Å²	29.5	15%	0.154	15%	0.151	C	C	.	.	H	α-helix	trans	-60.7	-47.6	176.3	-166.1	-177	-164.7	0	0	112.2	Y699 C826 L827 F832 L833 R834	Y699-E830 HydrophobicContact CD2-CB 4.28Å; Y699-E830 HydrophobicContact CE1-CG 4.22Å; Y699-E830 HydrophobicContact CE2-CB 3.58Å; Y699-E830 HydrophobicContact CE2-CG 4.06Å; Y699-E830 WeakPolarHBondContact OH-CG 3.49Å; Y699-E830 PolarHBondContact OH-OE1 3.37Å; C826-E830 PolarHBondContact O-N 3.17Å; L827-E830 PolarHBondContact O-N 2.87Å; E830-F832 VanDerWaalsContact C-N 3.32Å; E830-F832 PolarHBondContact O-N 3.31Å; E830-L833 PolarHBondContact O-N 2.83Å; E830-R834 HydrophobicContact CG-CG 4.49Å; E830-R834 WeakPolarHBondContact O-CB 3.33Å; E830-R834 VanDerWaalsContact O-CG 3.27Å; E830-R834 WeakPolarHBondContact O-CG 3.46Å; E830-R834 PolarHBondContact O-N 3.24Å; E830-R834 IonicContact OE1-CZ 2.82Å; E830-R834 IonicContact OE1-NE 2.64Å; E830-R834 PolarHBondContact OE1-NE 3.34Å; E830-R834 IonicContact OE1-NH2 2.96Å; E830-R834 PolarHBondContact OE1-NH2 2.93Å; E830-R834 IonicContact OE2-NH2 2.77Å
831	M	95.9	Very high	95	Very high	81 Å²	81	33 Å²	33	40%	0.399	17%	0.166	S	C	.	.	H	α-helix	trans	-62.9	-37.5	178.9	-72.9	177.9	64.1	0	0	112.4	L827 D835	L827-M831 HydrophobicContact CG-SD 4.36Å; L827-M831 WeakPolarHBondContact O-CG 3.31Å; L827-M831 PolarHBondContact O-N 2.81Å; M831-D835 PolarHBondContact O-N 3.16Å
832	F	97.5	Very high	94.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-72.7	-40	176.6	179.9	-129.8	0	0	0	112	V691 E695 A828 S829 E830 D835 L836 L853 I854 H857 F863 L921	V691-F832 HydrophobicContact CG1-CZ 4.46Å; E695-F832 HydrophobicContact CG-CD1 3.99Å; E695-F832 HydrophobicContact CG-CE1 4.44Å; E695-F832 WeakPolarHBondContact OE2-CD1 3.5Å; A828-F832 WeakPolarHBondContact O-CB 3.41Å; A828-F832 PolarHBondContact O-N 3.02Å; S829-F832 PolarHBondContact O-N 2.84Å; E830-F832 VanDerWaalsContact C-N 3.32Å; E830-F832 PolarHBondContact O-N 3.31Å; F832-D835 PolarHBondContact O-N 2.92Å; F832-L836 HydrophobicContact CD1-CD1 4.08Å; F832-L836 HydrophobicContact CD2-CD1 4.3Å; F832-L836 HydrophobicContact CD2-CG 4.28Å; F832-L836 HydrophobicContact CE1-CD1 3.7Å; F832-L836 HydrophobicContact CE2-CD1 3.94Å; F832-L836 HydrophobicContact CE2-CD2 4.15Å; F832-L836 HydrophobicContact CE2-CG 3.95Å; F832-L836 HydrophobicContact CG-CD1 4.36Å; F832-L836 HydrophobicContact CZ-CD1 3.62Å; F832-L836 HydrophobicContact CZ-CD2 4.24Å; F832-L836 HydrophobicContact CZ-CG 4.11Å; F832-L836 WeakPolarHBondContact O-CG 3.14Å; F832-L836 PolarHBondContact O-N 2.74Å; F832-L853 HydrophobicContact CE2-CB 4.21Å; F832-I854 HydrophobicContact CE2-CG1 4.12Å; F832-I854 HydrophobicContact CZ-CG1 3.73Å; F832-H857 VanDerWaalsContact CA-CE1 3.48Å; F832-H857 WeakPolarHBondContact CA-CE1 3.42Å; F832-H857 HydrophobicContact CD2-CB 4.17Å; F832-H857 AromaticContact CD2-CD2 3.67Å; F832-H857 AromaticContact CD2-CG 3.79Å; F832-F863 HydrophobicContact CB-CE1 4.11Å; F832-F863 HydrophobicContact CB-CZ 4.37Å; F832-F863 HydrophobicContact CD1-CE1 4.29Å; F832-F863 AromaticContact CD1-CZ 3.8Å; F832-F863 HydrophobicContact CD1-CZ 3.8Å; F832-F863 HydrophobicContact CD2-CZ 4.34Å; F832-F863 HydrophobicContact CE1-CZ 4.14Å; F832-F863 HydrophobicContact CG-CE1 4.17Å; F832-F863 AromaticContact CG-CZ 3.92Å; F832-F863 HydrophobicContact CG-CZ 3.92Å; F832-L921 HydrophobicContact CE1-CD2 4.17Å; F832-L921 HydrophobicContact CZ-CD2 4.43Å
833	L	96.5	Very high	94.3	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-48.4	174.4	-177.7	57.7	0	0	0	111.6	E695 A696 Y699 S829 E830 D835 L836 E837	E695-L833 HydrophobicContact CB-CD1 4.12Å; E695-L833 HydrophobicContact CG-CB 3.82Å; E695-L833 HydrophobicContact CG-CD1 3.99Å; E695-L833 HydrophobicContact CG-CG 4.42Å; A696-L833 HydrophobicContact CB-CD1 3.99Å; A696-L833 HydrophobicContact CB-CD2 4.36Å; Y699-L833 HydrophobicContact CD1-CD2 3.7Å; Y699-L833 HydrophobicContact CG-CD2 4.12Å; S829-L833 WeakPolarHBondContact O-CB 3.26Å; S829-L833 PolarHBondContact O-N 2.81Å; E830-L833 PolarHBondContact O-N 2.83Å; L833-D835 VanDerWaalsContact C-N 3.31Å; L833-D835 PolarHBondContact O-N 3.48Å; L833-L836 WeakPolarHBondContact O-CB 3.32Å; L833-L836 PolarHBondContact O-N 2.93Å; L833-L836 VanDerWaalsContact O-N 3.11Å; L833-E837 HydrophobicContact CD1-CG 3.95Å; L833-E837 HydrophobicContact CG-CG 4.22Å; L833-E837 WeakPolarHBondContact O-CB 3.32Å; L833-E837 WeakPolarHBondContact O-CG 3.41Å; L833-E837 PolarHBondContact O-N 2.69Å
834	R	95.5	Very high	93.6	Very high	115 Å²	115	43.3 Å²	43.3	43%	0.434	22%	0.218	S	C	.	.	H	α-helix	trans	-57.3	-42.1	178	-71.8	173.1	-177.2	-162.6	7.6	112.2	E830 A838	E830-R834 HydrophobicContact CG-CG 4.49Å; E830-R834 WeakPolarHBondContact O-CB 3.33Å; E830-R834 VanDerWaalsContact O-CG 3.27Å; E830-R834 WeakPolarHBondContact O-CG 3.46Å; E830-R834 PolarHBondContact O-N 3.24Å; E830-R834 IonicContact OE1-CZ 2.82Å; E830-R834 IonicContact OE1-NE 2.64Å; E830-R834 PolarHBondContact OE1-NE 3.34Å; E830-R834 IonicContact OE1-NH2 2.96Å; E830-R834 PolarHBondContact OE1-NH2 2.93Å; E830-R834 IonicContact OE2-NH2 2.77Å; R834-A838 VanDerWaalsContact O-CB 3.29Å; R834-A838 WeakPolarHBondContact O-CB 3.29Å; R834-A838 PolarHBondContact O-N 3.43Å
835	D	96.1	Very high	93	Very high	43 Å²	43	42.1 Å²	42.1	23%	0.23	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-41	175.6	-99.1	-1.3	0	0	0	112.4	M831 F832 L833 R839 L853 K856 H857	M831-D835 PolarHBondContact O-N 3.16Å; F832-D835 PolarHBondContact O-N 2.92Å; L833-D835 VanDerWaalsContact C-N 3.31Å; L833-D835 PolarHBondContact O-N 3.48Å; D835-R839 WeakPolarHBondContact O-CB 3.43Å; D835-R839 PolarHBondContact O-N 2.96Å; D835-L853 HydrophobicContact CB-CD1 4.29Å; D835-L853 HydrophobicContact CB-CD2 4.09Å; D835-L853 WeakPolarHBondContact O-CD1 3.34Å; D835-K856 IonicContact OD1-NZ 2.58Å; D835-K856 PolarHBondContact OD1-NZ 2.88Å; D835-K856 WeakPolarHBondContact OD2-CE 3.46Å; D835-K856 IonicContact OD2-NZ 3.96Å; D835-K856 PolarHBondContact OD2-NZ 3.5Å; D835-H857 IonicContact OD2-CD2 3.6Å; D835-H857 IonicContact OD2-CE1 2.62Å; D835-H857 IonicContact OD2-NE2 2.96Å; D835-H857 PolarHBondContact OD2-NE2 3.41Å
836	L	95.4	Very high	92.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-67.7	-44.9	176.7	-73.7	170.9	0	0	0	112	V691 I692 E695 F832 L833 R839 W840 V850 L853	V691-L836 HydrophobicContact CG1-CD1 4.31Å; V691-L836 HydrophobicContact CG1-CD2 4.49Å; I692-L836 HydrophobicContact CG1-CB 4.19Å; I692-L836 HydrophobicContact CG1-CD2 4.28Å; I692-L836 HydrophobicContact CG2-CB 4.34Å; E695-L836 HydrophobicContact CB-CD1 4.05Å; E695-L836 HydrophobicContact CG-CD1 4.26Å; F832-L836 HydrophobicContact CD1-CD1 4.08Å; F832-L836 HydrophobicContact CD2-CD1 4.3Å; F832-L836 HydrophobicContact CD2-CG 4.28Å; F832-L836 HydrophobicContact CE1-CD1 3.7Å; F832-L836 HydrophobicContact CE2-CD1 3.94Å; F832-L836 HydrophobicContact CE2-CD2 4.15Å; F832-L836 HydrophobicContact CE2-CG 3.95Å; F832-L836 HydrophobicContact CG-CD1 4.36Å; F832-L836 HydrophobicContact CZ-CD1 3.62Å; F832-L836 HydrophobicContact CZ-CD2 4.24Å; F832-L836 HydrophobicContact CZ-CG 4.11Å; F832-L836 WeakPolarHBondContact O-CG 3.14Å; F832-L836 PolarHBondContact O-N 2.74Å; L833-L836 WeakPolarHBondContact O-CB 3.32Å; L833-L836 PolarHBondContact O-N 2.93Å; L833-L836 VanDerWaalsContact O-N 3.11Å; L836-R839 PolarHBondContact O-N 2.93Å; L836-W840 PolarHBondContact O-N 2.76Å; L836-V850 HydrophobicContact CD2-CB 4.13Å; L836-V850 HydrophobicContact CD2-CG1 4.29Å; L836-L853 HydrophobicContact CD2-CD1 3.95Å; L836-L853 HydrophobicContact CG-CD1 4.44Å
837	E	93.1	Very high	92.3	Very high	11 Å²	11	43.2 Å²	43.2	5%	0.051	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-46.9	177.1	-72.1	-177.7	163.4	0	0	110.7	F650 L833 R839 W840 E841	F650-E837 HydrophobicContact CE2-CG 3.94Å; F650-E837 WeakPolarHBondContact CE2-OE1 3.41Å; F650-E837 HydrophobicContact CZ-CG 4.01Å; L833-E837 HydrophobicContact CD1-CG 3.95Å; L833-E837 HydrophobicContact CG-CG 4.22Å; L833-E837 WeakPolarHBondContact O-CB 3.32Å; L833-E837 WeakPolarHBondContact O-CG 3.41Å; L833-E837 PolarHBondContact O-N 2.69Å; E837-R839 VanDerWaalsContact C-N 3.3Å; E837-R839 PolarHBondContact O-N 3.32Å; E837-W840 PolarHBondContact O-N 3.01Å; E837-W840 VanDerWaalsContact O-N 3.11Å; E837-E841 WeakPolarHBondContact O-CG 3.26Å; E837-E841 PolarHBondContact O-N 3.29Å
838	A	93.9	Very high	92	Very high	53 Å²	53	41.2 Å²	41.2	44%	0.438	21%	0.208	S	C	.	.	H	α-helix	trans	-61.9	-36	175.6	0	0	0	0	0	112.7	R834 W840 S842	R834-A838 VanDerWaalsContact O-CB 3.29Å; R834-A838 WeakPolarHBondContact O-CB 3.29Å; R834-A838 PolarHBondContact O-N 3.43Å; A838-W840 VanDerWaalsContact C-N 3.33Å; A838-S842 VanDerWaalsContact O-CB 3.31Å; A838-S842 WeakPolarHBondContact O-CB 3.38Å; A838-S842 PolarHBondContact O-N 2.88Å; A838-S842 VanDerWaalsContact O-N 3.1Å; A838-S842 PolarHBondContact O-OG 3.37Å
839	R	93.8	Very high	91.8	Very high	49 Å²	49	41.9 Å²	41.9	19%	0.185	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-33.2	174.5	-174.8	61.4	64.7	104.9	9.7	112.7	D835 L836 E837 S842 D852 L853	D835-R839 WeakPolarHBondContact O-CB 3.43Å; D835-R839 PolarHBondContact O-N 2.96Å; L836-R839 PolarHBondContact O-N 2.93Å; E837-R839 VanDerWaalsContact C-N 3.3Å; E837-R839 PolarHBondContact O-N 3.32Å; R839-S842 PolarHBondContact O-OG 3.49Å; R839-D852 IonicContact CZ-OD1 2.95Å; R839-D852 IonicContact CZ-OD2 2.69Å; R839-D852 IonicContact NH1-OD1 2.64Å; R839-D852 PolarHBondContact NH1-OD1 2.74Å; R839-D852 IonicContact NH1-OD2 3.31Å; R839-D852 PolarHBondContact NH1-OD2 2.84Å; R839-D852 IonicContact NH2-OD1 2.75Å; R839-D852 IonicContact NH2-OD2 3.84Å; R839-D852 PolarHBondContact NH2-OD2 3.37Å; R839-L853 HydrophobicContact CB-CD1 3.82Å; R839-L853 HydrophobicContact CG-CD1 4.15Å
840	W	90	Very high	91.7	Very high	2 Å²	2	41.9 Å²	41.9	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-78.7	-48.2	176.8	179.6	67	0	0	0	112	R649 F650 M665 F689 I692 L836 E837 A838 S842 R843 M844 L847	R649-W840 HydrophobicContact CG-CH2 4.09Å; R649-W840 HydrophobicContact CG-CZ3 4.28Å; F650-W840 HydrophobicContact CD1-CH2 4.47Å; F650-W840 HydrophobicContact CD1-CZ3 4.29Å; F650-W840 HydrophobicContact CE1-CD2 4Å; F650-W840 AromaticContact CE1-CE3 3.45Å; F650-W840 HydrophobicContact CE1-CE3 3.45Å; F650-W840 VanDerWaalsContact CE1-CE3 3.45Å; F650-W840 AromaticContact CE1-CH2 3.85Å; F650-W840 HydrophobicContact CE1-CH2 3.85Å; F650-W840 HydrophobicContact CE1-CZ2 4.37Å; F650-W840 AromaticContact CE1-CZ3 3.34Å; F650-W840 HydrophobicContact CE1-CZ3 3.34Å; F650-W840 HydrophobicContact CE2-CZ3 4.41Å; F650-W840 HydrophobicContact CZ-CD2 4.33Å; F650-W840 AromaticContact CZ-CE3 3.43Å; F650-W840 HydrophobicContact CZ-CE3 3.43Å; F650-W840 VanDerWaalsContact CZ-CE3 3.43Å; F650-W840 HydrophobicContact CZ-CH2 4.35Å; F650-W840 AromaticContact CZ-CZ3 3.43Å; F650-W840 HydrophobicContact CZ-CZ3 3.43Å; F650-W840 VanDerWaalsContact CZ-CZ3 3.43Å; M665-W840 HydrophobicContact CE-CH2 3.75Å; M665-W840 HydrophobicContact CE-CZ2 3.5Å; M665-W840 VanDerWaalsContact CE-CZ2 3.5Å; M665-W840 HydrophobicContact SD-CZ2 4.01Å; F689-W840 HydrophobicContact CE2-CZ2 4.26Å; I692-W840 HydrophobicContact CD1-CB 3.87Å; I692-W840 HydrophobicContact CD1-CG 4.31Å; L836-W840 PolarHBondContact O-N 2.76Å; E837-W840 PolarHBondContact O-N 3.01Å; E837-W840 VanDerWaalsContact O-N 3.11Å; A838-W840 VanDerWaalsContact C-N 3.33Å; W840-S842 PolarHBondContact O-N 2.93Å; W840-R843 CarbonylContact O-C 3.6Å; W840-R843 PolarHBondContact O-N 2.87Å; W840-M844 HydrophobicContact CH2-SD 4.38Å; W840-M844 HydrophobicContact CZ2-CG 4.42Å; W840-M844 HydrophobicContact CZ2-SD 4.07Å; W840-M844 PolarHBondContact O-N 3.44Å; W840-L847 HydrophobicContact CB-CD2 4.11Å; W840-L847 HydrophobicContact CG-CD2 4.5Å
841	E	89.7	Confident	91.8	Very high	82 Å²	82	40.4 Å²	40.4	38%	0.383	20%	0.204	S	C	.	.	H	α-helix	trans	-56.2	-34	175.2	-71.1	-169.9	144.8	0	0	112	K646 R649 E837	K646-E841 IonicContact NZ-OE1 3.48Å; K646-E841 PolarHBondContact NZ-OE1 3.5Å; K646-E841 IonicContact NZ-OE2 2.8Å; K646-E841 PolarHBondContact NZ-OE2 3.41Å; R649-E841 IonicContact NH1-OE1 3.23Å; R649-E841 PolarHBondContact NH1-OE1 3.01Å; E837-E841 WeakPolarHBondContact O-CG 3.26Å; E837-E841 PolarHBondContact O-N 3.29Å
842	S	90	Very high	91.8	Very high	84 Å²	84	38.4 Å²	38.4	59%	0.587	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-6.3	177.4	58.7	0	0	0	0	116	A838 R839 W840	A838-S842 VanDerWaalsContact O-CB 3.31Å; A838-S842 WeakPolarHBondContact O-CB 3.38Å; A838-S842 PolarHBondContact O-N 2.88Å; A838-S842 VanDerWaalsContact O-N 3.1Å; A838-S842 PolarHBondContact O-OG 3.37Å; R839-S842 PolarHBondContact O-OG 3.49Å; W840-S842 PolarHBondContact O-N 2.93Å
843	R	85.6	Confident	91.7	Very high	107 Å²	107	38.7 Å²	38.7	40%	0.404	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.6	5.1	-176.8	-61.7	-168.8	177.2	-168.6	-2.4	115.2	W840 I846	W840-R843 CarbonylContact O-C 3.6Å; W840-R843 PolarHBondContact O-N 2.87Å; R843-I846 CarbonylContact O-C 3.47Å; R843-I846 PolarHBondContact O-N 3.08Å
844	M	80.7	Confident	91.8	Very high	84 Å²	84	38.6 Å²	38.6	41%	0.414	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	133.3	175.6	-169.2	179.7	76.4	0	0	110.6	E667 W840	E667-M844 HydrophobicContact CB-CE 3.92Å; E667-M844 HydrophobicContact CB-CG 4.23Å; E667-M844 HydrophobicContact CB-SD 3.73Å; E667-M844 HydrophobicContact CG-CE 3.79Å; E667-M844 HydrophobicContact CG-SD 3.67Å; W840-M844 HydrophobicContact CH2-SD 4.38Å; W840-M844 HydrophobicContact CZ2-CG 4.42Å; W840-M844 HydrophobicContact CZ2-SD 4.07Å; W840-M844 PolarHBondContact O-N 3.44Å
845	P	82.9	Confident	91.8	Very high	31 Å²	31	34.8 Å²	34.8	20%	0.201	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	cis	-90.7	-12.1	7.4	32.4	-31.6	0	0	0	115.8	W662 V668	W662-P845 WeakPolarHBondContact CZ2-O 3.42Å; W662-P845 PolarHBondContact NE1-O 3.1Å; V668-P845 HydrophobicContact CG2-CB 3.96Å
846	I	86.7	Confident	91.8	Very high	33 Å²	33	38.3 Å²	38.3	17%	0.169	20%	0.199	C	C	.	.			trans	-107.2	111.3	-169.6	-61.3	175.9	0	0	0	111	C673 R843	C673-I846 HydrophobicContact CB-CD1 4.27Å; R843-I846 CarbonylContact O-C 3.47Å; R843-I846 PolarHBondContact O-N 3.08Å
847	L	90.6	Very high	91.8	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.199	C	C	.	.			trans	-73.2	127.5	169.4	-72.1	170.1	0	0	0	109.7	Q685 M688 I692 W840 V850	Q685-L847 PolarHBondContact NE2-O 3.39Å; Q685-L847 PolarHBondContact OE1-O 2.68Å; M688-L847 HydrophobicContact CB-CD1 4.16Å; M688-L847 HydrophobicContact CE-CB 3.98Å; M688-L847 WeakPolarHBondContact CE-O 3.39Å; M688-L847 HydrophobicContact SD-CB 4.48Å; I692-L847 HydrophobicContact CD1-CD1 3.78Å; W840-L847 HydrophobicContact CB-CD2 4.11Å; W840-L847 HydrophobicContact CG-CD2 4.5Å; L847-V850 HydrophobicContact CD1-CG1 4.31Å
848	N	89.3	Confident	91.9	Very high	49 Å²	49	37.9 Å²	37.9	26%	0.262	20%	0.197	S	C	.	.			trans	-81.2	-43.5	171.9	-74	-15.5	0	0	0	111.4	R950	N848-R950 PolarHBondContact OD1-NH1 2.81Å
849	E	92.3	Very high	91.6	Very high	18 Å²	18	36.4 Å²	36.4	8%	0.084	19%	0.187	C	C	.	.			trans	-158.9	150.5	-175.3	178.2	160.6	-134	0	0	111.4	C851 D852 E956 N959	E849-C851 HydrophobicContact CG-CB 4.34Å; E849-D852 HydrophobicContact CG-CB 4.43Å; E849-E956 HydrophobicContact CB-CG 4.25Å; E849-E956 WeakPolarHBondContact OE1-CA 3.35Å; E849-N959 VanDerWaalsContact CD-ND2 3.31Å; E849-N959 WeakPolarHBondContact OE1-CB 3.49Å; E849-N959 PolarHBondContact OE1-ND2 3.31Å; E849-N959 PolarHBondContact OE2-ND2 3.29Å
850	V	95.4	Very high	91.3	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.006	19%	0.186	C	C	.	.	S	Bend	trans	-127.8	-6.4	166.5	-60.2	0	0	0	0	113.3	M688 V691 L836 L847 I854 I928	M688-V850 HydrophobicContact CB-CG1 4.13Å; M688-V850 HydrophobicContact CB-CG2 4.13Å; M688-V850 HydrophobicContact CG-CG2 3.94Å; V691-V850 HydrophobicContact CB-CG2 4.37Å; V691-V850 HydrophobicContact CG2-CG2 4.19Å; L836-V850 HydrophobicContact CD2-CB 4.13Å; L836-V850 HydrophobicContact CD2-CG1 4.29Å; L847-V850 HydrophobicContact CD1-CG1 4.31Å; V850-I854 PolarHBondContact O-N 3.06Å; V850-I928 HydrophobicContact CG2-CD1 4.03Å
851	C	96.9	Very high	91.2	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-80.5	-25.3	-173.7	-70	0	0	0	0	113.5	E849 L853 I854 V855 N959 V960 A963	E849-C851 HydrophobicContact CG-CB 4.34Å; C851-L853 VanDerWaalsContact C-N 3.29Å; C851-L853 PolarHBondContact O-N 3.31Å; C851-I854 PolarHBondContact O-N 2.88Å; C851-I854 VanDerWaalsContact O-N 3.15Å; C851-V855 WeakPolarHBondContact O-CG2 3.45Å; C851-V855 PolarHBondContact O-N 3.29Å; C851-N959 HydrophobicContact CB-CB 4.36Å; C851-V960 HydrophobicContact CB-CG2 3.9Å; C851-V960 VanDerWaalsContact SG-CG2 3.57Å; C851-A963 HydrophobicContact CB-CB 4.21Å
852	D	96	Very high	91.3	Very high	39 Å²	39	37.5 Å²	37.5	21%	0.209	21%	0.207	C	C	.	.	H	α-helix	trans	-58.8	-40.5	169.1	68.9	-35.7	0	0	0	111.8	R839 E849 V855 K856	R839-D852 IonicContact CZ-OD1 2.95Å; R839-D852 IonicContact CZ-OD2 2.69Å; R839-D852 IonicContact NH1-OD1 2.64Å; R839-D852 PolarHBondContact NH1-OD1 2.74Å; R839-D852 IonicContact NH1-OD2 3.31Å; R839-D852 PolarHBondContact NH1-OD2 2.84Å; R839-D852 IonicContact NH2-OD1 2.75Å; R839-D852 IonicContact NH2-OD2 3.84Å; R839-D852 PolarHBondContact NH2-OD2 3.37Å; E849-D852 HydrophobicContact CG-CB 4.43Å; D852-V855 PolarHBondContact O-N 3.28Å; D852-K856 WeakPolarHBondContact O-CB 3.43Å; D852-K856 PolarHBondContact O-N 3.41Å
853	L	96.6	Very high	91.6	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-68.3	-36.9	173.5	-65.8	177.7	0	0	0	112.3	F832 D835 L836 R839 C851 K856 H857	F832-L853 HydrophobicContact CE2-CB 4.21Å; D835-L853 HydrophobicContact CB-CD1 4.29Å; D835-L853 HydrophobicContact CB-CD2 4.09Å; D835-L853 WeakPolarHBondContact O-CD1 3.34Å; L836-L853 HydrophobicContact CD2-CD1 3.95Å; L836-L853 HydrophobicContact CG-CD1 4.44Å; R839-L853 HydrophobicContact CB-CD1 3.82Å; R839-L853 HydrophobicContact CG-CD1 4.15Å; C851-L853 VanDerWaalsContact C-N 3.29Å; C851-L853 PolarHBondContact O-N 3.31Å; L853-K856 HydrophobicContact CD2-CD 4.15Å; L853-K856 PolarHBondContact O-N 2.73Å; L853-H857 PolarHBondContact O-CD2 3.05Å; L853-H857 VanDerWaalsContact O-CD2 3.27Å; L853-H857 PolarHBondContact O-N 3.45Å; L853-H857 VanDerWaalsContact O-N 3.07Å
854	I	96.7	Very high	91.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63	-43.7	173.3	-65.4	171.5	0	0	0	110.3	V691 F832 V850 C851 H857 A858 L921 V925 A963 L967	V691-I854 HydrophobicContact CG1-CD1 4.38Å; F832-I854 HydrophobicContact CE2-CG1 4.12Å; F832-I854 HydrophobicContact CZ-CG1 3.73Å; V850-I854 PolarHBondContact O-N 3.06Å; C851-I854 PolarHBondContact O-N 2.88Å; C851-I854 VanDerWaalsContact O-N 3.15Å; I854-H857 PolarHBondContact O-N 3.14Å; I854-A858 WeakPolarHBondContact O-CB 3.45Å; I854-A858 PolarHBondContact O-N 3.1Å; I854-L921 HydrophobicContact CD1-CD2 4.24Å; I854-V925 HydrophobicContact CD1-CG2 3.5Å; I854-A963 HydrophobicContact CB-CB 4.1Å; I854-A963 HydrophobicContact CG2-CB 3.76Å; I854-L967 HydrophobicContact CG2-CD1 3.84Å; I854-L967 HydrophobicContact CG2-CD2 4.31Å; I854-L967 HydrophobicContact CG2-CG 4.04Å
855	V	96.8	Very high	92.6	Very high	36 Å²	36	29 Å²	29	22%	0.218	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-47.7	174.6	175.1	0	0	0	0	111.1	C851 D852 H857 A858 G859 L962 A963	C851-V855 WeakPolarHBondContact O-CG2 3.45Å; C851-V855 PolarHBondContact O-N 3.29Å; D852-V855 PolarHBondContact O-N 3.28Å; V855-H857 VanDerWaalsContact C-N 3.29Å; V855-H857 PolarHBondContact O-N 2.99Å; V855-A858 PolarHBondContact O-N 3.43Å; V855-G859 PolarHBondContact O-N 2.86Å; V855-L962 HydrophobicContact CG1-CB 4.46Å; V855-L962 HydrophobicContact CG2-CB 3.57Å; V855-A963 HydrophobicContact CG2-CB 4.04Å
856	K	95.6	Very high	93.2	Very high	116 Å²	116	27.7 Å²	27.7	50%	0.504	15%	0.154	S	C	.	.	H	α-helix	trans	-52.9	-43	177.6	-180	-171.2	176.4	-170.6	0	112.7	D835 D852 L853 G860	D835-K856 IonicContact OD1-NZ 2.58Å; D835-K856 PolarHBondContact OD1-NZ 2.88Å; D835-K856 WeakPolarHBondContact OD2-CE 3.46Å; D835-K856 IonicContact OD2-NZ 3.96Å; D835-K856 PolarHBondContact OD2-NZ 3.5Å; D852-K856 WeakPolarHBondContact O-CB 3.43Å; D852-K856 PolarHBondContact O-N 3.41Å; L853-K856 HydrophobicContact CD2-CD 4.15Å; L853-K856 PolarHBondContact O-N 2.73Å; K856-G860 PolarHBondContact O-N 2.63Å
857	H	96.3	Very high	93.6	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.009	15%	0.148	C	C	.	.	H	α-helix	trans	-89.1	-32.7	-176.7	-75.6	-100.7	0	0	0	114	F832 D835 L853 I854 V855 N862 F863	F832-H857 VanDerWaalsContact CA-CE1 3.48Å; F832-H857 WeakPolarHBondContact CA-CE1 3.42Å; F832-H857 HydrophobicContact CD2-CB 4.17Å; F832-H857 AromaticContact CD2-CD2 3.67Å; F832-H857 AromaticContact CD2-CG 3.79Å; D835-H857 IonicContact OD2-CD2 3.6Å; D835-H857 IonicContact OD2-CE1 2.62Å; D835-H857 IonicContact OD2-NE2 2.96Å; D835-H857 PolarHBondContact OD2-NE2 3.41Å; L853-H857 PolarHBondContact O-CD2 3.05Å; L853-H857 VanDerWaalsContact O-CD2 3.27Å; L853-H857 PolarHBondContact O-N 3.45Å; L853-H857 VanDerWaalsContact O-N 3.07Å; I854-H857 PolarHBondContact O-N 3.14Å; V855-H857 VanDerWaalsContact C-N 3.29Å; V855-H857 PolarHBondContact O-N 2.99Å; H857-N862 HydrophobicContact CB-CB 4.28Å; H857-N862 PolarHBondContact CE1-ND2 3.26Å; H857-N862 VanDerWaalsContact CE1-ND2 3.26Å; H857-N862 PolarHBondContact ND1-ND2 2.84Å; H857-F863 HydrophobicContact CB-CD1 4.05Å; H857-F863 HydrophobicContact CB-CE1 3.67Å; H857-F863 HydrophobicContact CB-CE2 4.19Å; H857-F863 HydrophobicContact CB-CG 4.47Å; H857-F863 HydrophobicContact CB-CZ 3.74Å; H857-F863 WeakPolarHBondContact O-CG 3.48Å; H857-F863 PolarHBondContact O-N 3.09Å
858	A	94.2	Very high	93.7	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-87	-33.3	-177.3	0	0	0	0	0	114.4	I854 V855 F863 E966 R969 L970	I854-A858 WeakPolarHBondContact O-CB 3.45Å; I854-A858 PolarHBondContact O-N 3.1Å; V855-A858 PolarHBondContact O-N 3.43Å; A858-F863 HydrophobicContact CB-CD2 3.68Å; A858-F863 HydrophobicContact CB-CE2 4.1Å; A858-E966 HydrophobicContact CB-CB 3.71Å; A858-R969 PolarHBondContact O-NH2 3.02Å; A858-L970 HydrophobicContact CB-CD1 3.74Å
859	G	87.3	Confident	94	Very high	22 Å²	22	26.2 Å²	26.2	23%	0.227	15%	0.148	C	C	.	.	S	Bend	trans	-88.6	-8.3	169	0	0	0	0	0	113.3	R381 V855	R381-G859 PolarHBondContact NH2-O 3.42Å; V855-G859 PolarHBondContact O-N 2.86Å
860	G	88	Confident	94	Very high	16 Å²	16	25.4 Å²	25.4	17%	0.165	14%	0.144	C	C	.	.	S	Bend	trans	-89.3	177.2	168.6	0	0	0	0	0	112.6	K856 N862	K856-G860 PolarHBondContact O-N 2.63Å; G860-N862 PolarHBondContact O-N 2.91Å
861	V	88.1	Confident	93.9	Very high	102 Å²	102	27.2 Å²	27.2	62%	0.618	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-8.2	177.9	-63.2	0	0	0	0	113.7	F863 E864 P865	V861-F863 PolarHBondContact O-N 3.13Å; V861-E864 PolarHBondContact O-N 3.26Å; V861-P865 WeakPolarHBondContact O-CD 3.23Å
862	N	91.3	Very high	93.6	Very high	39 Å²	39	27.9 Å²	27.9	21%	0.209	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-34.2	-169.9	-62.7	0.5	0	0	0	112.6	A828 H857 G860 P865	A828-N862 WeakPolarHBondContact CB-O 3.43Å; H857-N862 HydrophobicContact CB-CB 4.28Å; H857-N862 PolarHBondContact CE1-ND2 3.26Å; H857-N862 VanDerWaalsContact CE1-ND2 3.26Å; H857-N862 PolarHBondContact ND1-ND2 2.84Å; G860-N862 PolarHBondContact O-N 2.91Å; N862-P865 WeakPolarHBondContact O-CD 3.36Å
863	F	95.8	Very high	93.3	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	15%	0.152	C	C	.	.	S	Bend	trans	-94.6	-7.2	178.4	-72.1	0.1	0	0	0	114.6	F832 H857 A858 V861 P865 Y866 L921 L970	F832-F863 HydrophobicContact CB-CE1 4.11Å; F832-F863 HydrophobicContact CB-CZ 4.37Å; F832-F863 HydrophobicContact CD1-CE1 4.29Å; F832-F863 AromaticContact CD1-CZ 3.8Å; F832-F863 HydrophobicContact CD1-CZ 3.8Å; F832-F863 HydrophobicContact CD2-CZ 4.34Å; F832-F863 HydrophobicContact CE1-CZ 4.14Å; F832-F863 HydrophobicContact CG-CE1 4.17Å; F832-F863 AromaticContact CG-CZ 3.92Å; F832-F863 HydrophobicContact CG-CZ 3.92Å; H857-F863 HydrophobicContact CB-CD1 4.05Å; H857-F863 HydrophobicContact CB-CE1 3.67Å; H857-F863 HydrophobicContact CB-CE2 4.19Å; H857-F863 HydrophobicContact CB-CG 4.47Å; H857-F863 HydrophobicContact CB-CZ 3.74Å; H857-F863 WeakPolarHBondContact O-CG 3.48Å; H857-F863 PolarHBondContact O-N 3.09Å; A858-F863 HydrophobicContact CB-CD2 3.68Å; A858-F863 HydrophobicContact CB-CE2 4.1Å; V861-F863 PolarHBondContact O-N 3.13Å; F863-P865 VanDerWaalsContact C-N 3.3Å; F863-Y866 HydrophobicContact CB-CD2 4.26Å; F863-Y866 HydrophobicContact CD1-CD2 4.43Å; F863-Y866 AromaticContact CD1-CE2 3.98Å; F863-Y866 HydrophobicContact CD1-CE2 3.98Å; F863-Y866 HydrophobicContact CE1-CE2 4.48Å; F863-Y866 HydrophobicContact CG-CD2 4.48Å; F863-Y866 HydrophobicContact CG-CE2 4.41Å; F863-Y866 VanDerWaalsContact O-CB 3.32Å; F863-Y866 WeakPolarHBondContact O-CB 3.37Å; F863-Y866 WeakPolarHBondContact O-CD2 3.49Å; F863-Y866 PolarHBondContact O-N 3Å; F863-L921 HydrophobicContact CE2-CD1 3.89Å; F863-L921 HydrophobicContact CZ-CD1 4.26Å; F863-L970 HydrophobicContact CB-CD1 3.67Å; F863-L970 HydrophobicContact CB-CD2 4.3Å; F863-L970 HydrophobicContact CD2-CD1 3.77Å; F863-L970 HydrophobicContact CG-CD1 4.25Å
864	E	92.6	Very high	92.8	Very high	69 Å²	69	30 Å²	30	32%	0.322	17%	0.167	S	C	.	.	H	α-helix	trans	-55.9	-31.9	173.6	-65.8	-63.1	137.1	0	0	114.5	V861 Y866 I867 R969	V861-E864 PolarHBondContact O-N 3.26Å; E864-Y866 PolarHBondContact O-N 3.32Å; E864-Y866 VanDerWaalsContact O-N 3.14Å; E864-I867 PolarHBondContact O-N 3.04Å; E864-I867 VanDerWaalsContact O-N 3.1Å; E864-I867 WeakPolarHBondContact OE2-CD1 3.44Å; E864-R969 IonicContact OE1-CZ 2.74Å; E864-R969 VanDerWaalsContact OE1-CZ 3.24Å; E864-R969 IonicContact OE1-NH1 3.97Å; E864-R969 PolarHBondContact OE1-NH1 3.37Å; E864-R969 IonicContact OE1-NH2 2.68Å; E864-R969 PolarHBondContact OE1-NH2 3.12Å
865	P	94.7	Very high	92.3	Very high	25 Å²	25	32.6 Å²	32.6	16%	0.162	18%	0.177	C	C	.	.	H	α-helix	trans	-54.4	-27.4	169.1	-30.4	37.5	0	0	0	115.3	N821 L824 V825 V861 N862 F863 Y869	N821-P865 PolarHBondContact ND2-O 3.27Å; L824-P865 HydrophobicContact CB-CB 3.8Å; L824-P865 HydrophobicContact CB-CG 4.09Å; V825-P865 HydrophobicContact CG2-CB 4.35Å; V861-P865 WeakPolarHBondContact O-CD 3.23Å; N862-P865 WeakPolarHBondContact O-CD 3.36Å; F863-P865 VanDerWaalsContact C-N 3.3Å; P865-Y869 PolarHBondContact O-N 3.05Å; P865-Y869 VanDerWaalsContact O-N 3.1Å
866	Y	96.1	Very high	92	Very high	4 Å²	4	31 Å²	31	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-67	-40.5	176.6	-72.9	-109.9	0	0	0	111.2	Y698 V825 A828 F863 E864 T868 Y869 L870 P914	Y698-Y866 WeakPolarHBondContact CE1-OH 3.06Å; Y698-Y866 WeakPolarHBondContact OH-CE1 3.49Å; Y698-Y866 PolarHBondContact OH-OH 3.19Å; V825-Y866 HydrophobicContact CG1-CD1 4.06Å; V825-Y866 HydrophobicContact CG1-CD2 4.24Å; V825-Y866 HydrophobicContact CG1-CE1 3.72Å; V825-Y866 HydrophobicContact CG1-CE2 3.93Å; V825-Y866 HydrophobicContact CG1-CG 4.31Å; A828-Y866 HydrophobicContact CB-CE2 4.06Å; F863-Y866 HydrophobicContact CB-CD2 4.26Å; F863-Y866 HydrophobicContact CD1-CD2 4.43Å; F863-Y866 AromaticContact CD1-CE2 3.98Å; F863-Y866 HydrophobicContact CD1-CE2 3.98Å; F863-Y866 HydrophobicContact CE1-CE2 4.48Å; F863-Y866 HydrophobicContact CG-CD2 4.48Å; F863-Y866 HydrophobicContact CG-CE2 4.41Å; F863-Y866 VanDerWaalsContact O-CB 3.32Å; F863-Y866 WeakPolarHBondContact O-CB 3.37Å; F863-Y866 WeakPolarHBondContact O-CD2 3.49Å; F863-Y866 PolarHBondContact O-N 3Å; E864-Y866 PolarHBondContact O-N 3.32Å; E864-Y866 VanDerWaalsContact O-N 3.14Å; Y866-T868 PolarHBondContact O-N 2.88Å; Y866-Y869 WeakPolarHBondContact O-CB 3.32Å; Y866-Y869 PolarHBondContact O-N 2.81Å; Y866-Y869 VanDerWaalsContact O-N 3.17Å; Y866-L870 WeakPolarHBondContact O-CB 3.41Å; Y866-L870 VanDerWaalsContact O-CG 3.23Å; Y866-L870 WeakPolarHBondContact O-CG 3.33Å; Y866-L870 PolarHBondContact O-N 2.79Å; Y866-P914 HydrophobicContact CD1-CB 3.91Å; Y866-P914 HydrophobicContact CE1-CB 4.14Å
867	I	94.8	Very high	91.8	Very high	8 Å²	8	28.5 Å²	28.5	4%	0.041	16%	0.158	C	C	.	.	H	α-helix	trans	-59.4	-50.1	178.1	-72.5	161	0	0	0	110.1	E864 Y869 L870 R871 L970 A973 S974 E977	E864-I867 PolarHBondContact O-N 3.04Å; E864-I867 VanDerWaalsContact O-N 3.1Å; E864-I867 WeakPolarHBondContact OE2-CD1 3.44Å; I867-Y869 VanDerWaalsContact C-N 3.28Å; I867-Y869 PolarHBondContact O-N 3.49Å; I867-L870 PolarHBondContact O-N 3.25Å; I867-R871 WeakPolarHBondContact O-CB 3.17Å; I867-R871 PolarHBondContact O-N 3.36Å; I867-L970 HydrophobicContact CD1-CD2 3.63Å; I867-L970 HydrophobicContact CG1-CD2 4.28Å; I867-A973 HydrophobicContact CD1-CB 3.78Å; I867-A973 HydrophobicContact CG1-CB 4.2Å; I867-S974 WeakPolarHBondContact CG1-OG 3.21Å; I867-E977 HydrophobicContact CG2-CB 4.44Å; I867-E977 VanDerWaalsContact CG2-CD 3.43Å; I867-E977 HydrophobicContact CG2-CG 3.91Å; I867-E977 WeakPolarHBondContact CG2-OE2 3.44Å
868	T	92.7	Very high	91.5	Very high	45 Å²	45	29.9 Å²	29.9	28%	0.276	17%	0.17	S	C	.	.	H	α-helix	trans	-62	-33.1	177.1	-74.7	0	0	0	0	113	N821 Y866 R871 N872	N821-T868 HydrophobicContact CB-CG2 4.48Å; Y866-T868 PolarHBondContact O-N 2.88Å; T868-R871 PolarHBondContact OG1-NH2 3.02Å; T868-N872 PolarHBondContact O-ND2 3.18Å
869	Y	95.4	Very high	91.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69	-46.2	174.8	-176.1	-83.4	0	0	0	111.5	N821 V822 V825 P865 Y866 I867 N872 Q873 Q876 L911 P914	N821-Y869 WeakPolarHBondContact OD1-CA 3.34Å; N821-Y869 WeakPolarHBondContact OD1-CB 3.4Å; N821-Y869 PolarHBondContact OD1-N 3.5Å; V822-Y869 HydrophobicContact CB-CD2 4.47Å; V822-Y869 HydrophobicContact CB-CE2 4.02Å; V822-Y869 HydrophobicContact CG2-CE2 4.38Å; V825-Y869 HydrophobicContact CG2-CD2 4.13Å; V825-Y869 HydrophobicContact CG2-CG 4.17Å; P865-Y869 PolarHBondContact O-N 3.05Å; P865-Y869 VanDerWaalsContact O-N 3.1Å; Y866-Y869 WeakPolarHBondContact O-CB 3.32Å; Y866-Y869 PolarHBondContact O-N 2.81Å; Y866-Y869 VanDerWaalsContact O-N 3.17Å; I867-Y869 VanDerWaalsContact C-N 3.28Å; I867-Y869 PolarHBondContact O-N 3.49Å; Y869-N872 PolarHBondContact O-N 3.3Å; Y869-Q873 PolarHBondContact O-N 3Å; Y869-Q876 PolarHBondContact O-NE2 3.3Å; Y869-Q876 PolarHBondContact OH-OE1 3.33Å; Y869-L911 WeakPolarHBondContact CE1-O 3.21Å; Y869-L911 WeakPolarHBondContact OH-CA 3.29Å; Y869-L911 PolarHBondContact OH-O 2.79Å; Y869-P914 HydrophobicContact CD1-CB 3.95Å; Y869-P914 HydrophobicContact CD1-CG 3.85Å; Y869-P914 HydrophobicContact CE1-CB 4.08Å; Y869-P914 HydrophobicContact CE1-CG 3.57Å; Y869-P914 HydrophobicContact CG-CG 4.46Å
870	L	93.4	Very high	91.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-74.3	-34.8	-174.4	-66.6	175.7	0	0	0	112.9	Y866 I867 N872 Q873 P914 M915 L918	Y866-L870 WeakPolarHBondContact O-CB 3.41Å; Y866-L870 VanDerWaalsContact O-CG 3.23Å; Y866-L870 WeakPolarHBondContact O-CG 3.33Å; Y866-L870 PolarHBondContact O-N 2.79Å; I867-L870 PolarHBondContact O-N 3.25Å; L870-N872 PolarHBondContact O-N 3.08Å; L870-Q873 WeakPolarHBondContact O-CB 3.45Å; L870-Q873 PolarHBondContact O-N 3.41Å; L870-P914 HydrophobicContact CD2-CB 4.45Å; L870-M915 HydrophobicContact CD1-CE 4.11Å; L870-M915 HydrophobicContact CD1-SD 4.02Å; L870-M915 HydrophobicContact CD2-CB 3.66Å; L870-M915 HydrophobicContact CD2-CE 4.13Å; L870-M915 HydrophobicContact CD2-CG 4.47Å; L870-M915 HydrophobicContact CD2-SD 4.37Å; L870-L918 HydrophobicContact CD1-CD2 4.45Å
871	R	92.2	Very high	91.8	Very high	39 Å²	39	36.4 Å²	36.4	15%	0.147	19%	0.185	C	C	.	.	H	α-helix	trans	-50.8	-38.5	167.4	178.7	176.5	61.6	-142.6	-0.7	112.3	I867 T868 E977 M981	I867-R871 WeakPolarHBondContact O-CB 3.17Å; I867-R871 PolarHBondContact O-N 3.36Å; T868-R871 PolarHBondContact OG1-NH2 3.02Å; R871-E977 HydrophobicContact CB-CB 3.94Å; R871-E977 WeakPolarHBondContact CD-OE2 3.36Å; R871-E977 HydrophobicContact CG-CB 4Å; R871-E977 IonicContact CZ-OE2 2.71Å; R871-E977 VanDerWaalsContact CZ-OE2 3.31Å; R871-E977 IonicContact NE-OE2 2.78Å; R871-E977 PolarHBondContact NE-OE2 2.86Å; R871-E977 IonicContact NH1-OE1 3.69Å; R871-E977 PolarHBondContact NH1-OE1 2.95Å; R871-E977 IonicContact NH1-OE2 3.65Å; R871-E977 PolarHBondContact NH1-OE2 3.48Å; R871-M981 HydrophobicContact CG-CB 3.81Å; R871-M981 HydrophobicContact CG-CE 4.18Å; R871-M981 HydrophobicContact CG-CG 4.32Å
872	N	91.2	Very high	91.9	Very high	17 Å²	17	35.5 Å²	35.5	9%	0.091	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-0.6	-176.9	-65.8	-12.3	0	0	0	113.2	S820 T868 Y869 L870 T874 Y875 Q876	S820-N872 PolarHBondContact OG-ND2 3.3Å; T868-N872 PolarHBondContact O-ND2 3.18Å; Y869-N872 PolarHBondContact O-N 3.3Å; L870-N872 PolarHBondContact O-N 3.08Å; N872-T874 VanDerWaalsContact C-N 3.35Å; N872-T874 PolarHBondContact O-N 3.23Å; N872-Y875 WeakPolarHBondContact O-CA 3.36Å; N872-Y875 WeakPolarHBondContact O-CB 3.43Å; N872-Y875 PolarHBondContact O-N 3.47Å; N872-Q876 PolarHBondContact O-N 3.46Å
873	Q	89.4	Confident	91.9	Very high	34 Å²	34	33.8 Å²	33.8	16%	0.159	17%	0.168	C	C	.	.	H	α-helix	trans	-60.3	-38.6	-170	-168.9	176.3	31.8	0	0	113.5	Y869 L870 Y875 Q876 M877	Y869-Q873 PolarHBondContact O-N 3Å; L870-Q873 WeakPolarHBondContact O-CB 3.45Å; L870-Q873 PolarHBondContact O-N 3.41Å; Q873-Y875 VanDerWaalsContact C-N 3.27Å; Q873-Y875 PolarHBondContact O-N 2.89Å; Q873-Q876 PolarHBondContact O-N 3.36Å; Q873-M877 WeakPolarHBondContact O-CG 3.44Å; Q873-M877 PolarHBondContact O-N 3.27Å; Q873-M877 VanDerWaalsContact O-N 3.09Å
874	T	85.8	Confident	91.7	Very high	55 Å²	55	36 Å²	36	34%	0.337	18%	0.183	S	C	.	.	H	α-helix	trans	-61.3	-37.5	176	-49.4	0	0	0	0	111.5	N872 A878 D982	N872-T874 VanDerWaalsContact C-N 3.35Å; N872-T874 PolarHBondContact O-N 3.23Å; T874-A878 VanDerWaalsContact O-CB 3.26Å; T874-A878 WeakPolarHBondContact O-CB 3.48Å; T874-A878 PolarHBondContact O-N 3.16Å; T874-D982 WeakPolarHBondContact CB-OD1 3.45Å; T874-D982 VanDerWaalsContact CG2-OD1 3.26Å; T874-D982 WeakPolarHBondContact CG2-OD1 3.45Å; T874-D982 PolarHBondContact OG1-OD1 3.44Å; T874-D982 PolarHBondContact OG1-OD2 2.89Å
875	Y	85.9	Confident	91.5	Very high	55 Å²	55	41.1 Å²	41.1	22%	0.216	20%	0.199	C	C	.	.	H	α-helix	trans	-72.1	-37.9	177.2	-66	-101.4	0	0	0	112.2	N872 Q873 A878 T879 M981 S985	N872-Y875 WeakPolarHBondContact O-CA 3.36Å; N872-Y875 WeakPolarHBondContact O-CB 3.43Å; N872-Y875 PolarHBondContact O-N 3.47Å; Q873-Y875 VanDerWaalsContact C-N 3.27Å; Q873-Y875 PolarHBondContact O-N 2.89Å; Y875-A878 PolarHBondContact O-N 3.15Å; Y875-T879 WeakPolarHBondContact O-CB 3.37Å; Y875-T879 PolarHBondContact O-N 3.36Å; Y875-T879 PolarHBondContact O-OG1 3.48Å; Y875-M981 HydrophobicContact CD2-CG 4.39Å; Y875-M981 HydrophobicContact CE2-CB 4.41Å; Y875-M981 HydrophobicContact CE2-CG 3.44Å; Y875-M981 VanDerWaalsContact CE2-CG 3.44Å; Y875-M981 PolarHBondContact OH-O 2.83Å; Y875-S985 WeakPolarHBondContact OH-CB 3.33Å; Y875-S985 PolarHBondContact OH-OG 3.14Å; Y875-S985 VanDerWaalsContact OH-OG 3.09Å
876	Q	92.2	Very high	91.4	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-58.4	-51	173.7	-62.4	170.2	26.1	0	0	110.4	H817 L818 Y869 N872 Q873 T879 L880	H817-Q876 VanDerWaalsContact O-CA 3.26Å; H817-Q876 WeakPolarHBondContact O-CA 3.49Å; H817-Q876 WeakPolarHBondContact O-CG 3.41Å; L818-Q876 WeakPolarHBondContact O-CG 3.42Å; Y869-Q876 PolarHBondContact O-NE2 3.3Å; Y869-Q876 PolarHBondContact OH-OE1 3.33Å; N872-Q876 PolarHBondContact O-N 3.46Å; Q873-Q876 PolarHBondContact O-N 3.36Å; Q876-T879 PolarHBondContact O-N 3.37Å; Q876-L880 WeakPolarHBondContact O-CB 3.2Å; Q876-L880 PolarHBondContact O-N 2.89Å
877	M	91.1	Very high	91	Very high	65 Å²	65	49.7 Å²	49.7	32%	0.32	24%	0.237	S	C	.	.	H	α-helix	trans	-67.9	-36.5	-179.3	-62.4	-57.3	-64	0	0	113	Q873 R881 N908	Q873-M877 WeakPolarHBondContact O-CG 3.44Å; Q873-M877 PolarHBondContact O-N 3.27Å; Q873-M877 VanDerWaalsContact O-N 3.09Å; M877-R881 WeakPolarHBondContact O-CB 3.38Å; M877-R881 PolarHBondContact O-N 3.13Å; M877-R881 VanDerWaalsContact O-N 3.11Å; M877-N908 WeakPolarHBondContact CE-OD1 3.38Å
878	A	89.4	Confident	90.7	Very high	30 Å²	30	52.5 Å²	52.5	25%	0.248	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-41.4	174.3	0	0	0	0	0	112.2	T874 Y875 R881 N882	T874-A878 VanDerWaalsContact O-CB 3.26Å; T874-A878 WeakPolarHBondContact O-CB 3.48Å; T874-A878 PolarHBondContact O-N 3.16Å; Y875-A878 PolarHBondContact O-N 3.15Å; A878-R881 PolarHBondContact O-N 3.46Å; A878-N882 WeakPolarHBondContact O-CB 3.5Å; A878-N882 PolarHBondContact O-N 2.93Å; A878-N882 PolarHBondContact O-ND2 2.86Å
879	T	90.8	Very high	90.7	Very high	19 Å²	19	50.4 Å²	50.4	12%	0.117	24%	0.244	C	C	.	.	H	α-helix	trans	-64.6	-48.7	177.6	-60.9	0	0	0	0	110.4	H817 L818 Y875 Q876 R881 N882 L883	H817-T879 HydrophobicContact CB-CG2 3.99Å; H817-T879 WeakPolarHBondContact CB-OG1 3.26Å; L818-T879 HydrophobicContact CB-CG2 4.37Å; Y875-T879 WeakPolarHBondContact O-CB 3.37Å; Y875-T879 PolarHBondContact O-N 3.36Å; Y875-T879 PolarHBondContact O-OG1 3.48Å; Q876-T879 PolarHBondContact O-N 3.37Å; T879-R881 VanDerWaalsContact C-N 3.34Å; T879-R881 PolarHBondContact O-N 3.36Å; T879-N882 CarbonylContact O-C 3.52Å; T879-N882 PolarHBondContact O-N 2.86Å; T879-N882 VanDerWaalsContact O-N 3.08Å; T879-L883 HydrophobicContact CG2-CD1 3.75Å; T879-L883 HydrophobicContact CG2-CG 4.15Å; T879-L883 WeakPolarHBondContact O-CB 3.44Å; T879-L883 VanDerWaalsContact O-CG 3.27Å; T879-L883 WeakPolarHBondContact O-CG 3.42Å; T879-L883 PolarHBondContact O-N 2.8Å
880	L	92.5	Very high	90.5	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-45.8	174.8	-177.9	55.2	0	0	0	111.9	L818 Q876 N882 L883 C884 F889 L893 I907 N908 L911	L818-L880 HydrophobicContact CD1-CB 3.72Å; L818-L880 HydrophobicContact CD1-CD1 4.12Å; L818-L880 HydrophobicContact CD1-CG 4.34Å; Q876-L880 WeakPolarHBondContact O-CB 3.2Å; Q876-L880 PolarHBondContact O-N 2.89Å; L880-N882 VanDerWaalsContact C-N 3.29Å; L880-N882 PolarHBondContact O-N 3.34Å; L880-L883 PolarHBondContact O-N 3.42Å; L880-C884 WeakPolarHBondContact O-CB 3.44Å; L880-C884 PolarHBondContact O-N 3.49Å; L880-C884 PolarHBondContact O-SG 3.02Å; L880-F889 HydrophobicContact CD1-CE1 3.98Å; L880-F889 HydrophobicContact CD1-CZ 4.05Å; L880-L893 HydrophobicContact CD1-CD2 4.14Å; L880-I907 HydrophobicContact CD1-CG2 3.96Å; L880-I907 HydrophobicContact CD2-CG2 3.74Å; L880-N908 WeakPolarHBondContact CD2-OD1 3.35Å; L880-L911 HydrophobicContact CD2-CD1 4.06Å
881	R	92.2	Very high	90.2	Very high	152 Å²	152	60 Å²	60	57%	0.574	29%	0.291	S	S	*	.	H	α-helix	trans	-60.9	-36.3	176.1	-169.4	-172.3	-58.5	115	0.8	112.7	M877 A878 T879	M877-R881 WeakPolarHBondContact O-CB 3.38Å; M877-R881 PolarHBondContact O-N 3.13Å; M877-R881 VanDerWaalsContact O-N 3.11Å; A878-R881 PolarHBondContact O-N 3.46Å; T879-R881 VanDerWaalsContact C-N 3.34Å; T879-R881 PolarHBondContact O-N 3.36Å
882	N	91.2	Very high	90.1	Very high	84 Å²	84	58.5 Å²	58.5	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-74.8	-39	177	-70.8	-21.8	0	0	0	112.1	A878 T879 L880 R885	A878-N882 WeakPolarHBondContact O-CB 3.5Å; A878-N882 PolarHBondContact O-N 2.93Å; A878-N882 PolarHBondContact O-ND2 2.86Å; T879-N882 CarbonylContact O-C 3.52Å; T879-N882 PolarHBondContact O-N 2.86Å; T879-N882 VanDerWaalsContact O-N 3.08Å; L880-N882 VanDerWaalsContact C-N 3.29Å; L880-N882 PolarHBondContact O-N 3.34Å; N882-R885 WeakPolarHBondContact O-CB 3.43Å; N882-R885 PolarHBondContact O-N 2.92Å; N882-R885 PolarHBondContact OD1-NH1 2.94Å
883	L	90.9	Very high	90.1	Very high	3 Å²	3	58 Å²	58	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-66.5	-40.5	177.1	-71.1	171.1	0	0	0	111.8	L810 L818 T879 L880 R885 R886 F889	L810-L883 HydrophobicContact CD2-CD1 3.6Å; L810-L883 HydrophobicContact CD2-CD2 3.57Å; L810-L883 HydrophobicContact CD2-CG 4.21Å; L818-L883 HydrophobicContact CD2-CD1 4.04Å; T879-L883 HydrophobicContact CG2-CD1 3.75Å; T879-L883 HydrophobicContact CG2-CG 4.15Å; T879-L883 WeakPolarHBondContact O-CB 3.44Å; T879-L883 VanDerWaalsContact O-CG 3.27Å; T879-L883 WeakPolarHBondContact O-CG 3.42Å; T879-L883 PolarHBondContact O-N 2.8Å; L880-L883 PolarHBondContact O-N 3.42Å; L883-R885 PolarHBondContact O-N 3.45Å; L883-R886 WeakPolarHBondContact O-CB 3.44Å; L883-R886 PolarHBondContact O-N 3.27Å; L883-F889 VanDerWaalsContact C-CD1 3.42Å; L883-F889 HydrophobicContact CB-CD1 3.58Å; L883-F889 HydrophobicContact CB-CD2 4.25Å; L883-F889 HydrophobicContact CB-CE1 3.54Å; L883-F889 HydrophobicContact CB-CE2 4.23Å; L883-F889 HydrophobicContact CB-CG 3.94Å; L883-F889 HydrophobicContact CB-CZ 3.89Å; L883-F889 HydrophobicContact CD1-CE2 4.03Å; L883-F889 HydrophobicContact CD1-CZ 4Å; L883-F889 WeakPolarHBondContact O-CD1 3.4Å
884	C	90.6	Very high	90.1	Very high	47 Å²	47	60 Å²	60	32%	0.318	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-3.3	174.5	-68.2	0	0	0	0	114.9	L880	L880-C884 WeakPolarHBondContact O-CB 3.44Å; L880-C884 PolarHBondContact O-N 3.49Å; L880-C884 PolarHBondContact O-SG 3.02Å
885	R	90.2	Very high	90.2	Very high	177 Å²	177	63 Å²	63	67%	0.668	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.4	166.3	-59.6	-167.1	-175.4	108.2	-1.2	113.7	N882 L883	N882-R885 WeakPolarHBondContact O-CB 3.43Å; N882-R885 PolarHBondContact O-N 2.92Å; N882-R885 PolarHBondContact OD1-NH1 2.94Å; L883-R885 PolarHBondContact O-N 3.45Å
886	R	91.3	Very high	90.3	Very high	91 Å²	91	61.1 Å²	61.1	34%	0.343	30%	0.304	S	S	.	.	S	Bend	trans	-94.2	116.3	173.2	-55.9	175.8	-175.6	165.7	4.9	107.8	E814 L883 S888 F889 R890	E814-R886 IonicContact OE1-CZ 2.73Å; E814-R886 IonicContact OE1-NH1 3.38Å; E814-R886 PolarHBondContact OE1-NH1 2.88Å; E814-R886 IonicContact OE1-NH2 2.75Å; E814-R886 PolarHBondContact OE1-NH2 3.14Å; E814-R886 IonicContact OE2-CZ 2.63Å; E814-R886 IonicContact OE2-NH1 3.63Å; E814-R886 PolarHBondContact OE2-NH1 2.8Å; E814-R886 IonicContact OE2-NH2 3.22Å; L883-R886 WeakPolarHBondContact O-CB 3.44Å; L883-R886 PolarHBondContact O-N 3.27Å; R886-S888 PolarHBondContact O-N 2.84Å; R886-F889 HydrophobicContact CB-CB 4.13Å; R886-F889 PolarHBondContact O-N 2.86Å; R886-F889 VanDerWaalsContact O-N 3.16Å; R886-R890 WeakPolarHBondContact O-CB 3.3Å; R886-R890 PolarHBondContact O-N 2.83Å
887	D	88.7	Confident	90.3	Very high	117 Å²	117	63 Å²	63	63%	0.626	31%	0.312	S	S	*	.	H	α-helix	trans	-62.2	-29.3	-176	-59.1	-66	0	0	0	113.2	S891	D887-S891 WeakPolarHBondContact O-CB 3.42Å; D887-S891 PolarHBondContact O-N 2.86Å; D887-S891 PolarHBondContact O-OG 2.84Å
888	S	88.4	Confident	90	Very high	68 Å²	68	63.8 Å²	63.8	48%	0.476	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-50.8	172.8	54.7	0	0	0	0	112.7	R886 R890 S891 A892	R886-S888 PolarHBondContact O-N 2.84Å; S888-R890 VanDerWaalsContact C-N 3.34Å; S888-S891 PolarHBondContact O-N 3.04Å; S888-A892 WeakPolarHBondContact O-CB 3.26Å; S888-A892 PolarHBondContact O-N 3.12Å
889	F	91.8	Very high	89.8	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.8	-40.8	175.1	175.3	-90.5	0	0	0	111.2	F715 L810 L818 L880 L883 R886 A892 L893	F715-F889 HydrophobicContact CD1-CD2 4.23Å; F715-F889 AromaticContact CD1-CE2 3.97Å; F715-F889 HydrophobicContact CD1-CE2 3.97Å; F715-F889 AromaticContact CE1-CD2 3.56Å; F715-F889 HydrophobicContact CE1-CD2 3.56Å; F715-F889 AromaticContact CE1-CE2 3.26Å; F715-F889 HydrophobicContact CE1-CE2 3.26Å; F715-F889 HydrophobicContact CE1-CZ 4.13Å; F715-F889 HydrophobicContact CE2-CE2 4.09Å; F715-F889 HydrophobicContact CE2-CZ 4.43Å; F715-F889 HydrophobicContact CZ-CD2 4.07Å; F715-F889 AromaticContact CZ-CE2 3.33Å; F715-F889 HydrophobicContact CZ-CE2 3.33Å; F715-F889 AromaticContact CZ-CZ 3.76Å; F715-F889 HydrophobicContact CZ-CZ 3.76Å; L810-F889 HydrophobicContact CD1-CE2 4.41Å; L810-F889 HydrophobicContact CD2-CD2 3.72Å; L810-F889 HydrophobicContact CD2-CE2 3.71Å; L810-F889 HydrophobicContact CG-CD2 4.41Å; L810-F889 HydrophobicContact CG-CE2 4.33Å; L818-F889 HydrophobicContact CD2-CZ 4.33Å; L880-F889 HydrophobicContact CD1-CE1 3.98Å; L880-F889 HydrophobicContact CD1-CZ 4.05Å; L883-F889 VanDerWaalsContact C-CD1 3.42Å; L883-F889 HydrophobicContact CB-CD1 3.58Å; L883-F889 HydrophobicContact CB-CD2 4.25Å; L883-F889 HydrophobicContact CB-CE1 3.54Å; L883-F889 HydrophobicContact CB-CE2 4.23Å; L883-F889 HydrophobicContact CB-CG 3.94Å; L883-F889 HydrophobicContact CB-CZ 3.89Å; L883-F889 HydrophobicContact CD1-CE2 4.03Å; L883-F889 HydrophobicContact CD1-CZ 4Å; L883-F889 WeakPolarHBondContact O-CD1 3.4Å; R886-F889 HydrophobicContact CB-CB 4.13Å; R886-F889 PolarHBondContact O-N 2.86Å; R886-F889 VanDerWaalsContact O-N 3.16Å; F889-A892 PolarHBondContact O-N 3.39Å; F889-L893 HydrophobicContact CE1-CB 4.32Å; F889-L893 HydrophobicContact CE1-CD2 3.89Å; F889-L893 HydrophobicContact CZ-CD2 4.36Å; F889-L893 VanDerWaalsContact O-CB 3.29Å; F889-L893 WeakPolarHBondContact O-CB 3.27Å; F889-L893 PolarHBondContact O-N 2.99Å
890	R	90.6	Very high	89.4	Confident	134 Å²	134	70.5 Å²	70.5	51%	0.506	36%	0.364	S	S	.	.	H	α-helix	trans	-61.1	-48.9	177.4	-179.9	178.3	176.1	170.2	1	111.7	R886 S888 A892 L893 D894	R886-R890 WeakPolarHBondContact O-CB 3.3Å; R886-R890 PolarHBondContact O-N 2.83Å; S888-R890 VanDerWaalsContact C-N 3.34Å; R890-A892 VanDerWaalsContact C-N 3.34Å; R890-A892 PolarHBondContact O-N 2.93Å; R890-L893 PolarHBondContact O-N 3.03Å; R890-L893 VanDerWaalsContact O-N 3.15Å; R890-D894 WeakPolarHBondContact CG-OD2 3.44Å; R890-D894 IonicContact NE-OD2 2.88Å; R890-D894 WeakPolarHBondContact O-CB 3.44Å; R890-D894 PolarHBondContact O-N 3.31Å
891	S	89	Confident	88.8	Confident	69 Å²	69	78.3 Å²	78.3	48%	0.483	39%	0.393	S	S	.	.	H	α-helix	trans	-63.5	-39.8	179.4	-56.4	0	0	0	0	111.9	D887 S888 N895	D887-S891 WeakPolarHBondContact O-CB 3.42Å; D887-S891 PolarHBondContact O-N 2.86Å; D887-S891 PolarHBondContact O-OG 2.84Å; S888-S891 PolarHBondContact O-N 3.04Å; S891-N895 VanDerWaalsContact O-CG 3.24Å; S891-N895 PolarHBondContact O-N 3.3Å; S891-N895 PolarHBondContact O-ND2 2.95Å
892	A	89.4	Confident	88	Confident	7 Å²	7	71.1 Å²	71.1	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-61.5	-44.8	171.6	0	0	0	0	0	112.2	E714 F715 L809 S888 F889 R890 N895 L896	E714-A892 HydrophobicContact CB-CB 3.9Å; E714-A892 HydrophobicContact CG-CB 3.84Å; F715-A892 HydrophobicContact CE1-CB 4.43Å; L809-A892 HydrophobicContact CD1-CB 3.48Å; L809-A892 VanDerWaalsContact CD1-CB 3.48Å; S888-A892 WeakPolarHBondContact O-CB 3.26Å; S888-A892 PolarHBondContact O-N 3.12Å; F889-A892 PolarHBondContact O-N 3.39Å; R890-A892 VanDerWaalsContact C-N 3.34Å; R890-A892 PolarHBondContact O-N 2.93Å; A892-N895 WeakPolarHBondContact O-CB 3.4Å; A892-N895 PolarHBondContact O-N 2.61Å; A892-L896 WeakPolarHBondContact O-CG 3.31Å; A892-L896 PolarHBondContact O-N 2.69Å
893	L	91.1	Very high	87.1	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-67.1	-39.4	179.3	-176.7	65.9	0	0	0	112.5	F709 F715 L880 F889 R890 N895 L896 H897 I907	F709-L893 HydrophobicContact CD1-CD1 4.34Å; F709-L893 HydrophobicContact CE1-CD1 4.21Å; F715-L893 HydrophobicContact CE2-CD1 4.43Å; F715-L893 HydrophobicContact CZ-CB 4.4Å; F715-L893 HydrophobicContact CZ-CD1 4.05Å; L880-L893 HydrophobicContact CD1-CD2 4.14Å; F889-L893 HydrophobicContact CE1-CB 4.32Å; F889-L893 HydrophobicContact CE1-CD2 3.89Å; F889-L893 HydrophobicContact CZ-CD2 4.36Å; F889-L893 VanDerWaalsContact O-CB 3.29Å; F889-L893 WeakPolarHBondContact O-CB 3.27Å; F889-L893 PolarHBondContact O-N 2.99Å; R890-L893 PolarHBondContact O-N 3.03Å; R890-L893 VanDerWaalsContact O-N 3.15Å; L893-N895 VanDerWaalsContact C-N 3.34Å; L893-L896 PolarHBondContact O-N 3.25Å; L893-H897 VanDerWaalsContact CG-CE1 3.49Å; L893-H897 WeakPolarHBondContact CG-CE1 3.42Å; L893-H897 VanDerWaalsContact O-CG 3.26Å; L893-H897 PolarHBondContact O-N 3.01Å; L893-H897 PolarHBondContact O-ND1 3.36Å; L893-I907 HydrophobicContact CD1-CB 4.06Å; L893-I907 HydrophobicContact CD1-CD1 4.24Å; L893-I907 HydrophobicContact CD1-CG2 3.74Å; L893-I907 HydrophobicContact CD2-CG2 4Å; L893-I907 HydrophobicContact CG-CG2 4.45Å
894	D	88.6	Confident	86.4	Confident	77 Å²	77	79.4 Å²	79.4	41%	0.412	41%	0.412	S	S	.	.	H	α-helix	trans	-65.6	-37	176.3	-72.9	-26.8	0	0	0	110.8	R890 H897 A898	R890-D894 WeakPolarHBondContact CG-OD2 3.44Å; R890-D894 IonicContact NE-OD2 2.88Å; R890-D894 WeakPolarHBondContact O-CB 3.44Å; R890-D894 PolarHBondContact O-N 3.31Å; D894-H897 PolarHBondContact O-N 3.19Å; D894-H897 IonicContact OD1-ND1 3.7Å; D894-A898 WeakPolarHBondContact O-CB 3.32Å; D894-A898 PolarHBondContact O-N 3.05Å
895	N	88.2	Confident	86	Confident	118 Å²	118	80.9 Å²	80.9	63%	0.631	42%	0.416	S	S	*	.	H	α-helix	trans	-62.8	-43.4	169.2	-70.8	-26.6	0	0	0	112.3	S891 A892 L893 H897 A898 H899	S891-N895 VanDerWaalsContact O-CG 3.24Å; S891-N895 PolarHBondContact O-N 3.3Å; S891-N895 PolarHBondContact O-ND2 2.95Å; A892-N895 WeakPolarHBondContact O-CB 3.4Å; A892-N895 PolarHBondContact O-N 2.61Å; L893-N895 VanDerWaalsContact C-N 3.34Å; N895-H897 VanDerWaalsContact C-N 3.34Å; N895-H897 PolarHBondContact O-N 2.98Å; N895-A898 PolarHBondContact O-N 2.85Å; N895-H899 PolarHBondContact O-N 3.15Å
896	L	88.9	Confident	86	Confident	16 Å²	16	77.7 Å²	77.7	8%	0.084	41%	0.41	C	S	.	.	H	α-helix	trans	-66.5	-34.6	177	-67.3	167.4	0	0	0	112	H708 F709 A712 F715 A892 L893 S902	H708-L896 PolarHBondContact NE2-O 3.49Å; F709-L896 HydrophobicContact CD1-CB 4.24Å; F709-L896 HydrophobicContact CD1-CD1 4.35Å; F709-L896 HydrophobicContact CE1-CB 3.97Å; A712-L896 HydrophobicContact CB-CD1 3.72Å; A712-L896 HydrophobicContact CB-CD2 3.8Å; A712-L896 HydrophobicContact CB-CG 4.44Å; F715-L896 HydrophobicContact CD2-CD1 4.4Å; F715-L896 HydrophobicContact CE1-CD1 4.16Å; F715-L896 HydrophobicContact CE2-CD1 3.86Å; F715-L896 HydrophobicContact CZ-CD1 3.71Å; A892-L896 WeakPolarHBondContact O-CG 3.31Å; A892-L896 PolarHBondContact O-N 2.69Å; L893-L896 PolarHBondContact O-N 3.25Å; L896-S902 PolarHBondContact O-OG 3.01Å
897	H	90.7	Very high	86	Confident	39 Å²	39	73.3 Å²	73.3	18%	0.181	39%	0.394	C	S	.	.	H	α-helix	trans	-68.3	-35.5	173	-68.4	159.6	0	0	0	112.9	F709 L893 D894 N895 H899 M906 I907	F709-H897 AromaticContact CE1-CD2 3.9Å; L893-H897 VanDerWaalsContact CG-CE1 3.49Å; L893-H897 WeakPolarHBondContact CG-CE1 3.42Å; L893-H897 VanDerWaalsContact O-CG 3.26Å; L893-H897 PolarHBondContact O-N 3.01Å; L893-H897 PolarHBondContact O-ND1 3.36Å; D894-H897 PolarHBondContact O-N 3.19Å; D894-H897 IonicContact OD1-ND1 3.7Å; N895-H897 VanDerWaalsContact C-N 3.34Å; N895-H897 PolarHBondContact O-N 2.98Å; H897-H899 VanDerWaalsContact C-N 3.27Å; H897-H899 PolarHBondContact O-N 2.86Å; H897-M906 WeakPolarHBondContact NE2-CA 3.49Å; H897-I907 PolarHBondContact NE2-N 3.34Å
898	A	86	Confident	86.1	Confident	83 Å²	83	70.7 Å²	70.7	69%	0.686	38%	0.38	S	S	*	.	H	α-helix	trans	-69	-23.7	177.9	0	0	0	0	0	113.4	D894 N895	D894-A898 WeakPolarHBondContact O-CB 3.32Å; D894-A898 PolarHBondContact O-N 3.05Å; N895-A898 PolarHBondContact O-N 2.85Å
899	H	84.9	Confident	86.2	Confident	77 Å²	77	69.4 Å²	69.4	36%	0.356	37%	0.371	S	S	.	.	S	Bend	trans	-68.8	134.1	-177.5	-169	-108.2	0	0	0	112.5	H708 N895 H897 R901 S902	H708-H899 VanDerWaalsContact CE1-CB 3.45Å; H708-H899 WeakPolarHBondContact CE1-CB 3.32Å; H708-H899 AromaticContact CE1-CG 3.43Å; H708-H899 VanDerWaalsContact CE1-CG 3.43Å; H708-H899 AromaticContact CE1-ND1 3.07Å; H708-H899 PolarHBondContact CE1-ND1 3.23Å; H708-H899 AromaticContact ND1-ND1 3.37Å; H708-H899 PolarHBondContact ND1-ND1 3.35Å; H708-H899 AromaticContact NE2-ND1 3.97Å; N895-H899 PolarHBondContact O-N 3.15Å; H897-H899 VanDerWaalsContact C-N 3.27Å; H897-H899 PolarHBondContact O-N 2.86Å; H899-R901 PolarHBondContact O-N 3.28Å; H899-S902 WeakPolarHBondContact O-CB 3.47Å; H899-S902 PolarHBondContact O-N 3.49Å
900	P	82.1	Confident	86.3	Confident	113 Å²	113	70 Å²	70	73%	0.734	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-55.6	-30.6	-173.3	-29.9	36.3	0	0	0	115.9	S902 G903	P900-S902 PolarHBondContact O-N 3.39Å; P900-G903 PolarHBondContact O-N 3.14Å
901	R	79.4	Confident	86.5	Confident	168 Å²	168	63.7 Å²	63.7	63%	0.634	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-58.8	-26.6	176.8	-69.1	-178.7	-177.7	156.3	-2	113.4	V704 H899 G903	V704-R901 WeakPolarHBondContact CG1-O 3.4Å; H899-R901 PolarHBondContact O-N 3.28Å; R901-G903 PolarHBondContact O-N 3Å
902	S	75.4	Confident	86.7	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-69.6	-13	175.1	-64.2	0	0	0	0	113	H708 F709 L896 H899 P900 K904 N905	H708-S902 PolarHBondContact CD2-OG 3.41Å; H708-S902 VanDerWaalsContact CD2-OG 3.23Å; H708-S902 PolarHBondContact NE2-OG 2.79Å; F709-S902 WeakPolarHBondContact CZ-OG 3.46Å; L896-S902 PolarHBondContact O-OG 3.01Å; H899-S902 WeakPolarHBondContact O-CB 3.47Å; H899-S902 PolarHBondContact O-N 3.49Å; P900-S902 PolarHBondContact O-N 3.39Å; S902-K904 PolarHBondContact O-N 3.27Å; S902-K904 VanDerWaalsContact O-N 3.17Å; S902-N905 WeakPolarHBondContact O-CB 3.47Å; S902-N905 PolarHBondContact O-N 3.03Å
903	G	72.9	Confident	87	Confident	48 Å²	48	62.4 Å²	62.4	50%	0.495	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.3	29.9	173.1	0	0	0	0	0	114.3	P900 R901 N905	P900-G903 PolarHBondContact O-N 3.14Å; R901-G903 PolarHBondContact O-N 3Å; G903-N905 PolarHBondContact O-N 2.8Å; G903-N905 PolarHBondContact O-ND2 2.85Å
904	K	76.1	Confident	87.1	Confident	214 Å²	214	62.2 Å²	62.2	93%	0.93	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	10.2	-170.2	-49.1	-179.3	-177.8	-177.9	0	115.1	S902	S902-K904 PolarHBondContact O-N 3.27Å; S902-K904 VanDerWaalsContact O-N 3.17Å
905	N	82.9	Confident	87.3	Confident	78 Å²	78	60.4 Å²	60.4	42%	0.417	33%	0.328	S	S	.	.			trans	-88.8	149.5	173.3	-73.8	-75.1	0	0	0	111.7	S902 G903 S909 F910	S902-N905 WeakPolarHBondContact O-CB 3.47Å; S902-N905 PolarHBondContact O-N 3.03Å; G903-N905 PolarHBondContact O-N 2.8Å; G903-N905 PolarHBondContact O-ND2 2.85Å; N905-S909 PolarHBondContact OD1-OG 2.66Å; N905-F910 HydrophobicContact CB-CD2 4.17Å; N905-F910 HydrophobicContact CB-CE2 3.44Å; N905-F910 VanDerWaalsContact CB-CE2 3.44Å; N905-F910 HydrophobicContact CB-CZ 3.79Å
906	M	89.2	Confident	87.7	Confident	109 Å²	109	60 Å²	60	54%	0.537	32%	0.322	S	S	.	.			trans	-93.1	155.5	172.7	-66.1	174.8	-78.2	0	0	110.5	H897 N908 S909 F910	H897-M906 WeakPolarHBondContact NE2-CA 3.49Å; M906-N908 PolarHBondContact O-N 2.89Å; M906-S909 PolarHBondContact O-N 2.91Å; M906-S909 PolarHBondContact O-OG 3.36Å; M906-F910 WeakPolarHBondContact O-CD2 3.39Å
907	I	91	Very high	88	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-50.5	-32.2	175.2	-165.9	172.9	0	0	0	113.1	F709 F715 L818 F819 L880 L893 H897 S909 F910 L911	F709-I907 HydrophobicContact CB-CD1 4.23Å; F709-I907 HydrophobicContact CD1-CB 4.12Å; F709-I907 HydrophobicContact CD1-CD1 3.92Å; F709-I907 HydrophobicContact CD1-CG1 4.07Å; F709-I907 HydrophobicContact CE1-CB 3.98Å; F709-I907 HydrophobicContact CE1-CG1 4.43Å; F709-I907 HydrophobicContact CG-CD1 4.26Å; F709-I907 HydrophobicContact CG-CG1 4.3Å; F709-I907 HydrophobicContact CZ-CB 4.45Å; F715-I907 HydrophobicContact CE2-CD1 4.3Å; L818-I907 HydrophobicContact CD2-CD1 4.42Å; F819-I907 HydrophobicContact CE1-CD1 4.11Å; F819-I907 HydrophobicContact CZ-CD1 4.07Å; L880-I907 HydrophobicContact CD1-CG2 3.96Å; L880-I907 HydrophobicContact CD2-CG2 3.74Å; L893-I907 HydrophobicContact CD1-CB 4.06Å; L893-I907 HydrophobicContact CD1-CD1 4.24Å; L893-I907 HydrophobicContact CD1-CG2 3.74Å; L893-I907 HydrophobicContact CD2-CG2 4Å; L893-I907 HydrophobicContact CG-CG2 4.45Å; H897-I907 PolarHBondContact NE2-N 3.34Å; I907-S909 PolarHBondContact O-N 2.95Å; I907-F910 PolarHBondContact O-N 3.07Å; I907-L911 HydrophobicContact CG1-CD1 4.14Å; I907-L911 HydrophobicContact CG1-CG 4.22Å; I907-L911 WeakPolarHBondContact O-CG 3.49Å; I907-L911 PolarHBondContact O-N 3.42Å
908	N	91.2	Very high	88.2	Confident	61 Å²	61	57.8 Å²	57.8	33%	0.326	31%	0.311	S	S	.	.	H	α-helix	trans	-55.8	-42.3	174.4	-71.7	-77.5	0	0	0	113.8	M877 L880 M906 A912	M877-N908 WeakPolarHBondContact CE-OD1 3.38Å; L880-N908 WeakPolarHBondContact CD2-OD1 3.35Å; M906-N908 PolarHBondContact O-N 2.89Å; N908-A912 PolarHBondContact O-N 2.77Å
909	S	91.2	Very high	88.7	Confident	41 Å²	41	56.7 Å²	56.7	29%	0.287	30%	0.296	S	S	.	.	H	α-helix	trans	-76.2	-33	-180	51	0	0	0	0	111.7	N905 M906 I907 A912	N905-S909 PolarHBondContact OD1-OG 2.66Å; M906-S909 PolarHBondContact O-N 2.91Å; M906-S909 PolarHBondContact O-OG 3.36Å; I907-S909 PolarHBondContact O-N 2.95Å; S909-A912 PolarHBondContact O-N 2.99Å
910	F	94	Very high	89.2	Confident	13 Å²	13	57.3 Å²	57.3	6%	0.057	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-46.1	172.4	-69.8	-77.5	0	0	0	112.6	S701 V704 L705 F709 N905 M906 I907 A912 L913	S701-F910 WeakPolarHBondContact O-CD1 3.22Å; V704-F910 HydrophobicContact CB-CE1 3.84Å; V704-F910 HydrophobicContact CB-CZ 4.25Å; V704-F910 HydrophobicContact CG1-CD1 4.47Å; V704-F910 HydrophobicContact CG1-CE1 3.62Å; V704-F910 HydrophobicContact CG1-CE2 4.31Å; V704-F910 HydrophobicContact CG1-CZ 3.53Å; L705-F910 HydrophobicContact CB-CB 4.15Å; L705-F910 HydrophobicContact CB-CD1 4.39Å; L705-F910 HydrophobicContact CD1-CB 3.87Å; L705-F910 HydrophobicContact CD2-CB 4.3Å; L705-F910 HydrophobicContact CG-CB 4.32Å; F709-F910 AromaticContact CE2-CD2 3.76Å; F709-F910 HydrophobicContact CE2-CD2 3.76Å; F709-F910 AromaticContact CE2-CE2 3.72Å; F709-F910 HydrophobicContact CE2-CE2 3.72Å; F709-F910 HydrophobicContact CE2-CZ 4.44Å; F709-F910 HydrophobicContact CZ-CD2 4.26Å; F709-F910 HydrophobicContact CZ-CE2 4.17Å; N905-F910 HydrophobicContact CB-CD2 4.17Å; N905-F910 HydrophobicContact CB-CE2 3.44Å; N905-F910 VanDerWaalsContact CB-CE2 3.44Å; N905-F910 HydrophobicContact CB-CZ 3.79Å; M906-F910 WeakPolarHBondContact O-CD2 3.39Å; I907-F910 PolarHBondContact O-N 3.07Å; F910-A912 PolarHBondContact O-N 3.04Å; F910-L913 HydrophobicContact CB-CD1 4.37Å; F910-L913 HydrophobicContact CD1-CD1 3.87Å; F910-L913 WeakPolarHBondContact O-CB 3.39Å; F910-L913 WeakPolarHBondContact O-CD1 3.45Å; F910-L913 VanDerWaalsContact O-CG 3.26Å; F910-L913 WeakPolarHBondContact O-CG 3.43Å; F910-L913 PolarHBondContact O-N 3.01Å; F910-L913 VanDerWaalsContact O-N 3.08Å
911	L	94.1	Very high	90	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-24.5	179	-70.3	172.2	0	0	0	113.2	L705 L818 F819 Y869 L880 I907	L705-L911 HydrophobicContact CD1-CD2 4.16Å; L705-L911 HydrophobicContact CD2-CD2 4.4Å; L818-L911 HydrophobicContact CD1-CD1 3.86Å; L818-L911 WeakPolarHBondContact O-CD2 3.17Å; F819-L911 HydrophobicContact CD1-CD2 4.08Å; Y869-L911 WeakPolarHBondContact CE1-O 3.21Å; Y869-L911 WeakPolarHBondContact OH-CA 3.29Å; Y869-L911 PolarHBondContact OH-O 2.79Å; L880-L911 HydrophobicContact CD2-CD1 4.06Å; I907-L911 HydrophobicContact CG1-CD1 4.14Å; I907-L911 HydrophobicContact CG1-CG 4.22Å; I907-L911 WeakPolarHBondContact O-CG 3.49Å; I907-L911 PolarHBondContact O-N 3.42Å
912	A	93.8	Very high	90.8	Very high	23 Å²	23	46.7 Å²	46.7	19%	0.19	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-13.5	176.7	0	0	0	0	0	114.4	N908 S909 F910 M915 Q916	N908-A912 PolarHBondContact O-N 2.77Å; S909-A912 PolarHBondContact O-N 2.99Å; F910-A912 PolarHBondContact O-N 3.04Å; A912-M915 PolarHBondContact O-N 3.43Å; A912-Q916 PolarHBondContact O-N 3.39Å
913	L	94.5	Very high	91.8	Very high	27 Å²	27	49.8 Å²	49.8	14%	0.141	26%	0.259	C	S	.	.	H	α-helix	trans	-56.2	-40.7	-171.6	-67.9	169.8	0	0	0	114.4	Y698 F910 M915 Q916 R917	Y698-L913 HydrophobicContact CD2-CB 4.15Å; Y698-L913 HydrophobicContact CE2-CB 3.76Å; F910-L913 HydrophobicContact CB-CD1 4.37Å; F910-L913 HydrophobicContact CD1-CD1 3.87Å; F910-L913 WeakPolarHBondContact O-CB 3.39Å; F910-L913 WeakPolarHBondContact O-CD1 3.45Å; F910-L913 VanDerWaalsContact O-CG 3.26Å; F910-L913 WeakPolarHBondContact O-CG 3.43Å; F910-L913 PolarHBondContact O-N 3.01Å; F910-L913 VanDerWaalsContact O-N 3.08Å; L913-M915 VanDerWaalsContact C-N 3.35Å; L913-M915 PolarHBondContact O-N 3.16Å; L913-Q916 PolarHBondContact O-N 2.95Å; L913-R917 WeakPolarHBondContact O-CB 3.34Å; L913-R917 PolarHBondContact O-N 2.96Å
914	P	94.6	Very high	93	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-35.8	-178.5	-27.1	38.7	0	0	0	114.3	V825 Y866 Y869 L870 R917 L918	V825-P914 HydrophobicContact CG1-CB 4.22Å; V825-P914 HydrophobicContact CG1-CG 4.1Å; Y866-P914 HydrophobicContact CD1-CB 3.91Å; Y866-P914 HydrophobicContact CE1-CB 4.14Å; Y869-P914 HydrophobicContact CD1-CB 3.95Å; Y869-P914 HydrophobicContact CD1-CG 3.85Å; Y869-P914 HydrophobicContact CE1-CB 4.08Å; Y869-P914 HydrophobicContact CE1-CG 3.57Å; Y869-P914 HydrophobicContact CG-CG 4.46Å; L870-P914 HydrophobicContact CD2-CB 4.45Å; P914-R917 PolarHBondContact O-N 2.92Å; P914-L918 PolarHBondContact O-N 3.46Å
915	M	93.3	Very high	94	Very high	40 Å²	40	37.8 Å²	37.8	20%	0.197	19%	0.193	C	C	.	.	H	α-helix	trans	-68.4	-42.4	175.1	-174.7	56.8	97	0	0	111	L870 A912 L913 R917 T919 L971	L870-M915 HydrophobicContact CD1-CE 4.11Å; L870-M915 HydrophobicContact CD1-SD 4.02Å; L870-M915 HydrophobicContact CD2-CB 3.66Å; L870-M915 HydrophobicContact CD2-CE 4.13Å; L870-M915 HydrophobicContact CD2-CG 4.47Å; L870-M915 HydrophobicContact CD2-SD 4.37Å; A912-M915 PolarHBondContact O-N 3.43Å; L913-M915 VanDerWaalsContact C-N 3.35Å; L913-M915 PolarHBondContact O-N 3.16Å; M915-R917 VanDerWaalsContact C-N 3.33Å; M915-R917 PolarHBondContact O-N 3.43Å; M915-T919 WeakPolarHBondContact O-CB 3.3Å; M915-T919 PolarHBondContact O-N 3.2Å; M915-T919 VanDerWaalsContact O-N 3.14Å; M915-T919 PolarHBondContact O-OG1 3.45Å; M915-L971 HydrophobicContact SD-CD2 4.36Å
916	Q	94.8	Very high	94.7	Very high	108 Å²	108	36 Å²	36	51%	0.505	18%	0.182	S	C	.	.	H	α-helix	trans	-63.7	-39.4	176.9	-63.7	176	1.8	0	0	111.2	A912 L913 R920	A912-Q916 PolarHBondContact O-N 3.39Å; L913-Q916 PolarHBondContact O-N 2.95Å; Q916-R920 WeakPolarHBondContact O-CB 3.26Å; Q916-R920 PolarHBondContact O-N 3.14Å
917	R	96.1	Very high	95.1	Very high	7 Å²	7	33 Å²	33	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-51	179.3	178.8	62.3	-170.2	139.9	-16.6	112.2	V691 E695 Y698 L913 P914 M915 T919 R920 L921	V691-R917 PolarHBondContact O-NH2 3.49Å; E695-R917 IonicContact OE2-CZ 3.61Å; E695-R917 IonicContact OE2-NE 2.8Å; E695-R917 PolarHBondContact OE2-NE 2.73Å; E695-R917 IonicContact OE2-NH2 3.66Å; E695-R917 PolarHBondContact OE2-NH2 3.01Å; Y698-R917 HydrophobicContact CD1-CB 4.29Å; Y698-R917 HydrophobicContact CD1-CG 3.72Å; Y698-R917 HydrophobicContact CD2-CB 3.8Å; Y698-R917 HydrophobicContact CD2-CG 4.13Å; Y698-R917 HydrophobicContact CE1-CB 4.08Å; Y698-R917 HydrophobicContact CE1-CG 3.65Å; Y698-R917 HydrophobicContact CE2-CB 3.56Å; Y698-R917 HydrophobicContact CE2-CG 4.07Å; Y698-R917 HydrophobicContact CG-CB 4.16Å; Y698-R917 HydrophobicContact CG-CG 3.95Å; L913-R917 WeakPolarHBondContact O-CB 3.34Å; L913-R917 PolarHBondContact O-N 2.96Å; P914-R917 PolarHBondContact O-N 2.92Å; M915-R917 VanDerWaalsContact C-N 3.33Å; M915-R917 PolarHBondContact O-N 3.43Å; R917-T919 VanDerWaalsContact C-N 3.34Å; R917-T919 PolarHBondContact O-N 3.43Å; R917-R920 PolarHBondContact O-N 3.06Å; R917-L921 PolarHBondContact O-N 2.9Å
918	L	95.3	Very high	95.4	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-41.1	-178.3	-171.5	65.1	0	0	0	111.4	L870 P914 L921 K922 L967 L970 L971	L870-L918 HydrophobicContact CD1-CD2 4.45Å; P914-L918 PolarHBondContact O-N 3.46Å; L918-L921 PolarHBondContact O-N 3.43Å; L918-K922 PolarHBondContact O-N 3.26Å; L918-L967 HydrophobicContact CD1-CD2 3.7Å; L918-L970 HydrophobicContact CD1-CB 4.09Å; L918-L970 HydrophobicContact CD1-CD1 3.96Å; L918-L970 HydrophobicContact CD2-CB 3.89Å; L918-L971 HydrophobicContact CB-CD2 4.27Å; L918-L971 HydrophobicContact CD2-CD2 3.7Å; L918-L971 HydrophobicContact CD2-CG 3.83Å; L918-L971 HydrophobicContact CG-CD2 3.81Å; L918-L971 HydrophobicContact CG-CG 3.89Å
919	T	95.5	Very high	95.7	Very high	59 Å²	59	34.8 Å²	34.8	36%	0.362	17%	0.172	S	C	.	.	H	α-helix	trans	-62	-43.1	172.7	-54	0	0	0	0	111.8	M915 R917 K922 L923	M915-T919 WeakPolarHBondContact O-CB 3.3Å; M915-T919 PolarHBondContact O-N 3.2Å; M915-T919 VanDerWaalsContact O-N 3.14Å; M915-T919 PolarHBondContact O-OG1 3.45Å; R917-T919 VanDerWaalsContact C-N 3.34Å; R917-T919 PolarHBondContact O-N 3.43Å; T919-K922 PolarHBondContact O-N 3.37Å; T919-L923 PolarHBondContact O-N 2.87Å
920	R	96.6	Very high	96	Very high	91 Å²	91	38.7 Å²	38.7	34%	0.343	18%	0.181	S	C	.	.	H	α-helix	trans	-67.7	-37	178.5	179.4	171.5	164.5	84.9	2.3	112.6	E690 S694 Q916 R917 K922 L923 L924	E690-R920 VanDerWaalsContact CD-NH2 3.33Å; E690-R920 IonicContact OE1-CZ 3.5Å; E690-R920 VanDerWaalsContact OE1-CZ 3.3Å; E690-R920 IonicContact OE1-NH1 3.54Å; E690-R920 PolarHBondContact OE1-NH1 3.22Å; E690-R920 VanDerWaalsContact OE1-NH1 3.07Å; E690-R920 IonicContact OE1-NH2 2.69Å; E690-R920 PolarHBondContact OE1-NH2 3.22Å; S694-R920 PolarHBondContact OG-NE 2.98Å; S694-R920 VanDerWaalsContact OG-NE 3.14Å; S694-R920 PolarHBondContact OG-NH2 3.18Å; S694-R920 VanDerWaalsContact OG-NH2 3.12Å; Q916-R920 WeakPolarHBondContact O-CB 3.26Å; Q916-R920 PolarHBondContact O-N 3.14Å; R917-R920 PolarHBondContact O-N 3.06Å; R920-K922 PolarHBondContact O-N 2.84Å; R920-L923 PolarHBondContact O-N 3.4Å; R920-L924 HydrophobicContact CG-CD1 4.07Å; R920-L924 HydrophobicContact CG-CG 4.35Å; R920-L924 WeakPolarHBondContact O-CG 3.41Å; R920-L924 PolarHBondContact O-N 2.75Å
921	L	97.2	Very high	96.1	Very high	3 Å²	3	39 Å²	39	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-55.7	-50.9	172.7	-85.4	174.2	0	0	0	110.9	V691 F832 I854 F863 R917 L918 L923 L924 V925 L967	V691-L921 HydrophobicContact CG1-CD2 4.3Å; F832-L921 HydrophobicContact CE1-CD2 4.17Å; F832-L921 HydrophobicContact CZ-CD2 4.43Å; I854-L921 HydrophobicContact CD1-CD2 4.24Å; F863-L921 HydrophobicContact CE2-CD1 3.89Å; F863-L921 HydrophobicContact CZ-CD1 4.26Å; R917-L921 PolarHBondContact O-N 2.9Å; L918-L921 PolarHBondContact O-N 3.43Å; L921-L923 VanDerWaalsContact C-N 3.34Å; L921-L923 PolarHBondContact O-N 3.45Å; L921-L924 PolarHBondContact O-N 2.64Å; L921-V925 WeakPolarHBondContact O-CG2 3.48Å; L921-V925 PolarHBondContact O-N 2.57Å; L921-L967 HydrophobicContact CB-CD1 3.9Å; L921-L967 HydrophobicContact CB-CD2 3.8Å; L921-L967 HydrophobicContact CD1-CD2 3.92Å; L921-L967 HydrophobicContact CG-CD2 4.48Å
922	K	97.1	Very high	96.2	Very high	55 Å²	55	39.4 Å²	39.4	24%	0.239	19%	0.185	C	C	.	.	H	α-helix	trans	-55.9	-47.2	177.9	174.5	178.2	168.1	175.9	0	111.9	L918 T919 R920 L924 V925 E926 L964 L967 N968 L971	L918-K922 PolarHBondContact O-N 3.26Å; T919-K922 PolarHBondContact O-N 3.37Å; R920-K922 PolarHBondContact O-N 2.84Å; K922-L924 PolarHBondContact O-N 2.62Å; K922-V925 PolarHBondContact O-N 3.27Å; K922-E926 VanDerWaalsContact CE-OE1 3.26Å; K922-E926 WeakPolarHBondContact CE-OE1 3.36Å; K922-E926 WeakPolarHBondContact O-CG 3.42Å; K922-E926 PolarHBondContact O-N 3.24Å; K922-L964 HydrophobicContact CG-CD2 4.26Å; K922-L967 HydrophobicContact CB-CB 4.43Å; K922-N968 WeakPolarHBondContact CE-OD1 3.35Å; K922-N968 PolarHBondContact NZ-OD1 3.27Å; K922-L971 HydrophobicContact CB-CD1 4.37Å; K922-L971 HydrophobicContact CD-CD1 3.81Å
923	L	97.3	Very high	96.2	Very high	65 Å²	65	40.5 Å²	40.5	34%	0.34	19%	0.187	S	C	.	.	H	α-helix	trans	-63.1	-38.4	179.8	-68.8	173.4	0	0	0	112.9	T919 R920 L921 E926 V927	T919-L923 PolarHBondContact O-N 2.87Å; R920-L923 PolarHBondContact O-N 3.4Å; L921-L923 VanDerWaalsContact C-N 3.34Å; L921-L923 PolarHBondContact O-N 3.45Å; L923-E926 PolarHBondContact O-N 3.32Å; L923-V927 WeakPolarHBondContact O-CG2 3.32Å; L923-V927 PolarHBondContact O-N 2.95Å; L923-V927 VanDerWaalsContact O-N 3.11Å
924	L	97.3	Very high	96.2	Very high	9 Å²	9	39.3 Å²	39.3	5%	0.047	18%	0.182	C	C	.	.	H	α-helix	trans	-67.8	-42.5	176.1	-68.3	172.2	0	0	0	111.7	E690 V691 R920 L921 K922 E926 V927 I928	E690-L924 HydrophobicContact CB-CD2 4.21Å; E690-L924 VanDerWaalsContact CD-CD2 3.47Å; E690-L924 HydrophobicContact CG-CD1 4.45Å; E690-L924 HydrophobicContact CG-CD2 3.77Å; E690-L924 WeakPolarHBondContact OE2-CD2 3.49Å; V691-L924 HydrophobicContact CG2-CB 4.02Å; V691-L924 HydrophobicContact CG2-CD1 4.05Å; R920-L924 HydrophobicContact CG-CD1 4.07Å; R920-L924 HydrophobicContact CG-CG 4.35Å; R920-L924 WeakPolarHBondContact O-CG 3.41Å; R920-L924 PolarHBondContact O-N 2.75Å; L921-L924 PolarHBondContact O-N 2.64Å; K922-L924 PolarHBondContact O-N 2.62Å; L924-E926 VanDerWaalsContact C-N 3.34Å; L924-E926 PolarHBondContact O-N 3.09Å; L924-V927 WeakPolarHBondContact O-CB 3.46Å; L924-V927 PolarHBondContact O-N 3.29Å; L924-V927 VanDerWaalsContact O-N 3.12Å; L924-I928 WeakPolarHBondContact O-CG1 3.12Å; L924-I928 PolarHBondContact O-N 3.45Å
925	V	97.7	Very high	96.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-35.7	175.8	-177.1	0	0	0	0	111.5	I854 L921 K922 V927 I928 R929 V960 A963 L964 L967	I854-V925 HydrophobicContact CD1-CG2 3.5Å; L921-V925 WeakPolarHBondContact O-CG2 3.48Å; L921-V925 PolarHBondContact O-N 2.57Å; K922-V925 PolarHBondContact O-N 3.27Å; V925-V927 VanDerWaalsContact C-N 3.3Å; V925-V927 PolarHBondContact O-N 3.28Å; V925-I928 PolarHBondContact O-N 3.42Å; V925-R929 PolarHBondContact O-N 3.13Å; V925-V960 HydrophobicContact CG1-CG1 4.07Å; V925-A963 HydrophobicContact CG1-CB 4.02Å; V925-A963 HydrophobicContact CG2-CB 4.45Å; V925-L964 HydrophobicContact CB-CD2 3.97Å; V925-L964 HydrophobicContact CB-CG 4.35Å; V925-L964 HydrophobicContact CG1-CD1 4.42Å; V925-L964 HydrophobicContact CG1-CD2 3.89Å; V925-L964 HydrophobicContact CG1-CG 3.7Å; V925-L967 HydrophobicContact CG2-CD1 3.96Å
926	E	97.5	Very high	96.2	Very high	41 Å²	41	38.6 Å²	38.6	19%	0.192	18%	0.18	C	C	.	.	H	α-helix	trans	-62.2	-35.2	170.9	-77.3	-174	-152.4	0	0	113	K922 L923 L924 R930 L964	K922-E926 VanDerWaalsContact CE-OE1 3.26Å; K922-E926 WeakPolarHBondContact CE-OE1 3.36Å; K922-E926 WeakPolarHBondContact O-CG 3.42Å; K922-E926 PolarHBondContact O-N 3.24Å; L923-E926 PolarHBondContact O-N 3.32Å; L924-E926 VanDerWaalsContact C-N 3.34Å; L924-E926 PolarHBondContact O-N 3.09Å; E926-R930 VanDerWaalsContact O-CG 3.27Å; E926-R930 WeakPolarHBondContact O-CG 3.48Å; E926-R930 PolarHBondContact O-N 2.8Å; E926-R930 IonicContact OE2-CZ 3.05Å; E926-R930 IonicContact OE2-NH1 3.85Å; E926-R930 IonicContact OE2-NH2 2.62Å; E926-R930 PolarHBondContact OE2-NH2 3.32Å; E926-L964 HydrophobicContact CG-CD2 3.83Å
927	V	97.4	Very high	96.1	Very high	47 Å²	47	40.4 Å²	40.4	29%	0.285	18%	0.182	S	C	.	.	H	α-helix	trans	-70.7	-47.3	174.8	168.1	0	0	0	0	110.6	A687 L923 L924 V925 R929 R930 L931	A687-V927 HydrophobicContact CB-CG1 4.01Å; L923-V927 WeakPolarHBondContact O-CG2 3.32Å; L923-V927 PolarHBondContact O-N 2.95Å; L923-V927 VanDerWaalsContact O-N 3.11Å; L924-V927 WeakPolarHBondContact O-CB 3.46Å; L924-V927 PolarHBondContact O-N 3.29Å; L924-V927 VanDerWaalsContact O-N 3.12Å; V925-V927 VanDerWaalsContact C-N 3.3Å; V925-V927 PolarHBondContact O-N 3.28Å; V927-R929 VanDerWaalsContact C-N 3.29Å; V927-R929 PolarHBondContact O-N 3.19Å; V927-R930 PolarHBondContact O-N 3.18Å; V927-R930 VanDerWaalsContact O-N 3.15Å; V927-L931 HydrophobicContact CG1-CD1 3.64Å; V927-L931 HydrophobicContact CG1-CG 4.4Å; V927-L931 WeakPolarHBondContact O-CG 3.39Å; V927-L931 PolarHBondContact O-N 3.03Å
928	I	97.4	Very high	95.9	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-53.6	-46.2	174.3	-70.6	167	0	0	0	110.5	L684 A687 M688 V691 V850 L924 V925 R930 L931 Q932 V960	L684-I928 HydrophobicContact CD1-CB 4.47Å; L684-I928 HydrophobicContact CD1-CG2 3.96Å; A687-I928 HydrophobicContact CB-CG1 3.98Å; M688-I928 HydrophobicContact CG-CD1 3.98Å; M688-I928 HydrophobicContact CG-CG1 4.22Å; V691-I928 HydrophobicContact CG2-CD1 3.94Å; V850-I928 HydrophobicContact CG2-CD1 4.03Å; L924-I928 WeakPolarHBondContact O-CG1 3.12Å; L924-I928 PolarHBondContact O-N 3.45Å; V925-I928 PolarHBondContact O-N 3.42Å; I928-R930 PolarHBondContact O-N 3.38Å; I928-L931 PolarHBondContact O-N 3.1Å; I928-Q932 HydrophobicContact CG2-CG 4.4Å; I928-Q932 WeakPolarHBondContact O-CG 3.35Å; I928-Q932 PolarHBondContact O-N 3.08Å; I928-V960 HydrophobicContact CG2-CG2 3.9Å
929	R	97.1	Very high	95.6	Very high	97 Å²	97	43 Å²	43	37%	0.366	20%	0.2	S	C	.	.	H	α-helix	trans	-58	-50.6	175.9	-164.6	-178.1	68.4	178.7	0.3	112.6	V925 V927 L931 Q932 D933 V960	V925-R929 PolarHBondContact O-N 3.13Å; V927-R929 VanDerWaalsContact C-N 3.29Å; V927-R929 PolarHBondContact O-N 3.19Å; R929-L931 PolarHBondContact O-N 3.27Å; R929-Q932 PolarHBondContact O-N 3.36Å; R929-D933 WeakPolarHBondContact O-CB 3.42Å; R929-D933 PolarHBondContact O-N 3.28Å; R929-V960 HydrophobicContact CB-CG1 3.48Å; R929-V960 VanDerWaalsContact CB-CG1 3.48Å; R929-V960 HydrophobicContact CG-CG1 3.67Å
930	R	96.9	Very high	95.3	Very high	122 Å²	122	47.8 Å²	47.8	46%	0.46	22%	0.215	S	C	.	.	H	α-helix	trans	-60	-33.1	-179.8	-71.4	169.7	-170.7	121.8	9	112.1	E926 V927 I928 A934	E926-R930 VanDerWaalsContact O-CG 3.27Å; E926-R930 WeakPolarHBondContact O-CG 3.48Å; E926-R930 PolarHBondContact O-N 2.8Å; E926-R930 IonicContact OE2-CZ 3.05Å; E926-R930 IonicContact OE2-NH1 3.85Å; E926-R930 IonicContact OE2-NH2 2.62Å; E926-R930 PolarHBondContact OE2-NH2 3.32Å; V927-R930 PolarHBondContact O-N 3.18Å; V927-R930 VanDerWaalsContact O-N 3.15Å; I928-R930 PolarHBondContact O-N 3.38Å; R930-A934 WeakPolarHBondContact O-CB 3.44Å; R930-A934 PolarHBondContact O-N 3.36Å; R930-A934 VanDerWaalsContact O-N 3.16Å
931	L	96.3	Very high	94.8	Very high	21 Å²	21	46.5 Å²	46.5	11%	0.11	22%	0.215	C	C	.	.	H	α-helix	trans	-79.8	-42.6	178.5	-69	167.6	0	0	0	112.3	Q683 L684 A687 V927 I928 R929 D933 A934 V935	Q683-L931 HydrophobicContact CB-CD1 4.16Å; Q683-L931 HydrophobicContact CB-CD2 3.73Å; Q683-L931 WeakPolarHBondContact O-CD1 3.45Å; L684-L931 HydrophobicContact CB-CB 4.16Å; L684-L931 HydrophobicContact CD1-CB 4.02Å; A687-L931 HydrophobicContact CB-CD1 3.8Å; V927-L931 HydrophobicContact CG1-CD1 3.64Å; V927-L931 HydrophobicContact CG1-CG 4.4Å; V927-L931 WeakPolarHBondContact O-CG 3.39Å; V927-L931 PolarHBondContact O-N 3.03Å; I928-L931 PolarHBondContact O-N 3.1Å; R929-L931 PolarHBondContact O-N 3.27Å; L931-D933 VanDerWaalsContact C-N 3.34Å; L931-D933 PolarHBondContact O-N 2.81Å; L931-A934 WeakPolarHBondContact O-CA 3.37Å; L931-A934 WeakPolarHBondContact O-CB 3.34Å; L931-A934 PolarHBondContact O-N 2.88Å; L931-V935 WeakPolarHBondContact O-CG2 3.45Å; L931-V935 PolarHBondContact O-N 3Å
932	Q	95.8	Very high	94	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.037	25%	0.252	C	S	.	.	H	α-helix	trans	-55.5	-49.8	169.3	-76	-175.9	-18.3	0	0	111	L684 I928 R929 A934 V935 V936 P952 E956	L684-Q932 HydrophobicContact CD1-CG 4.06Å; L684-Q932 HydrophobicContact CD2-CG 4.14Å; I928-Q932 HydrophobicContact CG2-CG 4.4Å; I928-Q932 WeakPolarHBondContact O-CG 3.35Å; I928-Q932 PolarHBondContact O-N 3.08Å; R929-Q932 PolarHBondContact O-N 3.36Å; Q932-A934 PolarHBondContact O-N 3.28Å; Q932-V935 PolarHBondContact O-N 3.09Å; Q932-V936 VanDerWaalsContact O-CG2 3.31Å; Q932-V936 WeakPolarHBondContact O-CG2 3.38Å; Q932-V936 PolarHBondContact O-N 2.79Å; Q932-P952 HydrophobicContact CB-CB 4.34Å; Q932-P952 HydrophobicContact CB-CG 3.95Å; Q932-P952 HydrophobicContact CG-CB 4.04Å; Q932-P952 HydrophobicContact CG-CG 3.8Å; Q932-E956 PolarHBondContact NE2-O 3.5Å; Q932-E956 PolarHBondContact OE1-O 3.15Å
933	D	95.1	Very high	93.2	Very high	46 Å²	46	58 Å²	58	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-23.8	177.1	-70.6	-35.2	0	0	0	112.2	R929 L931 R937 R957	R929-D933 WeakPolarHBondContact O-CB 3.42Å; R929-D933 PolarHBondContact O-N 3.28Å; L931-D933 VanDerWaalsContact C-N 3.34Å; L931-D933 PolarHBondContact O-N 2.81Å; D933-R937 VanDerWaalsContact C-NH1 3.25Å; D933-R937 WeakPolarHBondContact O-CG 3.42Å; D933-R937 PolarHBondContact O-N 2.95Å; D933-R937 PolarHBondContact O-NH1 2.7Å; D933-R957 IonicContact OD1-CZ 3.17Å; D933-R957 IonicContact OD1-NE 2.73Å; D933-R957 IonicContact OD1-NH2 2.73Å; D933-R957 PolarHBondContact OD1-NH2 3.44Å
934	A	94.2	Very high	92.2	Very high	3 Å²	3	57.9 Å²	57.9	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-73.7	-49.4	171.6	0	0	0	0	0	111.8	H680 R930 L931 Q932 V936 R937 D938	H680-A934 HydrophobicContact CB-CB 4.12Å; R930-A934 WeakPolarHBondContact O-CB 3.44Å; R930-A934 PolarHBondContact O-N 3.36Å; R930-A934 VanDerWaalsContact O-N 3.16Å; L931-A934 WeakPolarHBondContact O-CA 3.37Å; L931-A934 WeakPolarHBondContact O-CB 3.34Å; L931-A934 PolarHBondContact O-N 2.88Å; Q932-A934 PolarHBondContact O-N 3.28Å; A934-V936 PolarHBondContact O-N 2.85Å; A934-R937 VanDerWaalsContact CA-NH2 3.35Å; A934-R937 WeakPolarHBondContact O-CA 3.12Å; A934-R937 WeakPolarHBondContact O-CB 3.46Å; A934-R937 PolarHBondContact O-N 2.83Å; A934-D938 PolarHBondContact O-N 2.8Å
935	V	94	Very high	91	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.1	-34.9	174.9	179.4	0	0	0	0	111.6	H680 E681 L684 L931 Q932 R937 S939 P948	H680-V935 HydrophobicContact CB-CG2 3.78Å; E681-V935 HydrophobicContact CG-CG1 4Å; E681-V935 HydrophobicContact CG-CG2 3.87Å; L684-V935 HydrophobicContact CD2-CG2 4.33Å; L931-V935 WeakPolarHBondContact O-CG2 3.45Å; L931-V935 PolarHBondContact O-N 3Å; Q932-V935 PolarHBondContact O-N 3.09Å; V935-R937 VanDerWaalsContact C-N 3.34Å; V935-S939 PolarHBondContact O-N 3.45Å; V935-S939 PolarHBondContact O-OG 2.8Å; V935-P948 HydrophobicContact CG1-CB 3.71Å; V935-P948 HydrophobicContact CG1-CG 3.86Å
936	V	93.8	Very high	90.1	Very high	25 Å²	25	71.6 Å²	71.6	15%	0.152	34%	0.337	C	S	.	.	H	α-helix	trans	-72.2	-20.7	174.1	173.5	0	0	0	0	113.6	Q932 A934 S939 K940 V951	Q932-V936 VanDerWaalsContact O-CG2 3.31Å; Q932-V936 WeakPolarHBondContact O-CG2 3.38Å; Q932-V936 PolarHBondContact O-N 2.79Å; A934-V936 PolarHBondContact O-N 2.85Å; V936-S939 PolarHBondContact O-OG 2.77Å; V936-K940 WeakPolarHBondContact O-CD 3.49Å; V936-K940 WeakPolarHBondContact O-CG 3.39Å; V936-V951 HydrophobicContact CG2-CG1 3.85Å
937	R	92.2	Very high	89.5	Confident	145 Å²	145	76.8 Å²	76.8	55%	0.547	36%	0.355	S	S	.	.	H	α-helix	trans	-82.1	-47.5	169.1	-72.9	-176.4	-54.2	-88.9	5.5	110.8	D933 A934 V935 S939 K940 D941	D933-R937 VanDerWaalsContact C-NH1 3.25Å; D933-R937 WeakPolarHBondContact O-CG 3.42Å; D933-R937 PolarHBondContact O-N 2.95Å; D933-R937 PolarHBondContact O-NH1 2.7Å; A934-R937 VanDerWaalsContact CA-NH2 3.35Å; A934-R937 WeakPolarHBondContact O-CA 3.12Å; A934-R937 WeakPolarHBondContact O-CB 3.46Å; A934-R937 PolarHBondContact O-N 2.83Å; V935-R937 VanDerWaalsContact C-N 3.34Å; R937-S939 PolarHBondContact O-N 3.43Å; R937-K940 PolarHBondContact O-N 2.8Å; R937-D941 PolarHBondContact O-N 3.05Å; R937-D941 VanDerWaalsContact O-N 3.09Å
938	D	91.8	Very high	88.9	Confident	25 Å²	25	75.5 Å²	75.5	13%	0.134	35%	0.347	C	S	.	.	H	α-helix	trans	-57.4	-34	179	-69.4	18.4	0	0	0	112.2	H680 A934 K940 D941 L944 P948	H680-D938 IonicContact CE1-OD1 3.53Å; H680-D938 IonicContact CE1-OD2 2.79Å; H680-D938 IonicContact CG-OD2 3.2Å; H680-D938 IonicContact ND1-OD1 3.43Å; H680-D938 PolarHBondContact ND1-OD1 2.83Å; H680-D938 IonicContact ND1-OD2 2.71Å; H680-D938 PolarHBondContact ND1-OD2 2.71Å; A934-D938 PolarHBondContact O-N 2.8Å; D938-K940 VanDerWaalsContact C-N 3.28Å; D938-K940 PolarHBondContact O-N 3.08Å; D938-D941 PolarHBondContact O-N 2.86Å; D938-L944 HydrophobicContact CB-CD1 3.67Å; D938-P948 HydrophobicContact CB-CG 3.75Å
939	S	89.4	Confident	88.3	Confident	41 Å²	41	81 Å²	81	29%	0.287	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-18.8	176.1	67.7	0	0	0	0	114.6	V935 V936 R937 V951	V935-S939 PolarHBondContact O-N 3.45Å; V935-S939 PolarHBondContact O-OG 2.8Å; V936-S939 PolarHBondContact O-OG 2.77Å; R937-S939 PolarHBondContact O-N 3.43Å; S939-V951 VanDerWaalsContact CB-CG2 3.49Å
940	K	88.6	Confident	87.9	Confident	159 Å²	159	80.6 Å²	80.6	69%	0.691	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-22.8	176.6	-64.3	177.3	-175.7	-177.9	0	112.2	V936 R937 D938 K942	V936-K940 WeakPolarHBondContact O-CD 3.49Å; V936-K940 WeakPolarHBondContact O-CG 3.39Å; R937-K940 PolarHBondContact O-N 2.8Å; D938-K940 VanDerWaalsContact C-N 3.28Å; D938-K940 PolarHBondContact O-N 3.08Å; K940-K942 PolarHBondContact O-N 3.38Å
941	D	87.2	Confident	87.5	Confident	64 Å²	64	78 Å²	78	34%	0.342	37%	0.368	S	S	.	.			trans	-74.2	113	176	-164.3	-23.5	0	0	0	110.8	R937 D938 T943 L944	R937-D941 PolarHBondContact O-N 3.05Å; R937-D941 VanDerWaalsContact O-N 3.09Å; D938-D941 PolarHBondContact O-N 2.86Å; D941-T943 VanDerWaalsContact C-N 3.27Å; D941-T943 PolarHBondContact O-N 2.82Å; D941-T943 WeakPolarHBondContact OD1-CB 3.43Å; D941-T943 PolarHBondContact OD1-N 3.49Å; D941-T943 PolarHBondContact OD1-OG1 3.06Å; D941-T943 PolarHBondContact OD2-OG1 3.45Å; D941-L944 HydrophobicContact CB-CD1 4.04Å; D941-L944 HydrophobicContact CB-CG 4.07Å
942	K	79.5	Confident	87.4	Confident	179 Å²	179	77.6 Å²	77.6	78%	0.778	37%	0.366	S	S	*	.	S	Bend	trans	-78.4	-10.9	179.2	-64.6	-178.7	-178.1	177.5	0	113	K940	K940-K942 PolarHBondContact O-N 3.38Å
943	T	80.5	Confident	87.2	Confident	119 Å²	119	79.8 Å²	79.8	73%	0.73	38%	0.382	S	S	*	.	S	Bend	trans	-88.7	-17.6	-175.7	71.3	0	0	0	0	113.6	D941 E945	D941-T943 VanDerWaalsContact C-N 3.27Å; D941-T943 PolarHBondContact O-N 2.82Å; D941-T943 WeakPolarHBondContact OD1-CB 3.43Å; D941-T943 PolarHBondContact OD1-N 3.49Å; D941-T943 PolarHBondContact OD1-OG1 3.06Å; D941-T943 PolarHBondContact OD2-OG1 3.45Å; T943-E945 PolarHBondContact O-N 3.43Å
944	L	76.6	Confident	87.1	Confident	64 Å²	64	83.1 Å²	83.1	34%	0.335	40%	0.4	S	S	.	.			trans	-70	121.2	177.4	-65.3	177.2	0	0	0	111.1	D938 D941 K946	D938-L944 HydrophobicContact CB-CD1 3.67Å; D941-L944 HydrophobicContact CB-CD1 4.04Å; D941-L944 HydrophobicContact CB-CG 4.07Å; L944-K946 PolarHBondContact O-N 2.9Å
945	E	72.3	Confident	87.1	Confident	208 Å²	208	91.8 Å²	91.8	97%	0.972	43%	0.432	S	S	*	.	S	Bend	trans	-54.7	-34.8	175.4	-58.8	-178.1	148.1	0	0	112.4	T943	T943-E945 PolarHBondContact O-N 3.43Å
946	K	79.5	Confident	87.2	Confident	88 Å²	88	92.3 Å²	92.3	38%	0.383	44%	0.435	S	S	.	.	S	Bend	trans	-119.9	106	-178.9	-167.2	-178.4	-166	179.5	0	109.7	Q675 R676 L677 T678 L944	Q675-K946 VanDerWaalsContact O-CE 3.29Å; Q675-K946 WeakPolarHBondContact O-CE 3.12Å; Q675-K946 PolarHBondContact O-NZ 3.16Å; R676-K946 WeakPolarHBondContact O-CE 3.36Å; L677-K946 VanDerWaalsContact O-CE 3.26Å; L677-K946 WeakPolarHBondContact O-CE 3.35Å; L677-K946 PolarHBondContact O-NZ 3.47Å; T678-K946 HydrophobicContact CG2-CG 4.21Å; T678-K946 WeakPolarHBondContact CG2-O 3.45Å; L944-K946 PolarHBondContact O-N 2.9Å
947	R	83.4	Confident	87.2	Confident	151 Å²	151	94.2 Å²	94.2	57%	0.57	44%	0.439	S	S	*	.			trans	-78.5	156.4	173.6	-64.7	-174.6	-176.1	169.8	5.9	111.1	T678	T678-R947 VanDerWaalsContact CG2-C 3.48Å; T678-R947 WeakPolarHBondContact CG2-O 3.39Å
948	P	85.2	Confident	87.4	Confident	19 Å²	19	92.4 Å²	92.4	12%	0.123	44%	0.437	C	S	.	.			trans	-53	138.3	171.9	-30.3	38.3	0	0	0	113.5	T678 E681 V935 D938	T678-P948 HydrophobicContact CG2-CG 4.29Å; E681-P948 WeakPolarHBondContact OE2-CA 3.39Å; V935-P948 HydrophobicContact CG1-CB 3.71Å; V935-P948 HydrophobicContact CG1-CG 3.86Å; D938-P948 HydrophobicContact CB-CG 3.75Å
949	F	84.6	Confident	87.7	Confident	118 Å²	118	92.1 Å²	92.1	52%	0.518	44%	0.435	S	S	.	.	S	Bend	trans	-72.4	-35.9	172.4	177.4	-102.4	0	0	0	111.5	L677 E681	L677-F949 HydrophobicContact CD2-CB 3.86Å; L677-F949 HydrophobicContact CD2-CD1 4.08Å; L677-F949 HydrophobicContact CD2-CG 4.27Å; E681-F949 WeakPolarHBondContact OE1-CA 3.27Å; E681-F949 WeakPolarHBondContact OE1-CB 3.44Å; E681-F949 PolarHBondContact OE1-N 3.2Å; E681-F949 PolarHBondContact OE2-N 2.77Å; E681-F949 VanDerWaalsContact OE2-N 3.17Å
950	R	88.4	Confident	88	Confident	87 Å²	87	90.1 Å²	90.1	33%	0.328	42%	0.422	S	S	.	.			trans	-140.6	119.6	176.7	-174.4	174	-176.3	-99.4	-9.7	111.3	E681 N848 E956	E681-R950 PolarHBondContact OE1-N 2.86Å; N848-R950 PolarHBondContact OD1-NH1 2.81Å; R950-E956 IonicContact CZ-OE1 2.73Å; R950-E956 IonicContact CZ-OE2 2.93Å; R950-E956 IonicContact NH1-OE1 3.5Å; R950-E956 PolarHBondContact NH1-OE1 3.21Å; R950-E956 IonicContact NH1-OE2 3.91Å; R950-E956 IonicContact NH2-OE1 2.88Å; R950-E956 PolarHBondContact NH2-OE1 3.22Å; R950-E956 IonicContact NH2-OE2 3.52Å; R950-E956 PolarHBondContact NH2-OE2 3.44Å
951	V	90.1	Very high	88.4	Confident	68 Å²	68	88 Å²	88	41%	0.412	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-80.9	133	169.1	-171.7	0	0	0	0	109	V936 S939 S953	V936-V951 HydrophobicContact CG2-CG1 3.85Å; S939-V951 VanDerWaalsContact CB-CG2 3.49Å; V951-S953 PolarHBondContact O-N 3.28Å
952	P	92.4	Very high	88.9	Confident	12 Å²	12	87 Å²	87	8%	0.078	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-58.2	131.7	172	-23.6	33	0	0	0	111.4	L684 Q932 R957	L684-P952 HydrophobicContact CD2-CG 4.32Å; Q932-P952 HydrophobicContact CB-CB 4.34Å; Q932-P952 HydrophobicContact CB-CG 3.95Å; Q932-P952 HydrophobicContact CG-CB 4.04Å; Q932-P952 HydrophobicContact CG-CG 3.8Å; P952-R957 HydrophobicContact CB-CG 4.21Å
953	S	92.9	Very high	89.8	Confident	54 Å²	54	78.5 Å²	78.5	38%	0.378	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-70.5	157.8	174.7	63.8	0	0	0	0	111.5	V951 R955 E956 R957	V951-S953 PolarHBondContact O-N 3.28Å; S953-R955 PolarHBondContact O-N 2.91Å; S953-E956 WeakPolarHBondContact CB-OE2 3.29Å; S953-E956 PolarHBondContact N-OE2 3.09Å; S953-E956 WeakPolarHBondContact O-CB 3.39Å; S953-E956 PolarHBondContact O-N 2.95Å; S953-E956 VanDerWaalsContact OG-CD 3.31Å; S953-E956 WeakPolarHBondContact OG-CG 3.15Å; S953-E956 PolarHBondContact OG-N 3.19Å; S953-E956 PolarHBondContact OG-OE2 3.32Å; S953-R957 WeakPolarHBondContact O-CG 3.22Å; S953-R957 PolarHBondContact O-N 2.81Å; S953-R957 VanDerWaalsContact O-N 3.1Å
954	D	92.9	Very high	90.6	Very high	116 Å²	116	73.4 Å²	73.4	62%	0.62	34%	0.34	S	S	*	.	H	α-helix	trans	-63.3	-28.9	-180	-71.4	-60.7	0	0	0	113	R957 E958	D954-R957 CarbonylContact O-C 3.45Å; D954-R957 PolarHBondContact O-N 2.7Å; D954-R957 VanDerWaalsContact O-N 3.15Å; D954-R957 IonicContact OD1-NH1 2.61Å; D954-R957 PolarHBondContact OD1-NH1 2.67Å; D954-E958 WeakPolarHBondContact O-CB 2.97Å; D954-E958 PolarHBondContact O-N 3.44Å
955	R	94.4	Very high	91.5	Very high	185 Å²	185	75.8 Å²	75.8	70%	0.698	34%	0.344	S	S	*	.	H	α-helix	trans	-62.6	-40.9	170	-171.7	178.6	-177.7	-179.1	2.3	112.6	S953 R957 E958 N959	S953-R955 PolarHBondContact O-N 2.91Å; R955-R957 PolarHBondContact O-N 2.78Å; R955-E958 PolarHBondContact O-N 3.12Å; R955-N959 WeakPolarHBondContact O-CB 3.49Å; R955-N959 VanDerWaalsContact O-CG 3.27Å; R955-N959 PolarHBondContact O-N 2.95Å; R955-N959 PolarHBondContact O-ND2 3.33Å
956	E	95	Very high	92.7	Very high	12 Å²	12	66.8 Å²	66.8	6%	0.056	30%	0.302	C	S	.	.	H	α-helix	trans	-70	-22.2	175.6	-69.5	162.6	129.2	0	0	112.2	E849 Q932 R950 S953 V960	E849-E956 HydrophobicContact CB-CG 4.25Å; E849-E956 WeakPolarHBondContact OE1-CA 3.35Å; Q932-E956 PolarHBondContact NE2-O 3.5Å; Q932-E956 PolarHBondContact OE1-O 3.15Å; R950-E956 IonicContact CZ-OE1 2.73Å; R950-E956 IonicContact CZ-OE2 2.93Å; R950-E956 IonicContact NH1-OE1 3.5Å; R950-E956 PolarHBondContact NH1-OE1 3.21Å; R950-E956 IonicContact NH1-OE2 3.91Å; R950-E956 IonicContact NH2-OE1 2.88Å; R950-E956 PolarHBondContact NH2-OE1 3.22Å; R950-E956 IonicContact NH2-OE2 3.52Å; R950-E956 PolarHBondContact NH2-OE2 3.44Å; S953-E956 WeakPolarHBondContact CB-OE2 3.29Å; S953-E956 PolarHBondContact N-OE2 3.09Å; S953-E956 WeakPolarHBondContact O-CB 3.39Å; S953-E956 PolarHBondContact O-N 2.95Å; S953-E956 VanDerWaalsContact OG-CD 3.31Å; S953-E956 WeakPolarHBondContact OG-CG 3.15Å; S953-E956 PolarHBondContact OG-N 3.19Å; S953-E956 PolarHBondContact OG-OE2 3.32Å; E956-V960 VanDerWaalsContact O-CG2 3.3Å; E956-V960 WeakPolarHBondContact O-CG2 3.49Å
957	R	94.9	Very high	93.5	Very high	64 Å²	64	62.6 Å²	62.6	24%	0.242	28%	0.284	C	S	.	.	H	α-helix	trans	-86.9	-28.1	174.1	-62.2	177	67.4	-104.4	-11.1	112.5	D933 P952 S953 D954 R955 Q961	D933-R957 IonicContact OD1-CZ 3.17Å; D933-R957 IonicContact OD1-NE 2.73Å; D933-R957 IonicContact OD1-NH2 2.73Å; D933-R957 PolarHBondContact OD1-NH2 3.44Å; P952-R957 HydrophobicContact CB-CG 4.21Å; S953-R957 WeakPolarHBondContact O-CG 3.22Å; S953-R957 PolarHBondContact O-N 2.81Å; S953-R957 VanDerWaalsContact O-N 3.1Å; D954-R957 CarbonylContact O-C 3.45Å; D954-R957 PolarHBondContact O-N 2.7Å; D954-R957 VanDerWaalsContact O-N 3.15Å; D954-R957 IonicContact OD1-NH1 2.61Å; D954-R957 PolarHBondContact OD1-NH1 2.67Å; R955-R957 PolarHBondContact O-N 2.78Å; R957-Q961 WeakPolarHBondContact O-CG 3.32Å; R957-Q961 PolarHBondContact O-N 3Å; R957-Q961 PolarHBondContact O-NE2 3.25Å
958	E	96.3	Very high	94.1	Very high	108 Å²	108	58.1 Å²	58.1	51%	0.505	27%	0.272	S	S	.	.	H	α-helix	trans	-71.8	-50.6	171.2	179.8	-176	-161.9	0	0	110.8	D954 R955 V960 Q961 L962	D954-E958 WeakPolarHBondContact O-CB 2.97Å; D954-E958 PolarHBondContact O-N 3.44Å; R955-E958 PolarHBondContact O-N 3.12Å; E958-V960 PolarHBondContact O-N 3.19Å; E958-Q961 CarbonylContact O-C 3.53Å; E958-Q961 WeakPolarHBondContact O-CA 3.48Å; E958-Q961 WeakPolarHBondContact O-CB 3.45Å; E958-Q961 PolarHBondContact O-N 2.89Å; E958-L962 HydrophobicContact CG-CD1 4.03Å; E958-L962 HydrophobicContact CG-CG 4.34Å; E958-L962 WeakPolarHBondContact O-CG 3.3Å; E958-L962 PolarHBondContact O-N 3.06Å
959	N	97.1	Very high	94.6	Very high	18 Å²	18	61.5 Å²	61.5	10%	0.096	28%	0.282	C	S	.	.	H	α-helix	trans	-53.4	-37.4	174.6	-79.9	-20.8	0	0	0	112.5	E849 C851 R955 L962 A963	E849-N959 VanDerWaalsContact CD-ND2 3.31Å; E849-N959 WeakPolarHBondContact OE1-CB 3.49Å; E849-N959 PolarHBondContact OE1-ND2 3.31Å; E849-N959 PolarHBondContact OE2-ND2 3.29Å; C851-N959 HydrophobicContact CB-CB 4.36Å; R955-N959 WeakPolarHBondContact O-CB 3.49Å; R955-N959 VanDerWaalsContact O-CG 3.27Å; R955-N959 PolarHBondContact O-N 2.95Å; R955-N959 PolarHBondContact O-ND2 3.33Å; N959-L962 PolarHBondContact O-N 3.02Å; N959-A963 WeakPolarHBondContact O-CB 3.45Å; N959-A963 PolarHBondContact O-N 3.42Å
960	V	97.1	Very high	95.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-37.1	172.5	161.9	0	0	0	0	112.6	C851 V925 I928 R929 E956 E958 L964	C851-V960 HydrophobicContact CB-CG2 3.9Å; C851-V960 VanDerWaalsContact SG-CG2 3.57Å; V925-V960 HydrophobicContact CG1-CG1 4.07Å; I928-V960 HydrophobicContact CG2-CG2 3.9Å; R929-V960 HydrophobicContact CB-CG1 3.48Å; R929-V960 VanDerWaalsContact CB-CG1 3.48Å; R929-V960 HydrophobicContact CG-CG1 3.67Å; E956-V960 VanDerWaalsContact O-CG2 3.3Å; E956-V960 WeakPolarHBondContact O-CG2 3.49Å; E958-V960 PolarHBondContact O-N 3.19Å; V960-L964 WeakPolarHBondContact O-CG 3.4Å; V960-L964 PolarHBondContact O-N 3.37Å; V960-L964 VanDerWaalsContact O-N 3.11Å
961	Q	96.7	Very high	95.3	Very high	113 Å²	113	53.3 Å²	53.3	53%	0.528	25%	0.25	S	C	.	.	H	α-helix	trans	-72.6	-41.7	175.2	-69	170.9	77.4	0	0	111.8	R957 E958 L964 R965	R957-Q961 WeakPolarHBondContact O-CG 3.32Å; R957-Q961 PolarHBondContact O-N 3Å; R957-Q961 PolarHBondContact O-NE2 3.25Å; E958-Q961 CarbonylContact O-C 3.53Å; E958-Q961 WeakPolarHBondContact O-CA 3.48Å; E958-Q961 WeakPolarHBondContact O-CB 3.45Å; E958-Q961 PolarHBondContact O-N 2.89Å; Q961-L964 PolarHBondContact O-N 3.09Å; Q961-R965 PolarHBondContact O-N 3.42Å
962	L	97.1	Very high	95.5	Very high	44 Å²	44	54.3 Å²	54.3	23%	0.23	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-43.8	173.6	-67.4	173	0	0	0	111.4	V855 E958 N959 L964 R965 E966	V855-L962 HydrophobicContact CG1-CB 4.46Å; V855-L962 HydrophobicContact CG2-CB 3.57Å; E958-L962 HydrophobicContact CG-CD1 4.03Å; E958-L962 HydrophobicContact CG-CG 4.34Å; E958-L962 WeakPolarHBondContact O-CG 3.3Å; E958-L962 PolarHBondContact O-N 3.06Å; N959-L962 PolarHBondContact O-N 3.02Å; L962-L964 VanDerWaalsContact C-N 3.34Å; L962-L964 PolarHBondContact O-N 3.49Å; L962-R965 WeakPolarHBondContact O-CB 3.15Å; L962-R965 PolarHBondContact O-N 2.94Å; L962-R965 VanDerWaalsContact O-N 3.07Å; L962-E966 PolarHBondContact O-N 3.33Å
963	A	97.5	Very high	95.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.2	-42.3	174.7	0	0	0	0	0	111.6	C851 I854 V855 V925 N959 L967	C851-A963 HydrophobicContact CB-CB 4.21Å; I854-A963 HydrophobicContact CB-CB 4.1Å; I854-A963 HydrophobicContact CG2-CB 3.76Å; V855-A963 HydrophobicContact CG2-CB 4.04Å; V925-A963 HydrophobicContact CG1-CB 4.02Å; V925-A963 HydrophobicContact CG2-CB 4.45Å; N959-A963 WeakPolarHBondContact O-CB 3.45Å; N959-A963 PolarHBondContact O-N 3.42Å; A963-L967 VanDerWaalsContact O-CB 3.28Å; A963-L967 WeakPolarHBondContact O-CB 3.49Å; A963-L967 WeakPolarHBondContact O-CD1 3.36Å; A963-L967 WeakPolarHBondContact O-CG 3.43Å; A963-L967 PolarHBondContact O-N 3.39Å
964	L	97.1	Very high	95.5	Very high	13 Å²	13	52.5 Å²	52.5	7%	0.068	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-38.9	172	-71.5	170.8	0	0	0	112	K922 V925 E926 V960 Q961 L962 N968	K922-L964 HydrophobicContact CG-CD2 4.26Å; V925-L964 HydrophobicContact CB-CD2 3.97Å; V925-L964 HydrophobicContact CB-CG 4.35Å; V925-L964 HydrophobicContact CG1-CD1 4.42Å; V925-L964 HydrophobicContact CG1-CD2 3.89Å; V925-L964 HydrophobicContact CG1-CG 3.7Å; E926-L964 HydrophobicContact CG-CD2 3.83Å; V960-L964 WeakPolarHBondContact O-CG 3.4Å; V960-L964 PolarHBondContact O-N 3.37Å; V960-L964 VanDerWaalsContact O-N 3.11Å; Q961-L964 PolarHBondContact O-N 3.09Å; L962-L964 VanDerWaalsContact C-N 3.34Å; L962-L964 PolarHBondContact O-N 3.49Å; L964-N968 WeakPolarHBondContact O-CB 3.26Å; L964-N968 PolarHBondContact O-N 2.9Å; L964-N968 PolarHBondContact O-ND2 2.83Å
965	R	96.9	Very high	95.4	Very high	113 Å²	113	51.2 Å²	51.2	43%	0.426	24%	0.236	S	C	.	.	H	α-helix	trans	-61.5	-50	178.2	-169.2	172.7	60.4	61.4	1.5	111.1	Q961 L962 N968 R969	Q961-R965 PolarHBondContact O-N 3.42Å; L962-R965 WeakPolarHBondContact O-CB 3.15Å; L962-R965 PolarHBondContact O-N 2.94Å; L962-R965 VanDerWaalsContact O-N 3.07Å; R965-N968 PolarHBondContact O-N 3.24Å; R965-R969 PolarHBondContact O-N 3.33Å
966	E	96.5	Very high	95.2	Very high	19 Å²	19	46.3 Å²	46.3	9%	0.089	23%	0.227	C	C	.	.	H	α-helix	trans	-69.5	-39.9	179.8	-65.5	-54.8	144.7	0	0	113.2	A858 L962 N968 R969 L970	A858-E966 HydrophobicContact CB-CB 3.71Å; L962-E966 PolarHBondContact O-N 3.33Å; E966-N968 VanDerWaalsContact C-N 3.31Å; E966-N968 PolarHBondContact O-N 2.97Å; E966-R969 WeakPolarHBondContact O-CB 3.37Å; E966-R969 PolarHBondContact O-N 3.27Å; E966-R969 WeakPolarHBondContact OE2-CD 3.47Å; E966-R969 IonicContact OE2-CZ 2.74Å; E966-R969 IonicContact OE2-NE 3.4Å; E966-R969 PolarHBondContact OE2-NE 2.88Å; E966-R969 IonicContact OE2-NH2 3.27Å; E966-L970 WeakPolarHBondContact O-CG 3.31Å; E966-L970 PolarHBondContact O-N 2.88Å
967	L	96.6	Very high	94.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-34.3	175.4	-70.2	170.4	0	0	0	112.3	I854 L918 L921 K922 V925 A963 L971	I854-L967 HydrophobicContact CG2-CD1 3.84Å; I854-L967 HydrophobicContact CG2-CD2 4.31Å; I854-L967 HydrophobicContact CG2-CG 4.04Å; L918-L967 HydrophobicContact CD1-CD2 3.7Å; L921-L967 HydrophobicContact CB-CD1 3.9Å; L921-L967 HydrophobicContact CB-CD2 3.8Å; L921-L967 HydrophobicContact CD1-CD2 3.92Å; L921-L967 HydrophobicContact CG-CD2 4.48Å; K922-L967 HydrophobicContact CB-CB 4.43Å; V925-L967 HydrophobicContact CG2-CD1 3.96Å; A963-L967 VanDerWaalsContact O-CB 3.28Å; A963-L967 WeakPolarHBondContact O-CB 3.49Å; A963-L967 WeakPolarHBondContact O-CD1 3.36Å; A963-L967 WeakPolarHBondContact O-CG 3.43Å; A963-L967 PolarHBondContact O-N 3.39Å; L967-L971 WeakPolarHBondContact O-CD1 3.05Å; L967-L971 VanDerWaalsContact O-CG 3.31Å; L967-L971 WeakPolarHBondContact O-CG 3.26Å; L967-L971 PolarHBondContact O-N 3.11Å
968	N	96	Very high	94.6	Very high	58 Å²	58	47 Å²	47	31%	0.31	23%	0.232	S	C	.	.	H	α-helix	trans	-70.4	-41	170.6	-76.1	-68.4	0	0	0	111.8	K922 L964 R965 E966 L970 L971 T972	K922-N968 WeakPolarHBondContact CE-OD1 3.35Å; K922-N968 PolarHBondContact NZ-OD1 3.27Å; L964-N968 WeakPolarHBondContact O-CB 3.26Å; L964-N968 PolarHBondContact O-N 2.9Å; L964-N968 PolarHBondContact O-ND2 2.83Å; R965-N968 PolarHBondContact O-N 3.24Å; E966-N968 VanDerWaalsContact C-N 3.31Å; E966-N968 PolarHBondContact O-N 2.97Å; N968-L970 VanDerWaalsContact C-N 3.35Å; N968-L970 PolarHBondContact O-N 2.65Å; N968-L971 PolarHBondContact O-N 2.87Å; N968-T972 WeakPolarHBondContact O-CB 3.46Å; N968-T972 PolarHBondContact O-N 2.82Å; N968-T972 PolarHBondContact O-OG1 2.83Å
969	R	95.5	Very high	94.2	Very high	89 Å²	89	46.3 Å²	46.3	34%	0.336	23%	0.229	S	C	.	.	H	α-helix	trans	-53.1	-51.6	173.8	-176.5	-169.8	68.1	84.1	-2.9	111	A858 E864 R965 E966 L971 T972 A973	A858-R969 PolarHBondContact O-NH2 3.02Å; E864-R969 IonicContact OE1-CZ 2.74Å; E864-R969 VanDerWaalsContact OE1-CZ 3.24Å; E864-R969 IonicContact OE1-NH1 3.97Å; E864-R969 PolarHBondContact OE1-NH1 3.37Å; E864-R969 IonicContact OE1-NH2 2.68Å; E864-R969 PolarHBondContact OE1-NH2 3.12Å; R965-R969 PolarHBondContact O-N 3.33Å; E966-R969 WeakPolarHBondContact O-CB 3.37Å; E966-R969 PolarHBondContact O-N 3.27Å; E966-R969 WeakPolarHBondContact OE2-CD 3.47Å; E966-R969 IonicContact OE2-CZ 2.74Å; E966-R969 IonicContact OE2-NE 3.4Å; E966-R969 PolarHBondContact OE2-NE 2.88Å; E966-R969 IonicContact OE2-NH2 3.27Å; R969-L971 PolarHBondContact O-N 3.35Å; R969-T972 PolarHBondContact O-N 2.92Å; R969-A973 VanDerWaalsContact O-CB 3.22Å; R969-A973 WeakPolarHBondContact O-CB 3.44Å; R969-A973 PolarHBondContact O-N 3.29Å
970	L	94.8	Very high	93.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-41.3	-179.9	-69	170.8	0	0	0	112.5	A858 F863 I867 L918 E966 N968 S974	A858-L970 HydrophobicContact CB-CD1 3.74Å; F863-L970 HydrophobicContact CB-CD1 3.67Å; F863-L970 HydrophobicContact CB-CD2 4.3Å; F863-L970 HydrophobicContact CD2-CD1 3.77Å; F863-L970 HydrophobicContact CG-CD1 4.25Å; I867-L970 HydrophobicContact CD1-CD2 3.63Å; I867-L970 HydrophobicContact CG1-CD2 4.28Å; L918-L970 HydrophobicContact CD1-CB 4.09Å; L918-L970 HydrophobicContact CD1-CD1 3.96Å; L918-L970 HydrophobicContact CD2-CB 3.89Å; E966-L970 WeakPolarHBondContact O-CG 3.31Å; E966-L970 PolarHBondContact O-N 2.88Å; N968-L970 VanDerWaalsContact C-N 3.35Å; N968-L970 PolarHBondContact O-N 2.65Å; L970-S974 VanDerWaalsContact O-CB 3.26Å; L970-S974 WeakPolarHBondContact O-CB 3.41Å; L970-S974 PolarHBondContact O-N 3.35Å; L970-S974 PolarHBondContact O-OG 2.85Å
971	L	94.2	Very high	93	Very high	33 Å²	33	52 Å²	52	17%	0.173	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-47.9	177.1	-76.7	165.8	0	0	0	111.9	M915 L918 K922 L967 N968 R969 S974 E975	M915-L971 HydrophobicContact SD-CD2 4.36Å; L918-L971 HydrophobicContact CB-CD2 4.27Å; L918-L971 HydrophobicContact CD2-CD2 3.7Å; L918-L971 HydrophobicContact CD2-CG 3.83Å; L918-L971 HydrophobicContact CG-CD2 3.81Å; L918-L971 HydrophobicContact CG-CG 3.89Å; K922-L971 HydrophobicContact CB-CD1 4.37Å; K922-L971 HydrophobicContact CD-CD1 3.81Å; L967-L971 WeakPolarHBondContact O-CD1 3.05Å; L967-L971 VanDerWaalsContact O-CG 3.31Å; L967-L971 WeakPolarHBondContact O-CG 3.26Å; L967-L971 PolarHBondContact O-N 3.11Å; N968-L971 PolarHBondContact O-N 2.87Å; R969-L971 PolarHBondContact O-N 3.35Å; L971-S974 PolarHBondContact O-N 2.89Å; L971-E975 PolarHBondContact O-N 3.11Å; L971-E975 VanDerWaalsContact O-N 3.09Å
972	T	94.3	Very high	92.4	Very high	89 Å²	89	49 Å²	49	55%	0.546	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-47.3	177.8	-64.7	0	0	0	0	111.1	N968 R969 S974 E975 T976	N968-T972 WeakPolarHBondContact O-CB 3.46Å; N968-T972 PolarHBondContact O-N 2.82Å; N968-T972 PolarHBondContact O-OG1 2.83Å; R969-T972 PolarHBondContact O-N 2.92Å; T972-S974 VanDerWaalsContact C-N 3.34Å; T972-S974 PolarHBondContact O-N 2.89Å; T972-E975 PolarHBondContact O-N 3.37Å; T972-T976 WeakPolarHBondContact O-CB 3.49Å; T972-T976 PolarHBondContact O-N 3.32Å; T972-T976 PolarHBondContact O-OG1 2.86Å; T972-T976 VanDerWaalsContact O-OG1 3.06Å
973	A	93.1	Very high	91.7	Very high	29 Å²	29	50.7 Å²	50.7	24%	0.24	25%	0.249	C	C	.	.	H	α-helix	trans	-58.8	-44.2	176.5	0	0	0	0	0	112.1	I867 R969 E975 T976 E977	I867-A973 HydrophobicContact CD1-CB 3.78Å; I867-A973 HydrophobicContact CG1-CB 4.2Å; R969-A973 VanDerWaalsContact O-CB 3.22Å; R969-A973 WeakPolarHBondContact O-CB 3.44Å; R969-A973 PolarHBondContact O-N 3.29Å; A973-E975 PolarHBondContact O-N 3.39Å; A973-T976 PolarHBondContact O-N 3.11Å; A973-E977 WeakPolarHBondContact O-CB 3.14Å; A973-E977 WeakPolarHBondContact O-CG 3.31Å; A973-E977 PolarHBondContact O-N 3.45Å
974	S	91.8	Very high	90.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.5	-43.2	177.8	-61.6	0	0	0	0	112.6	I867 L970 L971 T972 K978	I867-S974 WeakPolarHBondContact CG1-OG 3.21Å; L970-S974 VanDerWaalsContact O-CB 3.26Å; L970-S974 WeakPolarHBondContact O-CB 3.41Å; L970-S974 PolarHBondContact O-N 3.35Å; L970-S974 PolarHBondContact O-OG 2.85Å; L971-S974 PolarHBondContact O-N 2.89Å; T972-S974 VanDerWaalsContact C-N 3.34Å; T972-S974 PolarHBondContact O-N 2.89Å; S974-K978 WeakPolarHBondContact O-CB 3.3Å; S974-K978 PolarHBondContact O-N 3.34Å
975	E	90.3	Very high	90.2	Very high	89 Å²	89	55.9 Å²	55.9	42%	0.416	28%	0.276	S	S	.	.	H	α-helix	trans	-75.6	-37.3	-179.7	-168	60.1	-154.1	0	0	111.9	L971 T972 A973 K978 E979	L971-E975 PolarHBondContact O-N 3.11Å; L971-E975 VanDerWaalsContact O-N 3.09Å; T972-E975 PolarHBondContact O-N 3.37Å; A973-E975 PolarHBondContact O-N 3.39Å; E975-K978 PolarHBondContact O-N 3.24Å; E975-K978 IonicContact OE1-NZ 3.48Å; E975-K978 PolarHBondContact OE1-NZ 3.32Å; E975-K978 IonicContact OE2-NZ 3.37Å; E975-K978 PolarHBondContact OE2-NZ 3.08Å; E975-E979 WeakPolarHBondContact O-CB 3.37Å; E975-E979 PolarHBondContact O-N 3.23Å
976	T	90.2	Very high	89.8	Confident	82 Å²	82	53.1 Å²	53.1	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-64.6	-43.3	173.3	-61	0	0	0	0	112	T972 A973 E979 L980	T972-T976 WeakPolarHBondContact O-CB 3.49Å; T972-T976 PolarHBondContact O-N 3.32Å; T972-T976 PolarHBondContact O-OG1 2.86Å; T972-T976 VanDerWaalsContact O-OG1 3.06Å; A973-T976 PolarHBondContact O-N 3.11Å; T976-E979 PolarHBondContact O-N 3.31Å; T976-L980 WeakPolarHBondContact O-CB 3.48Å; T976-L980 PolarHBondContact O-N 2.81Å
977	E	89.2	Confident	89.4	Confident	56 Å²	56	53 Å²	53	26%	0.262	27%	0.266	S	S	.	.	H	α-helix	trans	-63.7	-42.2	174.7	-81.5	-142.1	146.2	0	0	112.1	I867 R871 A973 L980 M981	I867-E977 HydrophobicContact CG2-CB 4.44Å; I867-E977 VanDerWaalsContact CG2-CD 3.43Å; I867-E977 HydrophobicContact CG2-CG 3.91Å; I867-E977 WeakPolarHBondContact CG2-OE2 3.44Å; R871-E977 HydrophobicContact CB-CB 3.94Å; R871-E977 WeakPolarHBondContact CD-OE2 3.36Å; R871-E977 HydrophobicContact CG-CB 4Å; R871-E977 IonicContact CZ-OE2 2.71Å; R871-E977 VanDerWaalsContact CZ-OE2 3.31Å; R871-E977 IonicContact NE-OE2 2.78Å; R871-E977 PolarHBondContact NE-OE2 2.86Å; R871-E977 IonicContact NH1-OE1 3.69Å; R871-E977 PolarHBondContact NH1-OE1 2.95Å; R871-E977 IonicContact NH1-OE2 3.65Å; R871-E977 PolarHBondContact NH1-OE2 3.48Å; A973-E977 WeakPolarHBondContact O-CB 3.14Å; A973-E977 WeakPolarHBondContact O-CG 3.31Å; A973-E977 PolarHBondContact O-N 3.45Å; E977-L980 PolarHBondContact O-N 2.83Å; E977-M981 PolarHBondContact O-N 2.86Å
978	K	89.5	Confident	88.8	Confident	35 Å²	35	56.6 Å²	56.6	15%	0.152	29%	0.285	C	S	.	.	H	α-helix	trans	-61.6	-47.1	175.6	171	167	150.4	-85.8	0	111.5	S974 E975 L980 M981 D982	S974-K978 WeakPolarHBondContact O-CB 3.3Å; S974-K978 PolarHBondContact O-N 3.34Å; E975-K978 PolarHBondContact O-N 3.24Å; E975-K978 IonicContact OE1-NZ 3.48Å; E975-K978 PolarHBondContact OE1-NZ 3.32Å; E975-K978 IonicContact OE2-NZ 3.37Å; E975-K978 PolarHBondContact OE2-NZ 3.08Å; K978-L980 VanDerWaalsContact C-N 3.34Å; K978-L980 PolarHBondContact O-N 2.9Å; K978-M981 PolarHBondContact O-N 3.45Å; K978-D982 WeakPolarHBondContact O-CB 3.5Å; K978-D982 PolarHBondContact O-N 3.02Å
979	E	87	Confident	88.3	Confident	92 Å²	92	56.6 Å²	56.6	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-63	-39.4	176.1	-162.6	-164.6	-156.6	0	0	111.9	E975 T976 R983	E975-E979 WeakPolarHBondContact O-CB 3.37Å; E975-E979 PolarHBondContact O-N 3.23Å; T976-E979 PolarHBondContact O-N 3.31Å; E979-R983 WeakPolarHBondContact O-CB 3.32Å; E979-R983 VanDerWaalsContact O-CG 3.3Å; E979-R983 WeakPolarHBondContact O-CG 3.33Å; E979-R983 PolarHBondContact O-N 3.4Å; E979-R983 IonicContact OE1-CZ 2.72Å; E979-R983 IonicContact OE1-NH1 3.32Å; E979-R983 IonicContact OE1-NH2 2.65Å; E979-R983 PolarHBondContact OE1-NH2 3.02Å; E979-R983 IonicContact OE2-CZ 3.66Å; E979-R983 IonicContact OE2-NH1 3.7Å; E979-R983 PolarHBondContact OE2-NH1 2.92Å; E979-R983 IonicContact OE2-NH2 3.07Å; E979-R983 PolarHBondContact OE2-NH2 3.14Å
980	L	85.2	Confident	88	Confident	111 Å²	111	52.4 Å²	52.4	58%	0.581	27%	0.271	S	S	*	.	H	α-helix	trans	-62.1	-42.8	173.6	177.2	63.1	0	0	0	112	T976 E977 K978 K984	T976-L980 WeakPolarHBondContact O-CB 3.48Å; T976-L980 PolarHBondContact O-N 2.81Å; E977-L980 PolarHBondContact O-N 2.83Å; K978-L980 VanDerWaalsContact C-N 3.34Å; K978-L980 PolarHBondContact O-N 2.9Å; L980-K984 WeakPolarHBondContact O-CB 3.32Å; L980-K984 PolarHBondContact O-N 2.8Å
981	M	83.2	Confident	87.6	Confident	26 Å²	26	55.2 Å²	55.2	13%	0.128	29%	0.291	C	S	.	.	H	α-helix	trans	-72.6	-38.5	178.9	-163.9	71.8	101	0	0	112	R871 Y875 E977 K978 R983 K984 S985	R871-M981 HydrophobicContact CG-CB 3.81Å; R871-M981 HydrophobicContact CG-CE 4.18Å; R871-M981 HydrophobicContact CG-CG 4.32Å; Y875-M981 HydrophobicContact CD2-CG 4.39Å; Y875-M981 HydrophobicContact CE2-CB 4.41Å; Y875-M981 HydrophobicContact CE2-CG 3.44Å; Y875-M981 VanDerWaalsContact CE2-CG 3.44Å; Y875-M981 PolarHBondContact OH-O 2.83Å; E977-M981 PolarHBondContact O-N 2.86Å; K978-M981 PolarHBondContact O-N 3.45Å; M981-R983 PolarHBondContact O-N 3.28Å; M981-K984 CarbonylContact O-C 3.6Å; M981-K984 WeakPolarHBondContact O-CB 3.23Å; M981-K984 PolarHBondContact O-N 2.81Å; M981-K984 VanDerWaalsContact O-N 3.12Å; M981-S985 WeakPolarHBondContact O-CB 3.23Å; M981-S985 PolarHBondContact O-N 3.28Å
982	D	83.8	Confident	87.3	Confident	52 Å²	52	58.5 Å²	58.5	28%	0.278	32%	0.316	S	S	.	.	H	α-helix	trans	-62.8	-41.7	174.1	-76	-18.1	0	0	0	111.1	T874 K978 S985 R986	T874-D982 WeakPolarHBondContact CB-OD1 3.45Å; T874-D982 VanDerWaalsContact CG2-OD1 3.26Å; T874-D982 WeakPolarHBondContact CG2-OD1 3.45Å; T874-D982 PolarHBondContact OG1-OD1 3.44Å; T874-D982 PolarHBondContact OG1-OD2 2.89Å; K978-D982 WeakPolarHBondContact O-CB 3.5Å; K978-D982 PolarHBondContact O-N 3.02Å; D982-S985 VanDerWaalsContact O-CB 3.31Å; D982-S985 WeakPolarHBondContact O-CB 3.41Å; D982-S985 PolarHBondContact O-N 3.24Å; D982-R986 PolarHBondContact O-N 2.75Å
983	R	82.8	Confident	87.1	Confident	78 Å²	78	54.9 Å²	54.9	29%	0.294	30%	0.295	S	S	.	.	H	α-helix	trans	-57.4	-47.8	168.2	-75.6	178.2	-177.7	116.1	5.7	111.5	E979 M981 S985 R986 L987	E979-R983 WeakPolarHBondContact O-CB 3.32Å; E979-R983 VanDerWaalsContact O-CG 3.3Å; E979-R983 WeakPolarHBondContact O-CG 3.33Å; E979-R983 PolarHBondContact O-N 3.4Å; E979-R983 IonicContact OE1-CZ 2.72Å; E979-R983 IonicContact OE1-NH1 3.32Å; E979-R983 IonicContact OE1-NH2 2.65Å; E979-R983 PolarHBondContact OE1-NH2 3.02Å; E979-R983 IonicContact OE2-CZ 3.66Å; E979-R983 IonicContact OE2-NH1 3.7Å; E979-R983 PolarHBondContact OE2-NH1 2.92Å; E979-R983 IonicContact OE2-NH2 3.07Å; E979-R983 PolarHBondContact OE2-NH2 3.14Å; M981-R983 PolarHBondContact O-N 3.28Å; R983-S985 VanDerWaalsContact C-N 3.3Å; R983-S985 PolarHBondContact O-N 2.9Å; R983-R986 PolarHBondContact O-N 2.79Å; R983-R986 VanDerWaalsContact O-N 3.11Å; R983-L987 WeakPolarHBondContact O-CG 3.42Å; R983-L987 PolarHBondContact O-N 2.81Å
984	K	82.2	Confident	87	Confident	81 Å²	81	54.3 Å²	54.3	35%	0.352	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-36.6	179	-167.9	163.9	-173.8	161.6	0	112.5	L980 M981 L987 L988	L980-K984 WeakPolarHBondContact O-CB 3.32Å; L980-K984 PolarHBondContact O-N 2.8Å; M981-K984 CarbonylContact O-C 3.6Å; M981-K984 WeakPolarHBondContact O-CB 3.23Å; M981-K984 PolarHBondContact O-N 2.81Å; M981-K984 VanDerWaalsContact O-N 3.12Å; K984-L987 PolarHBondContact O-N 3.17Å; K984-L988 WeakPolarHBondContact O-CG 3.43Å; K984-L988 PolarHBondContact O-N 3.35Å
985	S	82.2	Confident	86.9	Confident	41 Å²	41	56.6 Å²	56.6	29%	0.287	30%	0.298	S	S	.	.	H	α-helix	trans	-59.8	-44	171.8	-147.9	0	0	0	0	112.1	Y875 M981 D982 R983 T989	Y875-S985 WeakPolarHBondContact OH-CB 3.33Å; Y875-S985 PolarHBondContact OH-OG 3.14Å; Y875-S985 VanDerWaalsContact OH-OG 3.09Å; M981-S985 WeakPolarHBondContact O-CB 3.23Å; M981-S985 PolarHBondContact O-N 3.28Å; D982-S985 VanDerWaalsContact O-CB 3.31Å; D982-S985 WeakPolarHBondContact O-CB 3.41Å; D982-S985 PolarHBondContact O-N 3.24Å; R983-S985 VanDerWaalsContact C-N 3.3Å; R983-S985 PolarHBondContact O-N 2.9Å; S985-T989 WeakPolarHBondContact O-CB 3.5Å; S985-T989 PolarHBondContact O-N 2.98Å; S985-T989 VanDerWaalsContact O-N 3.08Å; S985-T989 PolarHBondContact O-OG1 3.2Å
986	R	87.6	Confident	86.9	Confident	55 Å²	55	53.5 Å²	53.5	21%	0.208	28%	0.284	C	S	.	.	H	α-helix	trans	-68.1	-40.2	176.2	-174.8	56.6	178.4	162.2	5.5	112	D982 R983 T989 L990 L1010 E1013	D982-R986 PolarHBondContact O-N 2.75Å; R983-R986 PolarHBondContact O-N 2.79Å; R983-R986 VanDerWaalsContact O-N 3.11Å; R986-T989 PolarHBondContact O-N 3.03Å; R986-L990 HydrophobicContact CG-CD1 4.08Å; R986-L990 HydrophobicContact CG-CG 4.39Å; R986-L990 WeakPolarHBondContact O-CB 3.46Å; R986-L990 WeakPolarHBondContact O-CG 3.37Å; R986-L990 PolarHBondContact O-N 2.82Å; R986-L1010 HydrophobicContact CG-CD2 3.99Å; R986-E1013 IonicContact CZ-OE1 3.96Å; R986-E1013 IonicContact CZ-OE2 3.08Å; R986-E1013 IonicContact NE-OE1 2.64Å; R986-E1013 PolarHBondContact NE-OE1 2.95Å; R986-E1013 IonicContact NE-OE2 2.62Å; R986-E1013 PolarHBondContact NE-OE2 3.17Å; R986-E1013 VanDerWaalsContact NH2-CD 3.29Å; R986-E1013 IonicContact NH2-OE1 2.59Å; R986-E1013 PolarHBondContact NH2-OE1 2.83Å; R986-E1013 IonicContact NH2-OE2 3.66Å; R986-E1013 PolarHBondContact NH2-OE2 2.97Å
987	L	87.5	Confident	86.7	Confident	18 Å²	18	51.3 Å²	51.3	9%	0.094	27%	0.271	C	S	.	.	H	α-helix	trans	-60.3	-45.5	175.8	-69.8	170.3	0	0	0	112.4	R983 K984 L990 S991 K1008 L1010 F1045	R983-L987 WeakPolarHBondContact O-CG 3.42Å; R983-L987 PolarHBondContact O-N 2.81Å; K984-L987 PolarHBondContact O-N 3.17Å; L987-L990 PolarHBondContact O-N 3.37Å; L987-S991 VanDerWaalsContact O-CB 3.31Å; L987-S991 WeakPolarHBondContact O-CB 3.49Å; L987-S991 PolarHBondContact O-N 2.75Å; L987-K1008 WeakPolarHBondContact CD1-O 3.19Å; L987-K1008 WeakPolarHBondContact CD2-O 3.42Å; L987-L1010 HydrophobicContact CD2-CB 4.06Å; L987-F1045 HydrophobicContact CD2-CD1 4.35Å; L987-F1045 HydrophobicContact CD2-CE1 3.62Å
988	L	83.8	Confident	86.5	Confident	74 Å²	74	56.3 Å²	56.3	39%	0.387	30%	0.299	S	S	.	.	H	α-helix	trans	-63	-44.7	175.7	-70.6	169.6	0	0	0	111.5	K984 S991 S992	K984-L988 WeakPolarHBondContact O-CG 3.43Å; K984-L988 PolarHBondContact O-N 3.35Å; L988-S991 PolarHBondContact O-N 2.73Å; L988-S992 PolarHBondContact O-N 3.22Å; L988-S992 VanDerWaalsContact O-N 3.11Å
989	T	86.2	Confident	86.1	Confident	59 Å²	59	59.7 Å²	59.7	36%	0.362	32%	0.319	S	S	.	.	H	α-helix	trans	-57.4	-52.2	175.4	-55.5	0	0	0	0	111.1	S985 R986 S991 S992 S993	S985-T989 WeakPolarHBondContact O-CB 3.5Å; S985-T989 PolarHBondContact O-N 2.98Å; S985-T989 VanDerWaalsContact O-N 3.08Å; S985-T989 PolarHBondContact O-OG1 3.2Å; R986-T989 PolarHBondContact O-N 3.03Å; T989-S991 PolarHBondContact O-N 3.44Å; T989-S992 PolarHBondContact O-N 3.01Å; T989-S992 VanDerWaalsContact O-N 3.15Å; T989-S992 PolarHBondContact O-OG 3.25Å; T989-S993 PolarHBondContact O-N 2.73Å
990	L	89.2	Confident	86	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-43.2	176.9	-75.4	172.4	0	0	0	112.2	R986 L987 S992 S993 L994 I1005 L1010 I1043 F1060	R986-L990 HydrophobicContact CG-CD1 4.08Å; R986-L990 HydrophobicContact CG-CG 4.39Å; R986-L990 WeakPolarHBondContact O-CB 3.46Å; R986-L990 WeakPolarHBondContact O-CG 3.37Å; R986-L990 PolarHBondContact O-N 2.82Å; L987-L990 PolarHBondContact O-N 3.37Å; L990-S992 PolarHBondContact O-N 2.7Å; L990-S993 PolarHBondContact O-N 2.88Å; L990-L994 VanDerWaalsContact O-CG 3.29Å; L990-L994 WeakPolarHBondContact O-CG 3.42Å; L990-L994 PolarHBondContact O-N 3.15Å; L990-I1005 HydrophobicContact CB-CD1 3.75Å; L990-L1010 HydrophobicContact CD1-CD2 4.15Å; L990-I1043 HydrophobicContact CD1-CG2 4.39Å; L990-I1043 HydrophobicContact CD2-CD1 4.06Å; L990-F1060 HydrophobicContact CD2-CD2 4.09Å; L990-F1060 HydrophobicContact CD2-CE2 3.82Å
991	S	87.6	Confident	86	Confident	60 Å²	60	57.1 Å²	57.1	42%	0.42	30%	0.302	S	S	.	.	H	α-helix	trans	-64.7	-22.7	179.7	-168	0	0	0	0	112.9	L987 L988 T989	L987-S991 VanDerWaalsContact O-CB 3.31Å; L987-S991 WeakPolarHBondContact O-CB 3.49Å; L987-S991 PolarHBondContact O-N 2.75Å; L988-S991 PolarHBondContact O-N 2.73Å; T989-S991 PolarHBondContact O-N 3.44Å
992	S	86.1	Confident	86.1	Confident	101 Å²	101	63.7 Å²	63.7	71%	0.706	33%	0.326	S	S	*	.	H	α-helix	trans	-86.5	-18.8	173.9	77.2	0	0	0	0	114	L988 T989 L990	L988-S992 PolarHBondContact O-N 3.22Å; L988-S992 VanDerWaalsContact O-N 3.11Å; T989-S992 PolarHBondContact O-N 3.01Å; T989-S992 VanDerWaalsContact O-N 3.15Å; T989-S992 PolarHBondContact O-OG 3.25Å; L990-S992 PolarHBondContact O-N 2.7Å
993	S	90	Very high	86.2	Confident	13 Å²	13	63.2 Å²	63.2	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-111.8	-5.2	-173.7	80.5	0	0	0	0	114.9	T989 L990 E995 E1058 R1059 F1060	T989-S993 PolarHBondContact O-N 2.73Å; L990-S993 PolarHBondContact O-N 2.88Å; S993-E995 PolarHBondContact O-N 3.05Å; S993-E1058 WeakPolarHBondContact CB-O 3.43Å; S993-E1058 PolarHBondContact OG-O 3.47Å; S993-R1059 CarbonylContact O-C 3.56Å; S993-R1059 VanDerWaalsContact O-CA 3.27Å; S993-R1059 WeakPolarHBondContact O-CA 3.48Å; S993-F1060 PolarHBondContact O-N 3.24Å; S993-F1060 WeakPolarHBondContact OG-CD2 3.37Å
994	L	91.5	Very high	86.4	Confident	18 Å²	18	62.2 Å²	62.2	9%	0.094	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	116.2	171.8	-76.7	162.6	0	0	0	112	L990 F996 I1005 I1043 L1050 T1052 F1060 V1062	L990-L994 VanDerWaalsContact O-CG 3.29Å; L990-L994 WeakPolarHBondContact O-CG 3.42Å; L990-L994 PolarHBondContact O-N 3.15Å; L994-F996 HydrophobicContact CB-CE2 4Å; L994-I1005 HydrophobicContact CD1-CD1 3.67Å; L994-I1005 HydrophobicContact CD1-CG1 4.27Å; L994-I1005 HydrophobicContact CD1-CG2 4.36Å; L994-I1043 HydrophobicContact CD2-CD1 4.26Å; L994-L1050 HydrophobicContact CD1-CD2 4.3Å; L994-L1050 HydrophobicContact CD2-CD2 4.09Å; L994-T1052 HydrophobicContact CD2-CG2 4.2Å; L994-F1060 WeakPolarHBondContact CA-O 3.33Å; L994-F1060 HydrophobicContact CD2-CB 3.98Å; L994-V1062 HydrophobicContact CD2-CG2 3.6Å
995	E	89.7	Confident	86.6	Confident	47 Å²	47	58.4 Å²	58.4	22%	0.22	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	118.3	171.5	-67	-174.9	161.9	0	0	110.1	S993 K1055 R1059 F1060 L1061 V1062	S993-E995 PolarHBondContact O-N 3.05Å; E995-K1055 WeakPolarHBondContact OE2-CD 3.22Å; E995-K1055 WeakPolarHBondContact OE2-CE 3.08Å; E995-K1055 IonicContact OE2-NZ 2.77Å; E995-K1055 PolarHBondContact OE2-NZ 3.4Å; E995-R1059 IonicContact OE1-CZ 2.66Å; E995-R1059 IonicContact OE1-NE 3.24Å; E995-R1059 IonicContact OE1-NH1 2.71Å; E995-R1059 PolarHBondContact OE1-NH1 2.73Å; E995-R1059 IonicContact OE1-NH2 3.07Å; E995-F1060 PolarHBondContact N-O 2.83Å; E995-L1061 HydrophobicContact CB-CD1 4.34Å; E995-L1061 WeakPolarHBondContact O-CA 3.44Å; E995-V1062 PolarHBondContact O-N 2.88Å
996	F	90.1	Very high	86.5	Confident	24 Å²	24	59.2 Å²	59.2	11%	0.105	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-97	121.2	172.5	-63.2	-96.5	0	0	0	109.7	L994 V1000 R1002 I1003 V1062	L994-F996 HydrophobicContact CB-CE2 4Å; F996-V1000 HydrophobicContact CD1-CG1 4.23Å; F996-R1002 HydrophobicContact CB-CG 3.75Å; F996-R1002 HydrophobicContact CD2-CB 4.47Å; F996-R1002 HydrophobicContact CD2-CG 4.1Å; F996-R1002 HydrophobicContact CG-CB 4.37Å; F996-R1002 HydrophobicContact CG-CG 3.88Å; F996-R1002 PolarHBondContact O-NH2 2.85Å; F996-R1002 VanDerWaalsContact O-NH2 3.12Å; F996-I1003 HydrophobicContact CE1-CB 4.44Å; F996-I1003 HydrophobicContact CE1-CD1 4.36Å; F996-I1003 HydrophobicContact CE1-CG1 3.95Å; F996-I1003 HydrophobicContact CZ-CB 4.43Å; F996-I1003 HydrophobicContact CZ-CG1 4.42Å; F996-V1062 HydrophobicContact CD1-CB 4.08Å; F996-V1062 HydrophobicContact CD1-CG1 4.36Å; F996-V1062 HydrophobicContact CD1-CG2 3.96Å; F996-V1062 HydrophobicContact CE1-CB 4.31Å; F996-V1062 HydrophobicContact CE1-CG1 4.31Å; F996-V1062 HydrophobicContact CE1-CG2 3.86Å; F996-V1062 HydrophobicContact CG-CG2 4.37Å; F996-V1062 HydrophobicContact CZ-CG2 4.18Å
997	P	87.5	Confident	86.1	Confident	36 Å²	36	60.3 Å²	60.3	23%	0.234	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-75.2	160.6	170.1	33.8	-35	0	0	0	110.9	N999 V1000 L1061 V1062	P997-N999 WeakPolarHBondContact CB-OD1 3.4Å; P997-N999 WeakPolarHBondContact CG-OD1 3.36Å; P997-N999 PolarHBondContact O-N 3.36Å; P997-V1000 HydrophobicContact CG-CB 4.19Å; P997-V1000 HydrophobicContact CG-CG2 3.89Å; P997-V1000 PolarHBondContact O-N 2.93Å; P997-V1000 VanDerWaalsContact O-O 3.14Å; P997-L1061 HydrophobicContact CB-CD1 4.29Å; P997-L1061 HydrophobicContact CG-CD1 4.16Å; P997-V1062 WeakPolarHBondContact CD-O 3.37Å; P997-V1062 WeakPolarHBondContact CG-O 3.26Å
998	D	83.5	Confident	86	Confident	161 Å²	161	60.5 Å²	60.5	86%	0.861	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.3	-168.7	-54.7	-52.4	0	0	0	114.8
999	N	82.6	Confident	86.1	Confident	106 Å²	106	62.7 Å²	62.7	57%	0.567	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-7.6	173	70.2	-66.9	0	0	0	114.1	P997 H1276	P997-N999 WeakPolarHBondContact CB-OD1 3.4Å; P997-N999 WeakPolarHBondContact CG-OD1 3.36Å; P997-N999 PolarHBondContact O-N 3.36Å; N999-H1276 PolarHBondContact O-CE1 2.59Å
1000	V	83.9	Confident	86.2	Confident	6 Å²	6	61 Å²	61	4%	0.036	32%	0.322	C	S	.	.	S	Bend	trans	-118.1	121.4	-179.6	-177.4	0	0	0	0	109.8	F996 P997 R1002 V1062 Y1065	F996-V1000 HydrophobicContact CD1-CG1 4.23Å; P997-V1000 HydrophobicContact CG-CB 4.19Å; P997-V1000 HydrophobicContact CG-CG2 3.89Å; P997-V1000 PolarHBondContact O-N 2.93Å; P997-V1000 VanDerWaalsContact O-O 3.14Å; V1000-R1002 PolarHBondContact O-N 3.29Å; V1000-V1062 HydrophobicContact CG1-CG1 4.02Å; V1000-Y1065 HydrophobicContact CG1-CD1 3.88Å; V1000-Y1065 HydrophobicContact CG1-CE1 3.88Å
1001	K	85.1	Confident	86.2	Confident	144 Å²	144	64.5 Å²	64.5	63%	0.626	34%	0.34	S	S	*	.			trans	-60.4	131.3	178.9	-178.2	179.9	177	-176.2	0	111	I1003 H1276	K1001-I1003 WeakPolarHBondContact O-CG1 3.41Å; K1001-H1276 VanDerWaalsContact CB-NE2 3.26Å; K1001-H1276 WeakPolarHBondContact CB-NE2 3.34Å; K1001-H1276 PolarHBondContact N-CE1 3.49Å; K1001-H1276 PolarHBondContact N-NE2 2.98Å
1002	R	85.5	Confident	86.4	Confident	163 Å²	163	63.2 Å²	63.2	62%	0.615	33%	0.327	S	S	*	.			trans	-64.3	138.7	174.1	-65.4	176.8	-169	-78.9	-15.6	110.5	F996 V1000	F996-R1002 HydrophobicContact CB-CG 3.75Å; F996-R1002 HydrophobicContact CD2-CB 4.47Å; F996-R1002 HydrophobicContact CD2-CG 4.1Å; F996-R1002 HydrophobicContact CG-CB 4.37Å; F996-R1002 HydrophobicContact CG-CG 3.88Å; F996-R1002 PolarHBondContact O-NH2 2.85Å; F996-R1002 VanDerWaalsContact O-NH2 3.12Å; V1000-R1002 PolarHBondContact O-N 3.29Å
1003	I	86.5	Confident	86.7	Confident	42 Å²	42	60.6 Å²	60.6	22%	0.215	30%	0.303	C	S	.	.			trans	-130.9	143.1	-178.8	-30.5	167.5	0	0	0	108.8	F996 K1001 M1048 Y1065	F996-I1003 HydrophobicContact CE1-CB 4.44Å; F996-I1003 HydrophobicContact CE1-CD1 4.36Å; F996-I1003 HydrophobicContact CE1-CG1 3.95Å; F996-I1003 HydrophobicContact CZ-CB 4.43Å; F996-I1003 HydrophobicContact CZ-CG1 4.42Å; K1001-I1003 WeakPolarHBondContact O-CG1 3.41Å; I1003-M1048 HydrophobicContact CD1-CE 3.42Å; I1003-M1048 VanDerWaalsContact CD1-CE 3.42Å; I1003-M1048 HydrophobicContact CD1-SD 3.83Å; I1003-M1048 HydrophobicContact CG2-CE 4.2Å; I1003-Y1065 HydrophobicContact CD1-CD1 3.63Å; I1003-Y1065 HydrophobicContact CD1-CD2 3.58Å; I1003-Y1065 HydrophobicContact CD1-CE1 3.55Å; I1003-Y1065 HydrophobicContact CD1-CE2 3.53Å; I1003-Y1065 HydrophobicContact CD1-CG 3.61Å; I1003-Y1065 VanDerWaalsContact CD1-CZ 3.49Å; I1003-Y1065 HydrophobicContact CG1-CE1 4.04Å; I1003-Y1065 HydrophobicContact CG1-CE2 4.35Å
1004	A	85.9	Confident	86.7	Confident	57 Å²	57	60.4 Å²	60.4	47%	0.471	30%	0.304	S	S	.	.			trans	-74.2	146.9	162.4	0	0	0	0	0	110.3
1005	I	87.4	Confident	86.7	Confident	1 Å²	1	63 Å²	63	1%	0.005	32%	0.315	C	S	.	.			trans	-125.3	7.9	171	67.2	155.2	0	0	0	112.6	L990 L994 D1007 K1008 F1045	L990-I1005 HydrophobicContact CB-CD1 3.75Å; L994-I1005 HydrophobicContact CD1-CD1 3.67Å; L994-I1005 HydrophobicContact CD1-CG1 4.27Å; L994-I1005 HydrophobicContact CD1-CG2 4.36Å; I1005-D1007 VanDerWaalsContact C-N 3.3Å; I1005-D1007 PolarHBondContact O-N 3.49Å; I1005-K1008 HydrophobicContact CB-CD 4.38Å; I1005-K1008 HydrophobicContact CG2-CD 4.28Å; I1005-K1008 PolarHBondContact O-N 3.45Å; I1005-F1045 HydrophobicContact CB-CE1 4.19Å; I1005-F1045 HydrophobicContact CB-CZ 4Å; I1005-F1045 HydrophobicContact CD1-CE1 4.28Å; I1005-F1045 HydrophobicContact CD1-CZ 3.82Å; I1005-F1045 HydrophobicContact CG2-CE2 4.34Å; I1005-F1045 HydrophobicContact CG2-CZ 4.03Å
1006	S	78.9	Confident	86.7	Confident	59 Å²	59	60.8 Å²	60.8	41%	0.413	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-23.8	-175.1	44.9	0	0	0	0	113.9
1007	D	79.6	Confident	86.4	Confident	78 Å²	78	63.8 Å²	63.8	42%	0.417	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.9	176.9	65.1	-38.9	0	0	0	113.3	I1005	I1005-D1007 VanDerWaalsContact C-N 3.3Å; I1005-D1007 PolarHBondContact O-N 3.49Å
1008	K	85.8	Confident	86.2	Confident	21 Å²	21	64.2 Å²	64.2	9%	0.091	31%	0.314	C	S	.	.			trans	-92.7	143.6	-173.6	-62	-173.9	176.4	-70	0	112.6	L987 I1005 F1045 D1047 M1048	L987-K1008 WeakPolarHBondContact CD1-O 3.19Å; L987-K1008 WeakPolarHBondContact CD2-O 3.42Å; I1005-K1008 HydrophobicContact CB-CD 4.38Å; I1005-K1008 HydrophobicContact CG2-CD 4.28Å; I1005-K1008 PolarHBondContact O-N 3.45Å; K1008-F1045 HydrophobicContact CB-CB 4.2Å; K1008-F1045 HydrophobicContact CB-CD1 3.41Å; K1008-F1045 VanDerWaalsContact CB-CD1 3.41Å; K1008-F1045 HydrophobicContact CB-CE1 3.98Å; K1008-F1045 HydrophobicContact CB-CG 3.96Å; K1008-F1045 HydrophobicContact CD-CB 4.41Å; K1008-F1045 HydrophobicContact CD-CD1 4.31Å; K1008-F1045 HydrophobicContact CD-CD2 4.47Å; K1008-F1045 HydrophobicContact CD-CG 4.14Å; K1008-F1045 HydrophobicContact CG-CD1 4.49Å; K1008-D1047 IonicContact NZ-OD1 2.58Å; K1008-D1047 PolarHBondContact NZ-OD1 3Å; K1008-D1047 IonicContact NZ-OD2 2.71Å; K1008-D1047 PolarHBondContact NZ-OD2 2.84Å; K1008-M1048 HydrophobicContact CD-CE 4.01Å
1009	R	86	Confident	85.5	Confident	120 Å²	120	58.1 Å²	58.1	45%	0.453	28%	0.284	S	S	.	.			trans	-95.4	108.3	177.5	-179.9	170.8	172.8	168.7	-5.7	109.9	E404 I1011 F1045 N1046	E404-R1009 IonicContact OE1-CZ 3.68Å; E404-R1009 IonicContact OE1-NH1 3.24Å; E404-R1009 PolarHBondContact OE1-NH1 3.26Å; E404-R1009 IonicContact OE2-NH1 2.8Å; E404-R1009 PolarHBondContact OE2-NH1 2.71Å; R1009-I1011 PolarHBondContact O-N 3.29Å; R1009-F1045 CarbonylContact O-C 3.53Å; R1009-F1045 VanDerWaalsContact O-CA 3.3Å; R1009-F1045 WeakPolarHBondContact O-CA 3.47Å; R1009-N1046 HydrophobicContact CB-CB 4.15Å; R1009-N1046 PolarHBondContact N-OD1 3.12Å; R1009-N1046 PolarHBondContact O-N 3.07Å; R1009-N1046 PolarHBondContact O-OD1 3.06Å
1010	L	88.4	Confident	84.2	Confident	25 Å²	25	59.3 Å²	59.3	13%	0.131	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	124.7	174.6	-179.2	64.8	0	0	0	110.3	R986 L987 L990 I1043 F1045	R986-L1010 HydrophobicContact CG-CD2 3.99Å; L987-L1010 HydrophobicContact CD2-CB 4.06Å; L990-L1010 HydrophobicContact CD1-CD2 4.15Å; L1010-I1043 HydrophobicContact CD1-CG2 3.5Å; L1010-F1045 HydrophobicContact CB-CD1 4.37Å; L1010-F1045 HydrophobicContact CB-CE1 4.36Å; L1010-F1045 HydrophobicContact CD1-CE1 4.35Å
1011	I	89.2	Confident	82.7	Confident	72 Å²	72	63.1 Å²	63.1	37%	0.369	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-51.7	174.7	-70.3	-176.9	0	0	0	110.4	R1009 L1044 N1046 A1299	R1009-I1011 PolarHBondContact O-N 3.29Å; I1011-L1044 WeakPolarHBondContact CA-O 3.38Å; I1011-L1044 HydrophobicContact CB-CD2 4.49Å; I1011-L1044 HydrophobicContact CB-CG 4.32Å; I1011-L1044 WeakPolarHBondContact CB-O 3.47Å; I1011-L1044 HydrophobicContact CG2-CD2 4.13Å; I1011-L1044 PolarHBondContact N-O 2.83Å; I1011-N1046 HydrophobicContact CD1-CB 4.39Å; I1011-A1299 HydrophobicContact CG2-CB 4.31Å
1012	K	90.8	Very high	80.6	Confident	33 Å²	33	62.5 Å²	62.5	14%	0.143	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	146.3	-179.4	-176.6	170.2	168.4	66.5	0	111.4	L1044 S1295 W1296 A1299	K1012-L1044 PolarHBondContact N-O 2.81Å; K1012-L1044 VanDerWaalsContact N-O 3.14Å; K1012-L1044 PolarHBondContact O-N 3.23Å; K1012-S1295 WeakPolarHBondContact CE-OG 3.48Å; K1012-S1295 PolarHBondContact NZ-OG 3.36Å; K1012-W1296 HydrophobicContact CB-CH2 4.36Å; K1012-W1296 HydrophobicContact CB-CZ3 4.14Å; K1012-W1296 HydrophobicContact CD-CD2 3.73Å; K1012-W1296 HydrophobicContact CD-CE3 3.7Å; K1012-W1296 HydrophobicContact CD-CG 4.2Å; K1012-W1296 HydrophobicContact CD-CH2 4.34Å; K1012-W1296 HydrophobicContact CD-CZ2 4.39Å; K1012-W1296 HydrophobicContact CD-CZ3 4.02Å; K1012-W1296 VanDerWaalsContact CE-CD1 3.47Å; K1012-W1296 HydrophobicContact CG-CD2 4.37Å; K1012-W1296 HydrophobicContact CG-CE3 4.17Å; K1012-W1296 HydrophobicContact CG-CH2 3.94Å; K1012-W1296 HydrophobicContact CG-CZ2 4.17Å; K1012-W1296 HydrophobicContact CG-CZ3 3.95Å; K1012-A1299 HydrophobicContact CB-CB 4.06Å; K1012-A1299 HydrophobicContact CD-CB 3.81Å
1013	E	91.9	Very high	78.1	Confident	46 Å²	46	61.8 Å²	61.8	22%	0.215	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	164.8	164.9	60.2	-176.2	164.8	0	0	110.1	R986 Y1041 L1042	R986-E1013 IonicContact CZ-OE1 3.96Å; R986-E1013 IonicContact CZ-OE2 3.08Å; R986-E1013 IonicContact NE-OE1 2.64Å; R986-E1013 PolarHBondContact NE-OE1 2.95Å; R986-E1013 IonicContact NE-OE2 2.62Å; R986-E1013 PolarHBondContact NE-OE2 3.17Å; R986-E1013 VanDerWaalsContact NH2-CD 3.29Å; R986-E1013 IonicContact NH2-OE1 2.59Å; R986-E1013 PolarHBondContact NH2-OE1 2.83Å; R986-E1013 IonicContact NH2-OE2 3.66Å; R986-E1013 PolarHBondContact NH2-OE2 2.97Å; E1013-Y1041 HydrophobicContact CB-CE1 3.86Å; E1013-Y1041 HydrophobicContact CG-CE1 4.46Å; E1013-Y1041 PolarHBondContact OE2-OH 3.3Å; E1013-L1042 VanDerWaalsContact CA-O 3.27Å; E1013-L1042 WeakPolarHBondContact CA-O 3.24Å
1014	G	91.8	Very high	75.5	Confident	9 Å²	9	62.5 Å²	62.5	9%	0.093	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.4	176.3	-177	0	0	0	0	0	113.9	Y1041 L1042	G1014-Y1041 WeakPolarHBondContact O-CA 3.46Å; G1014-L1042 PolarHBondContact N-O 3.47Å; G1014-L1042 PolarHBondContact O-N 3.04Å
1015	E	90.5	Very high	73	Confident	72 Å²	72	70 Å²	70	34%	0.336	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.2	-175.7	-75.4	179	-138.2	0	0	111.2	Y1041 K1054 E1292	E1015-Y1041 HydrophobicContact CG-CD2 3.36Å; E1015-Y1041 HydrophobicContact CG-CE2 3.9Å; E1015-Y1041 HydrophobicContact CG-CG 4.33Å; E1015-K1054 WeakPolarHBondContact OE1-CD 3.49Å; E1015-K1054 WeakPolarHBondContact OE1-CE 3.27Å; E1015-K1054 IonicContact OE1-NZ 3.3Å; E1015-K1054 PolarHBondContact OE1-NZ 2.95Å; E1015-E1292 PolarHBondContact N-OE1 3.19Å
1016	L	89	Confident	70.5	Confident	1 Å²	1	76 Å²	76	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	143.4	175.9	-69	178.2	0	0	0	110	F1040 L1042 L1285 W1296	L1016-F1040 PolarHBondContact N-O 3.03Å; L1016-F1040 PolarHBondContact O-N 3.01Å; L1016-L1042 HydrophobicContact CD1-CD1 3.89Å; L1016-L1285 HydrophobicContact CB-CB 4.13Å; L1016-L1285 HydrophobicContact CB-CD1 4.17Å; L1016-L1285 HydrophobicContact CB-CD2 4.32Å; L1016-L1285 HydrophobicContact CB-CG 4.45Å; L1016-L1285 HydrophobicContact CD1-CB 4.19Å; L1016-L1285 HydrophobicContact CD1-CD1 3.81Å; L1016-W1296 HydrophobicContact CD1-CD2 4.15Å; L1016-W1296 HydrophobicContact CD1-CG 4.08Å
1017	R	85	Confident	68.4	Low	87 Å²	87	76.3 Å²	76.3	33%	0.328	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.8	-178.1	-61.7	179.7	-52.4	-177.7	5.6	110.9	C1019 N1038 T1039 L1285 S1286 N1288	R1017-C1019 PolarHBondContact O-N 2.94Å; R1017-N1038 WeakPolarHBondContact CA-O 3.26Å; R1017-T1039 HydrophobicContact CG-CG2 4.03Å; R1017-L1285 CarbonylContact O-C 3.58Å; R1017-L1285 WeakPolarHBondContact O-CA 3.4Å; R1017-S1286 PolarHBondContact N-O 2.84Å; R1017-S1286 PolarHBondContact O-N 2.72Å; R1017-S1286 PolarHBondContact O-OG 2.96Å; R1017-N1288 PolarHBondContact NH1-ND2 3.22Å; R1017-N1288 PolarHBondContact NH1-OD1 3.09Å; R1017-N1288 PolarHBondContact NH2-OD1 3.24Å
1018	E	82.7	Confident	66.5	Low	45 Å²	45	78.2 Å²	78.2	21%	0.21	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	120.8	173.8	-169.3	171	-126.6	0	0	111.2	N1038 F1040 T1284	E1018-N1038 HydrophobicContact CB-CB 4.07Å; E1018-N1038 WeakPolarHBondContact CB-O 3.25Å; E1018-N1038 PolarHBondContact N-O 3.4Å; E1018-N1038 WeakPolarHBondContact OE2-CB 3.24Å; E1018-N1038 PolarHBondContact OE2-ND2 3.16Å; E1018-F1040 HydrophobicContact CB-CD2 4.32Å; E1018-F1040 HydrophobicContact CB-CE2 3.87Å; E1018-F1040 HydrophobicContact CG-CE2 4.15Å; E1018-T1284 CarbonylContact C-O 3.57Å; E1018-T1284 WeakPolarHBondContact CA-O 3.45Å
1019	C	68.6	Low	64.3	Low	33 Å²	33	85.4 Å²	85.4	22%	0.223	44%	0.436	C	S	.	.			trans	-88.8	109.3	166.4	-68.8	0	0	0	0	108.7	R1017 T1021 T1284 S1286	R1017-C1019 PolarHBondContact O-N 2.94Å; C1019-T1021 PolarHBondContact O-N 3Å; C1019-T1021 VanDerWaalsContact O-N 3.13Å; C1019-T1284 HydrophobicContact CB-CG2 4.01Å; C1019-T1284 PolarHBondContact N-O 3.5Å; C1019-S1286 VanDerWaalsContact SG-CB 3.58Å; C1019-S1286 PolarHBondContact SG-OG 3.44Å
1020	L	56.7	Low	62.4	Low	131 Å²	131	84.2 Å²	84.2	69%	0.686	44%	0.436	S	S	*	.			trans	-61.9	112.1	171	-70	165.4	0	0	0	109.7	D1022	L1020-D1022 PolarHBondContact O-N 2.89Å
1021	T	50.9	Low	60	Low	86 Å²	86	91.6 Å²	91.6	53%	0.528	47%	0.467	S	S	.	.			trans	-74.6	108.7	170.4	54.4	0	0	0	0	109	C1019 N1023 T1284	C1019-T1021 PolarHBondContact O-N 3Å; C1019-T1021 VanDerWaalsContact O-N 3.13Å; T1021-N1023 PolarHBondContact O-N 3.23Å; T1021-T1284 HydrophobicContact CG2-CG2 4.29Å
1022	D	40.8	Very low	57.7	Low	132 Å²	132	95.3 Å²	95.3	71%	0.706	49%	0.487	S	S	*	.			trans	-75.8	59.3	-170.8	-161.2	7.2	0	0	0	113.3	L1020	L1020-D1022 PolarHBondContact O-N 2.89Å
1023	N	33	Very low	55.1	Low	148 Å²	148	98 Å²	98	79%	0.791	51%	0.506	S	S	*	.			trans	-104.9	64.9	-170.9	-79.9	-24.9	0	0	0	112.6	T1021	T1021-N1023 PolarHBondContact O-N 3.23Å
1024	G	32.5	Very low	52.5	Low	57 Å²	57	103.2 Å²	103.2	59%	0.588	53%	0.534	S	S	*	.	S	Bend	trans	126.3	110.7	151.7	0	0	0	0	0	118	M1026	G1024-M1026 PolarHBondContact O-N 3.2Å
1025	R	33.1	Very low	50.3	Low	215 Å²	215	113 Å²	113	81%	0.811	57%	0.568	S	S	*	*			trans	52.5	51.7	155	-55.6	-175	-174.8	174.3	2.6	116.9	S1255	R1025-S1255 PolarHBondContact NH2-OG 2.88Å
1026	M	35.6	Very low	48.5	Very low	127 Å²	127	115.1 Å²	115.1	63%	0.626	58%	0.576	S	S	*	*			trans	-68.6	138	164	-71.4	-171.8	67.9	0	0	111.8	G1024 Q1030	G1024-M1026 PolarHBondContact O-N 3.2Å; M1026-Q1030 HydrophobicContact CE-CB 3.77Å; M1026-Q1030 HydrophobicContact CE-CG 4.48Å
1027	S	34.5	Very low	47.1	Very low	65 Å²	65	118.6 Å²	118.6	46%	0.455	60%	0.599	S	S	.	*			trans	-73.2	149.1	179.3	-179.8	0	0	0	0	111.7	F1029 Q1030	S1027-F1029 PolarHBondContact O-N 2.99Å; S1027-F1029 VanDerWaalsContact O-N 3.14Å; S1027-Q1030 PolarHBondContact O-N 3.37Å
1028	V	39.3	Very low	46.6	Very low	117 Å²	117	117.1 Å²	117.1	71%	0.709	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-54.9	-33.8	177.2	-177.8	0	0	0	0	111.6	Q1030 K1031	V1028-Q1030 VanDerWaalsContact C-N 3.28Å; V1028-Q1030 PolarHBondContact O-N 2.88Å; V1028-K1031 WeakPolarHBondContact O-CB 3.21Å; V1028-K1031 PolarHBondContact O-N 2.82Å
1029	F	40.2	Very low	46.7	Very low	173 Å²	173	118 Å²	118	76%	0.759	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-68.3	-19.8	177.5	-72.5	-84.3	0	0	0	114.5	S1027	S1027-F1029 PolarHBondContact O-N 2.99Å; S1027-F1029 VanDerWaalsContact O-N 3.14Å
1030	Q	46.3	Very low	47.7	Very low	95 Å²	95	117.1 Å²	117.1	44%	0.444	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-81.3	-18.7	173.2	-71.6	180	-62.2	0	0	113.2	M1026 S1027 V1028 L1032 T1033	M1026-Q1030 HydrophobicContact CE-CB 3.77Å; M1026-Q1030 HydrophobicContact CE-CG 4.48Å; S1027-Q1030 PolarHBondContact O-N 3.37Å; V1028-Q1030 VanDerWaalsContact C-N 3.28Å; V1028-Q1030 PolarHBondContact O-N 2.88Å; Q1030-L1032 PolarHBondContact O-N 3.08Å; Q1030-T1033 PolarHBondContact O-N 3.31Å; Q1030-T1033 PolarHBondContact O-OG1 2.92Å
1031	K	38.6	Very low	49.4	Very low	180 Å²	180	112 Å²	112	78%	0.783	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-66.4	-14.7	177.6	-90	-175.2	171.1	-179.1	0	114	V1028	V1028-K1031 WeakPolarHBondContact O-CB 3.21Å; V1028-K1031 PolarHBondContact O-N 2.82Å
1032	L	39.1	Very low	51.4	Low	150 Å²	150	107.9 Å²	107.9	79%	0.785	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-90.5	-6	177.9	-74.5	154.9	0	0	0	113.4	Q1030	Q1030-L1032 PolarHBondContact O-N 3.08Å
1033	T	36.7	Very low	54	Low	90 Å²	90	101.6 Å²	101.6	55%	0.552	51%	0.511	S	S	*	.	S	Bend	trans	-112.8	89	171.1	56.5	0	0	0	0	109.8	Q1030 R1035	Q1030-T1033 PolarHBondContact O-N 3.31Å; Q1030-T1033 PolarHBondContact O-OG1 2.92Å; T1033-R1035 VanDerWaalsContact C-N 3.3Å; T1033-R1035 PolarHBondContact O-N 3.46Å
1034	I	38.3	Very low	56.9	Low	154 Å²	154	94.5 Å²	94.5	79%	0.79	47%	0.473	S	S	*	.			trans	-71.7	85.1	-179.4	-54.3	177.8	0	0	0	109.4	K1036	I1034-K1036 PolarHBondContact O-N 2.89Å
1035	R	45.2	Very low	59.8	Low	215 Å²	215	91.8 Å²	91.8	81%	0.811	45%	0.445	S	S	*	.			trans	-65.5	103.4	170.5	-69.7	-174.6	175.3	-166	-3.1	108.6	T1033	T1033-R1035 VanDerWaalsContact C-N 3.3Å; T1033-R1035 PolarHBondContact O-N 3.46Å
1036	K	52.3	Low	62.5	Low	116 Å²	116	85 Å²	85	50%	0.504	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-53.1	135.5	175.1	-58.6	-166.6	-177.7	-165.9	0	109.3	E69 I1034	E69-K1036 IonicContact OE1-NZ 2.72Å; E69-K1036 PolarHBondContact OE1-NZ 2.63Å; I1034-K1036 PolarHBondContact O-N 2.89Å
1037	P	60.3	Low	65.1	Low	75 Å²	75	81.8 Å²	81.8	49%	0.487	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-59.2	140.2	-176.8	24.8	-34.3	0	0	0	110.6	T1039	P1037-T1039 PolarHBondContact O-N 3.03Å
1038	N	73.1	Confident	67.8	Low	56 Å²	56	79.3 Å²	79.3	30%	0.299	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-65.9	127.4	-176.9	-73.8	-66.8	0	0	0	111.1	R1017 E1018 F1040 K1053	R1017-N1038 WeakPolarHBondContact CA-O 3.26Å; E1018-N1038 HydrophobicContact CB-CB 4.07Å; E1018-N1038 WeakPolarHBondContact CB-O 3.25Å; E1018-N1038 PolarHBondContact N-O 3.4Å; E1018-N1038 WeakPolarHBondContact OE2-CB 3.24Å; E1018-N1038 PolarHBondContact OE2-ND2 3.16Å; N1038-F1040 HydrophobicContact CB-CD2 4.44Å; N1038-F1040 HydrophobicContact CB-CE2 3.97Å; N1038-F1040 HydrophobicContact CB-CZ 4.01Å; N1038-K1053 PolarHBondContact OD1-NZ 3.02Å
1039	T	85.1	Confident	70.4	Confident	62 Å²	62	73.7 Å²	73.7	38%	0.38	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	121.1	159.2	41.3	0	0	0	0	109.1	R1017 P1037	R1017-T1039 HydrophobicContact CG-CG2 4.03Å; P1037-T1039 PolarHBondContact O-N 3.03Å
1040	F	89.8	Confident	72.9	Confident	15 Å²	15	65.5 Å²	65.5	7%	0.066	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	135	168.9	-65.4	-70.2	0	0	0	109	L1016 E1018 N1038 L1042 V1051 L1063 L1283 L1285	L1016-F1040 PolarHBondContact N-O 3.03Å; L1016-F1040 PolarHBondContact O-N 3.01Å; E1018-F1040 HydrophobicContact CB-CD2 4.32Å; E1018-F1040 HydrophobicContact CB-CE2 3.87Å; E1018-F1040 HydrophobicContact CG-CE2 4.15Å; N1038-F1040 HydrophobicContact CB-CD2 4.44Å; N1038-F1040 HydrophobicContact CB-CE2 3.97Å; N1038-F1040 HydrophobicContact CB-CZ 4.01Å; F1040-L1042 HydrophobicContact CB-CD2 4.34Å; F1040-V1051 HydrophobicContact CD1-CG1 3.71Å; F1040-V1051 HydrophobicContact CE1-CG1 4.12Å; F1040-V1051 HydrophobicContact CG-CG1 4.3Å; F1040-L1063 HydrophobicContact CD1-CD1 3.95Å; F1040-L1063 HydrophobicContact CE1-CD1 3.66Å; F1040-L1283 HydrophobicContact CE2-CD2 4Å; F1040-L1283 HydrophobicContact CZ-CD2 4.02Å; F1040-L1285 HydrophobicContact CD2-CD2 3.74Å; F1040-L1285 HydrophobicContact CE2-CD2 4.36Å
1041	Y	92.7	Very high	75.1	Confident	23 Å²	23	61.1 Å²	61.1	9%	0.09	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	107.6	168.9	-166.5	-79.9	0	0	0	107.2	E1013 G1014 E1015 I1043 T1052 K1054 F1060	E1013-Y1041 HydrophobicContact CB-CE1 3.86Å; E1013-Y1041 HydrophobicContact CG-CE1 4.46Å; E1013-Y1041 PolarHBondContact OE2-OH 3.3Å; G1014-Y1041 WeakPolarHBondContact O-CA 3.46Å; E1015-Y1041 HydrophobicContact CG-CD2 3.36Å; E1015-Y1041 HydrophobicContact CG-CE2 3.9Å; E1015-Y1041 HydrophobicContact CG-CG 4.33Å; Y1041-I1043 HydrophobicContact CD1-CD1 4.26Å; Y1041-I1043 HydrophobicContact CD1-CG1 3.82Å; Y1041-I1043 HydrophobicContact CE1-CD1 4.32Å; Y1041-I1043 HydrophobicContact CE1-CG1 3.92Å; Y1041-T1052 PolarHBondContact N-O 3.37Å; Y1041-T1052 WeakPolarHBondContact O-CB 3.29Å; Y1041-T1052 PolarHBondContact O-N 2.71Å; Y1041-T1052 PolarHBondContact O-OG1 3.37Å; Y1041-K1054 HydrophobicContact CD2-CD 4.14Å; Y1041-F1060 AromaticContact CD1-CD1 3.69Å; Y1041-F1060 HydrophobicContact CD1-CD1 3.69Å; Y1041-F1060 AromaticContact CD1-CE1 3.42Å; Y1041-F1060 HydrophobicContact CD1-CE1 3.42Å; Y1041-F1060 VanDerWaalsContact CD1-CE1 3.42Å; Y1041-F1060 HydrophobicContact CD1-CZ 4.22Å; Y1041-F1060 HydrophobicContact CD2-CD1 4.41Å; Y1041-F1060 AromaticContact CD2-CE1 3.66Å; Y1041-F1060 HydrophobicContact CD2-CE1 3.66Å; Y1041-F1060 HydrophobicContact CE1-CD1 4.21Å; Y1041-F1060 AromaticContact CE1-CE1 3.58Å; Y1041-F1060 HydrophobicContact CE1-CE1 3.58Å; Y1041-F1060 AromaticContact CE1-CZ 3.92Å; Y1041-F1060 HydrophobicContact CE1-CZ 3.92Å; Y1041-F1060 AromaticContact CE2-CE1 3.86Å; Y1041-F1060 HydrophobicContact CE2-CE1 3.86Å; Y1041-F1060 HydrophobicContact CE2-CZ 4.3Å; Y1041-F1060 AromaticContact CG-CD1 3.83Å; Y1041-F1060 HydrophobicContact CG-CD1 3.83Å; Y1041-F1060 AromaticContact CG-CE1 3.48Å; Y1041-F1060 HydrophobicContact CG-CE1 3.48Å; Y1041-F1060 VanDerWaalsContact CG-CE1 3.48Å; Y1041-F1060 AromaticContact CZ-CE1 3.83Å; Y1041-F1060 AromaticContact CZ-CZ 3.99Å
1042	L	93.9	Very high	77.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	140.1	-179.3	-64.5	-165.9	0	0	0	110	E1013 G1014 L1016 F1040 L1049 V1051 L1270 L1285 W1296 F1300	E1013-L1042 VanDerWaalsContact CA-O 3.27Å; E1013-L1042 WeakPolarHBondContact CA-O 3.24Å; G1014-L1042 PolarHBondContact N-O 3.47Å; G1014-L1042 PolarHBondContact O-N 3.04Å; L1016-L1042 HydrophobicContact CD1-CD1 3.89Å; F1040-L1042 HydrophobicContact CB-CD2 4.34Å; L1042-L1049 HydrophobicContact CB-CD1 4.26Å; L1042-L1049 HydrophobicContact CD1-CD1 4.39Å; L1042-V1051 HydrophobicContact CD2-CB 4.26Å; L1042-V1051 HydrophobicContact CD2-CG1 4.14Å; L1042-V1051 HydrophobicContact CD2-CG2 4.06Å; L1042-L1270 HydrophobicContact CD1-CD1 3.8Å; L1042-L1285 HydrophobicContact CD1-CD1 3.88Å; L1042-W1296 HydrophobicContact CB-CH2 3.51Å; L1042-W1296 HydrophobicContact CB-CZ2 3.81Å; L1042-W1296 HydrophobicContact CB-CZ3 4.27Å; L1042-F1300 HydrophobicContact CD1-CZ 4.23Å
1043	I	93.8	Very high	80.2	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	106.9	174.1	-47.2	177.6	0	0	0	107.7	L990 L994 L1010 Y1041 F1045 L1050 T1052	L990-I1043 HydrophobicContact CD1-CG2 4.39Å; L990-I1043 HydrophobicContact CD2-CD1 4.06Å; L994-I1043 HydrophobicContact CD2-CD1 4.26Å; L1010-I1043 HydrophobicContact CD1-CG2 3.5Å; Y1041-I1043 HydrophobicContact CD1-CD1 4.26Å; Y1041-I1043 HydrophobicContact CD1-CG1 3.82Å; Y1041-I1043 HydrophobicContact CE1-CD1 4.32Å; Y1041-I1043 HydrophobicContact CE1-CG1 3.92Å; I1043-F1045 HydrophobicContact CB-CE2 4.16Å; I1043-F1045 HydrophobicContact CG2-CD2 4.22Å; I1043-F1045 HydrophobicContact CG2-CE1 4.49Å; I1043-F1045 HydrophobicContact CG2-CE2 3.45Å; I1043-F1045 VanDerWaalsContact CG2-CE2 3.45Å; I1043-F1045 HydrophobicContact CG2-CZ 3.62Å; I1043-L1050 HydrophobicContact CB-CB 4.32Å; I1043-L1050 PolarHBondContact N-O 2.91Å; I1043-L1050 VanDerWaalsContact N-O 3.08Å; I1043-L1050 PolarHBondContact O-N 2.88Å; I1043-T1052 HydrophobicContact CD1-CG2 4.2Å
1044	L	94.2	Very high	82.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	115.9	-179.3	178.9	65.1	0	0	0	109.9	I1011 K1012 L1049 R1068 W1296 A1299 F1300	I1011-L1044 WeakPolarHBondContact CA-O 3.38Å; I1011-L1044 HydrophobicContact CB-CD2 4.49Å; I1011-L1044 HydrophobicContact CB-CG 4.32Å; I1011-L1044 WeakPolarHBondContact CB-O 3.47Å; I1011-L1044 HydrophobicContact CG2-CD2 4.13Å; I1011-L1044 PolarHBondContact N-O 2.83Å; K1012-L1044 PolarHBondContact N-O 2.81Å; K1012-L1044 VanDerWaalsContact N-O 3.14Å; K1012-L1044 PolarHBondContact O-N 3.23Å; L1044-L1049 HydrophobicContact CB-CD1 4.09Å; L1044-L1049 HydrophobicContact CD1-CB 4.19Å; L1044-L1049 HydrophobicContact CD1-CD1 4.2Å; L1044-R1068 HydrophobicContact CD1-CG 4.08Å; L1044-W1296 HydrophobicContact CB-CZ3 4.11Å; L1044-A1299 HydrophobicContact CD2-CB 3.97Å; L1044-F1300 HydrophobicContact CD1-CE1 4.27Å; L1044-F1300 HydrophobicContact CD2-CD1 4.17Å; L1044-F1300 HydrophobicContact CD2-CE1 4.04Å
1045	F	92.9	Very high	85	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	175.5	169.4	-61	-88.5	0	0	0	110.7	L987 I1005 K1008 R1009 L1010 I1043 D1047 M1048 L1050	L987-F1045 HydrophobicContact CD2-CD1 4.35Å; L987-F1045 HydrophobicContact CD2-CE1 3.62Å; I1005-F1045 HydrophobicContact CB-CE1 4.19Å; I1005-F1045 HydrophobicContact CB-CZ 4Å; I1005-F1045 HydrophobicContact CD1-CE1 4.28Å; I1005-F1045 HydrophobicContact CD1-CZ 3.82Å; I1005-F1045 HydrophobicContact CG2-CE2 4.34Å; I1005-F1045 HydrophobicContact CG2-CZ 4.03Å; K1008-F1045 HydrophobicContact CB-CB 4.2Å; K1008-F1045 HydrophobicContact CB-CD1 3.41Å; K1008-F1045 VanDerWaalsContact CB-CD1 3.41Å; K1008-F1045 HydrophobicContact CB-CE1 3.98Å; K1008-F1045 HydrophobicContact CB-CG 3.96Å; K1008-F1045 HydrophobicContact CD-CB 4.41Å; K1008-F1045 HydrophobicContact CD-CD1 4.31Å; K1008-F1045 HydrophobicContact CD-CD2 4.47Å; K1008-F1045 HydrophobicContact CD-CG 4.14Å; K1008-F1045 HydrophobicContact CG-CD1 4.49Å; R1009-F1045 CarbonylContact O-C 3.53Å; R1009-F1045 VanDerWaalsContact O-CA 3.3Å; R1009-F1045 WeakPolarHBondContact O-CA 3.47Å; L1010-F1045 HydrophobicContact CB-CD1 4.37Å; L1010-F1045 HydrophobicContact CB-CE1 4.36Å; L1010-F1045 HydrophobicContact CD1-CE1 4.35Å; I1043-F1045 HydrophobicContact CB-CE2 4.16Å; I1043-F1045 HydrophobicContact CG2-CD2 4.22Å; I1043-F1045 HydrophobicContact CG2-CE1 4.49Å; I1043-F1045 HydrophobicContact CG2-CE2 3.45Å; I1043-F1045 VanDerWaalsContact CG2-CE2 3.45Å; I1043-F1045 HydrophobicContact CG2-CZ 3.62Å; F1045-D1047 VanDerWaalsContact C-N 3.26Å; F1045-D1047 PolarHBondContact O-N 3.17Å; F1045-M1048 WeakPolarHBondContact CA-O 3.33Å; F1045-M1048 WeakPolarHBondContact CB-O 3.38Å; F1045-M1048 PolarHBondContact N-O 3.38Å; F1045-L1050 HydrophobicContact CD2-CD1 3.58Å; F1045-L1050 HydrophobicContact CE2-CD1 3.44Å; F1045-L1050 VanDerWaalsContact CE2-CD1 3.44Å; F1045-L1050 HydrophobicContact CE2-CD2 4.23Å; F1045-L1050 HydrophobicContact CE2-CG 4.42Å
1046	N	89.9	Confident	86.8	Confident	71 Å²	71	44.7 Å²	44.7	38%	0.38	22%	0.216	S	C	.	.	S	Bend	trans	-57.8	-35.1	175	60.4	-62.9	0	0	0	113.8	R1009 I1011 R1068	R1009-N1046 HydrophobicContact CB-CB 4.15Å; R1009-N1046 PolarHBondContact N-OD1 3.12Å; R1009-N1046 PolarHBondContact O-N 3.07Å; R1009-N1046 PolarHBondContact O-OD1 3.06Å; I1011-N1046 HydrophobicContact CD1-CB 4.39Å; N1046-R1068 VanDerWaalsContact O-CD 3.23Å; N1046-R1068 WeakPolarHBondContact O-CD 3.42Å
1047	D	90.9	Very high	88.1	Confident	60 Å²	60	46.3 Å²	46.3	32%	0.321	23%	0.23	S	C	.	.	S	Bend	trans	-118.1	-8	-173.6	67.1	-6.4	0	0	0	114.4	K1008 F1045 R1068	K1008-D1047 IonicContact NZ-OD1 2.58Å; K1008-D1047 PolarHBondContact NZ-OD1 3Å; K1008-D1047 IonicContact NZ-OD2 2.71Å; K1008-D1047 PolarHBondContact NZ-OD2 2.84Å; F1045-D1047 VanDerWaalsContact C-N 3.26Å; F1045-D1047 PolarHBondContact O-N 3.17Å; D1047-R1068 PolarHBondContact O-N 3.02Å
1048	M	91.7	Very high	89.1	Confident	13 Å²	13	48.4 Å²	48.4	6%	0.064	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	140.8	-167	-159.7	168.2	77.1	0	0	112.5	I1003 K1008 F1045 L1050 Y1065 C1066	I1003-M1048 HydrophobicContact CD1-CE 3.42Å; I1003-M1048 VanDerWaalsContact CD1-CE 3.42Å; I1003-M1048 HydrophobicContact CD1-SD 3.83Å; I1003-M1048 HydrophobicContact CG2-CE 4.2Å; K1008-M1048 HydrophobicContact CD-CE 4.01Å; F1045-M1048 WeakPolarHBondContact CA-O 3.33Å; F1045-M1048 WeakPolarHBondContact CB-O 3.38Å; F1045-M1048 PolarHBondContact N-O 3.38Å; M1048-L1050 HydrophobicContact CE-CD1 3.37Å; M1048-L1050 HydrophobicContact CE-CG 4.27Å; M1048-L1050 HydrophobicContact CG-CD1 4.24Å; M1048-Y1065 HydrophobicContact CG-CD2 4.31Å; M1048-Y1065 HydrophobicContact SD-CD2 3.77Å; M1048-Y1065 HydrophobicContact SD-CE2 4.26Å; M1048-C1066 CarbonylContact C-O 3.59Å; M1048-C1066 WeakPolarHBondContact CA-O 3.27Å; M1048-C1066 WeakPolarHBondContact CG-O 3.18Å
1049	L	93.5	Very high	89.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	127.8	168.6	176.8	65.3	0	0	0	109.3	L1042 L1044 Y1065 C1066 V1071 L1270 F1300	L1042-L1049 HydrophobicContact CB-CD1 4.26Å; L1042-L1049 HydrophobicContact CD1-CD1 4.39Å; L1044-L1049 HydrophobicContact CB-CD1 4.09Å; L1044-L1049 HydrophobicContact CD1-CB 4.19Å; L1044-L1049 HydrophobicContact CD1-CD1 4.2Å; L1049-Y1065 CarbonylContact O-C 3.45Å; L1049-Y1065 VanDerWaalsContact O-CA 3.24Å; L1049-Y1065 WeakPolarHBondContact O-CA 3.47Å; L1049-C1066 PolarHBondContact N-O 3.37Å; L1049-C1066 PolarHBondContact O-N 3.28Å; L1049-V1071 HydrophobicContact CB-CG2 4.03Å; L1049-V1071 HydrophobicContact CD2-CG1 4.23Å; L1049-V1071 HydrophobicContact CD2-CG2 3.87Å; L1049-L1270 HydrophobicContact CD2-CD1 4.26Å; L1049-F1300 HydrophobicContact CD1-CE1 4.39Å; L1049-F1300 HydrophobicContact CD1-CZ 4.38Å; L1049-F1300 HydrophobicContact CD2-CE1 4.19Å; L1049-F1300 HydrophobicContact CD2-CZ 4.38Å
1050	L	93.2	Very high	90.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	133.2	168	-70.5	63.7	0	0	0	109.2	L994 I1043 F1045 M1048 T1052	L994-L1050 HydrophobicContact CD1-CD2 4.3Å; L994-L1050 HydrophobicContact CD2-CD2 4.09Å; I1043-L1050 HydrophobicContact CB-CB 4.32Å; I1043-L1050 PolarHBondContact N-O 2.91Å; I1043-L1050 VanDerWaalsContact N-O 3.08Å; I1043-L1050 PolarHBondContact O-N 2.88Å; F1045-L1050 HydrophobicContact CD2-CD1 3.58Å; F1045-L1050 HydrophobicContact CE2-CD1 3.44Å; F1045-L1050 VanDerWaalsContact CE2-CD1 3.44Å; F1045-L1050 HydrophobicContact CE2-CD2 4.23Å; F1045-L1050 HydrophobicContact CE2-CG 4.42Å; M1048-L1050 HydrophobicContact CE-CD1 3.37Å; M1048-L1050 HydrophobicContact CE-CG 4.27Å; M1048-L1050 HydrophobicContact CG-CD1 4.24Å; L1050-T1052 HydrophobicContact CB-CG2 3.94Å
1051	V	92.8	Very high	90.3	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.018	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	110.5	168	-175.6	0	0	0	0	106.9	F1040 L1042 L1063 D1064 L1272 L1283	F1040-V1051 HydrophobicContact CD1-CG1 3.71Å; F1040-V1051 HydrophobicContact CE1-CG1 4.12Å; F1040-V1051 HydrophobicContact CG-CG1 4.3Å; L1042-V1051 HydrophobicContact CD2-CB 4.26Å; L1042-V1051 HydrophobicContact CD2-CG1 4.14Å; L1042-V1051 HydrophobicContact CD2-CG2 4.06Å; V1051-L1063 WeakPolarHBondContact O-CB 3.4Å; V1051-L1063 PolarHBondContact O-N 2.88Å; V1051-D1064 HydrophobicContact CB-CB 4.3Å; V1051-D1064 PolarHBondContact N-O 3.05Å; V1051-D1064 PolarHBondContact O-N 2.89Å; V1051-L1272 HydrophobicContact CG2-CD2 3.9Å; V1051-L1283 HydrophobicContact CG1-CD1 3.89Å; V1051-L1283 HydrophobicContact CG2-CD1 3.79Å
1052	T	93.1	Very high	90.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	162.5	-178.1	81.4	0	0	0	0	111.9	L994 Y1041 I1043 L1050 F1060 L1061 V1062	L994-T1052 HydrophobicContact CD2-CG2 4.2Å; Y1041-T1052 PolarHBondContact N-O 3.37Å; Y1041-T1052 WeakPolarHBondContact O-CB 3.29Å; Y1041-T1052 PolarHBondContact O-N 2.71Å; Y1041-T1052 PolarHBondContact O-OG1 3.37Å; I1043-T1052 HydrophobicContact CD1-CG2 4.2Å; L1050-T1052 HydrophobicContact CB-CG2 3.94Å; T1052-F1060 HydrophobicContact CG2-CB 4.46Å; T1052-L1061 CarbonylContact C-O 3.52Å; T1052-L1061 WeakPolarHBondContact CA-O 3.36Å; T1052-L1061 WeakPolarHBondContact CB-O 3.41Å; T1052-V1062 HydrophobicContact CG2-CG2 4.28Å
1053	K	91.1	Very high	90	Very high	77 Å²	77	51.2 Å²	51.2	34%	0.335	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.5	168.9	-167.2	160.3	-172.4	167.9	0	109.7	N1038 K1055 L1061 L1063	N1038-K1053 PolarHBondContact OD1-NZ 3.02Å; K1053-K1055 PolarHBondContact O-N 3.4Å; K1053-L1061 PolarHBondContact N-O 2.92Å; K1053-L1061 PolarHBondContact O-N 2.96Å; K1053-L1063 HydrophobicContact CB-CD1 4.1Å; K1053-L1063 HydrophobicContact CB-CD2 4.45Å; K1053-L1063 HydrophobicContact CB-CG 4.37Å
1054	K	89	Confident	89.8	Confident	98 Å²	98	51.5 Å²	51.5	43%	0.426	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	125	179.7	-168.6	178	-174.7	-175.4	0	110.1	E1015 Y1041 F1060	E1015-K1054 WeakPolarHBondContact OE1-CD 3.49Å; E1015-K1054 WeakPolarHBondContact OE1-CE 3.27Å; E1015-K1054 IonicContact OE1-NZ 3.3Å; E1015-K1054 PolarHBondContact OE1-NZ 2.95Å; Y1041-K1054 HydrophobicContact CD2-CD 4.14Å; K1054-F1060 HydrophobicContact CB-CD1 4.28Å; K1054-F1060 HydrophobicContact CB-CE1 4.23Å; K1054-F1060 HydrophobicContact CD-CE1 4.37Å; K1054-F1060 HydrophobicContact CG-CD1 4.32Å; K1054-F1060 HydrophobicContact CG-CE1 3.89Å
1055	K	86.9	Confident	89.7	Confident	87 Å²	87	53.2 Å²	53.2	38%	0.378	25%	0.248	S	C	.	.			trans	-100.8	175.8	173.1	-76.8	175.5	161.5	173.1	0	110	E995 K1053 R1059 L1061	E995-K1055 WeakPolarHBondContact OE2-CD 3.22Å; E995-K1055 WeakPolarHBondContact OE2-CE 3.08Å; E995-K1055 IonicContact OE2-NZ 2.77Å; E995-K1055 PolarHBondContact OE2-NZ 3.4Å; K1053-K1055 PolarHBondContact O-N 3.4Å; K1055-R1059 HydrophobicContact CB-CB 4.34Å; K1055-R1059 WeakPolarHBondContact CB-O 3.31Å; K1055-R1059 PolarHBondContact N-O 2.76Å; K1055-L1061 HydrophobicContact CD-CB 4.14Å
1056	K	81.7	Confident	89.6	Confident	183 Å²	183	53.3 Å²	53.3	80%	0.796	25%	0.248	S	C	*	.	S	Bend	trans	-59	147.7	169.5	-63.6	-179.2	179.7	178.1	0	110.3
1057	N	79.6	Confident	89.6	Confident	149 Å²	149	54 Å²	54	80%	0.797	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	46	176.9	-52.9	7.4	0	0	0	114.9	R1059	N1057-R1059 PolarHBondContact O-N 2.76Å
1058	E	81.1	Confident	89.5	Confident	119 Å²	119	54.9 Å²	54.9	56%	0.556	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	22.2	177.3	-57	-154.9	137.2	0	0	116.1	S993 F1060	S993-E1058 WeakPolarHBondContact CB-O 3.43Å; S993-E1058 PolarHBondContact OG-O 3.47Å; E1058-F1060 VanDerWaalsContact O-CD2 3.31Å; E1058-F1060 WeakPolarHBondContact O-CD2 3.46Å; E1058-F1060 WeakPolarHBondContact O-CE2 3Å
1059	R	89.3	Confident	89.4	Confident	116 Å²	116	58.7 Å²	58.7	44%	0.438	28%	0.284	S	S	.	.			trans	-88.3	143.9	173.6	-61.5	-170	-64.5	156.6	10.7	110.8	S993 E995 K1055 N1057	S993-R1059 CarbonylContact O-C 3.56Å; S993-R1059 VanDerWaalsContact O-CA 3.27Å; S993-R1059 WeakPolarHBondContact O-CA 3.48Å; E995-R1059 IonicContact OE1-CZ 2.66Å; E995-R1059 IonicContact OE1-NE 3.24Å; E995-R1059 IonicContact OE1-NH1 2.71Å; E995-R1059 PolarHBondContact OE1-NH1 2.73Å; E995-R1059 IonicContact OE1-NH2 3.07Å; K1055-R1059 HydrophobicContact CB-CB 4.34Å; K1055-R1059 WeakPolarHBondContact CB-O 3.31Å; K1055-R1059 PolarHBondContact N-O 2.76Å; N1057-R1059 PolarHBondContact O-N 2.76Å
1060	F	92.3	Very high	89.2	Confident	3 Å²	3	60.4 Å²	60.4	1%	0.013	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.9	-174.4	-60.8	-79.8	0	0	0	109.8	L990 S993 L994 E995 Y1041 T1052 K1054 E1058 V1062	L990-F1060 HydrophobicContact CD2-CD2 4.09Å; L990-F1060 HydrophobicContact CD2-CE2 3.82Å; S993-F1060 PolarHBondContact O-N 3.24Å; S993-F1060 WeakPolarHBondContact OG-CD2 3.37Å; L994-F1060 WeakPolarHBondContact CA-O 3.33Å; L994-F1060 HydrophobicContact CD2-CB 3.98Å; E995-F1060 PolarHBondContact N-O 2.83Å; Y1041-F1060 AromaticContact CD1-CD1 3.69Å; Y1041-F1060 HydrophobicContact CD1-CD1 3.69Å; Y1041-F1060 AromaticContact CD1-CE1 3.42Å; Y1041-F1060 HydrophobicContact CD1-CE1 3.42Å; Y1041-F1060 VanDerWaalsContact CD1-CE1 3.42Å; Y1041-F1060 HydrophobicContact CD1-CZ 4.22Å; Y1041-F1060 HydrophobicContact CD2-CD1 4.41Å; Y1041-F1060 AromaticContact CD2-CE1 3.66Å; Y1041-F1060 HydrophobicContact CD2-CE1 3.66Å; Y1041-F1060 HydrophobicContact CE1-CD1 4.21Å; Y1041-F1060 AromaticContact CE1-CE1 3.58Å; Y1041-F1060 HydrophobicContact CE1-CE1 3.58Å; Y1041-F1060 AromaticContact CE1-CZ 3.92Å; Y1041-F1060 HydrophobicContact CE1-CZ 3.92Å; Y1041-F1060 AromaticContact CE2-CE1 3.86Å; Y1041-F1060 HydrophobicContact CE2-CE1 3.86Å; Y1041-F1060 HydrophobicContact CE2-CZ 4.3Å; Y1041-F1060 AromaticContact CG-CD1 3.83Å; Y1041-F1060 HydrophobicContact CG-CD1 3.83Å; Y1041-F1060 AromaticContact CG-CE1 3.48Å; Y1041-F1060 HydrophobicContact CG-CE1 3.48Å; Y1041-F1060 VanDerWaalsContact CG-CE1 3.48Å; Y1041-F1060 AromaticContact CZ-CE1 3.83Å; Y1041-F1060 AromaticContact CZ-CZ 3.99Å; T1052-F1060 HydrophobicContact CG2-CB 4.46Å; K1054-F1060 HydrophobicContact CB-CD1 4.28Å; K1054-F1060 HydrophobicContact CB-CE1 4.23Å; K1054-F1060 HydrophobicContact CD-CE1 4.37Å; K1054-F1060 HydrophobicContact CG-CD1 4.32Å; K1054-F1060 HydrophobicContact CG-CE1 3.89Å; E1058-F1060 VanDerWaalsContact O-CD2 3.31Å; E1058-F1060 WeakPolarHBondContact O-CD2 3.46Å; E1058-F1060 WeakPolarHBondContact O-CE2 3Å; F1060-V1062 PolarHBondContact O-N 3.3Å
1061	L	92.1	Very high	88.9	Confident	40 Å²	40	61.1 Å²	61.1	21%	0.209	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	115.4	174.1	178.9	67	0	0	0	109.1	E995 P997 T1052 K1053 K1055 L1063	E995-L1061 HydrophobicContact CB-CD1 4.34Å; E995-L1061 WeakPolarHBondContact O-CA 3.44Å; P997-L1061 HydrophobicContact CB-CD1 4.29Å; P997-L1061 HydrophobicContact CG-CD1 4.16Å; T1052-L1061 CarbonylContact C-O 3.52Å; T1052-L1061 WeakPolarHBondContact CA-O 3.36Å; T1052-L1061 WeakPolarHBondContact CB-O 3.41Å; K1053-L1061 PolarHBondContact N-O 2.92Å; K1053-L1061 PolarHBondContact O-N 2.96Å; K1055-L1061 HydrophobicContact CD-CB 4.14Å; L1061-L1063 HydrophobicContact CD2-CD2 3.99Å; L1061-L1063 HydrophobicContact CG-CD2 4.12Å; L1061-L1063 PolarHBondContact O-N 3.05Å
1062	V	91.9	Very high	88.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	124.5	175.1	-171.7	0	0	0	0	109.1	L994 E995 F996 P997 V1000 T1052 F1060	L994-V1062 HydrophobicContact CD2-CG2 3.6Å; E995-V1062 PolarHBondContact O-N 2.88Å; F996-V1062 HydrophobicContact CD1-CB 4.08Å; F996-V1062 HydrophobicContact CD1-CG1 4.36Å; F996-V1062 HydrophobicContact CD1-CG2 3.96Å; F996-V1062 HydrophobicContact CE1-CB 4.31Å; F996-V1062 HydrophobicContact CE1-CG1 4.31Å; F996-V1062 HydrophobicContact CE1-CG2 3.86Å; F996-V1062 HydrophobicContact CG-CG2 4.37Å; F996-V1062 HydrophobicContact CZ-CG2 4.18Å; P997-V1062 WeakPolarHBondContact CD-O 3.37Å; P997-V1062 WeakPolarHBondContact CG-O 3.26Å; V1000-V1062 HydrophobicContact CG1-CG1 4.02Å; T1052-V1062 HydrophobicContact CG2-CG2 4.28Å; F1060-V1062 PolarHBondContact O-N 3.3Å
1063	L	89.7	Confident	88.5	Confident	56 Å²	56	68.1 Å²	68.1	29%	0.293	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-42.4	178.9	-56.9	-178.9	0	0	0	111.5	F1040 V1051 K1053 L1061 N1277	F1040-L1063 HydrophobicContact CD1-CD1 3.95Å; F1040-L1063 HydrophobicContact CE1-CD1 3.66Å; V1051-L1063 WeakPolarHBondContact O-CB 3.4Å; V1051-L1063 PolarHBondContact O-N 2.88Å; K1053-L1063 HydrophobicContact CB-CD1 4.1Å; K1053-L1063 HydrophobicContact CB-CD2 4.45Å; K1053-L1063 HydrophobicContact CB-CG 4.37Å; L1061-L1063 HydrophobicContact CD2-CD2 3.99Å; L1061-L1063 HydrophobicContact CG-CD2 4.12Å; L1061-L1063 PolarHBondContact O-N 3.05Å; L1063-N1277 PolarHBondContact O-ND2 2.93Å
1064	D	89.6	Confident	88.3	Confident	6 Å²	6	70 Å²	70	3%	0.032	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	161.4	-179.6	-163	5.6	0	0	0	109.6	V1051 S1275 H1276 T1281	V1051-D1064 HydrophobicContact CB-CB 4.3Å; V1051-D1064 PolarHBondContact N-O 3.05Å; V1051-D1064 PolarHBondContact O-N 2.89Å; D1064-S1275 PolarHBondContact OD1-OG 3.35Å; D1064-S1275 WeakPolarHBondContact OD2-CB 3.47Å; D1064-S1275 PolarHBondContact OD2-OG 3.31Å; D1064-H1276 PolarHBondContact OD1-N 3.17Å; D1064-T1281 PolarHBondContact OD2-OG1 2.92Å
1065	Y	91.2	Very high	88.1	Confident	37 Å²	37	66.6 Å²	66.6	15%	0.145	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	152.7	169.6	69.6	-90.7	0	0	0	111	V1000 I1003 M1048 L1049 H1276	V1000-Y1065 HydrophobicContact CG1-CD1 3.88Å; V1000-Y1065 HydrophobicContact CG1-CE1 3.88Å; I1003-Y1065 HydrophobicContact CD1-CD1 3.63Å; I1003-Y1065 HydrophobicContact CD1-CD2 3.58Å; I1003-Y1065 HydrophobicContact CD1-CE1 3.55Å; I1003-Y1065 HydrophobicContact CD1-CE2 3.53Å; I1003-Y1065 HydrophobicContact CD1-CG 3.61Å; I1003-Y1065 VanDerWaalsContact CD1-CZ 3.49Å; I1003-Y1065 HydrophobicContact CG1-CE1 4.04Å; I1003-Y1065 HydrophobicContact CG1-CE2 4.35Å; M1048-Y1065 HydrophobicContact CG-CD2 4.31Å; M1048-Y1065 HydrophobicContact SD-CD2 3.77Å; M1048-Y1065 HydrophobicContact SD-CE2 4.26Å; L1049-Y1065 CarbonylContact O-C 3.45Å; L1049-Y1065 VanDerWaalsContact O-CA 3.24Å; L1049-Y1065 WeakPolarHBondContact O-CA 3.47Å; Y1065-H1276 HydrophobicContact CD1-CB 3.67Å; Y1065-H1276 HydrophobicContact CD2-CB 4.38Å; Y1065-H1276 HydrophobicContact CE1-CB 3.42Å; Y1065-H1276 VanDerWaalsContact CE1-CB 3.42Å; Y1065-H1276 AromaticContact CE1-CD2 3.52Å; Y1065-H1276 AromaticContact CE1-CG 3.41Å; Y1065-H1276 VanDerWaalsContact CE1-CG 3.41Å; Y1065-H1276 HydrophobicContact CE2-CB 4.16Å; Y1065-H1276 HydrophobicContact CG-CB 4.18Å; Y1065-H1276 AromaticContact CZ-CD2 3.51Å; Y1065-H1276 AromaticContact CZ-CG 3.77Å; Y1065-H1276 PolarHBondContact O-N 3.47Å; Y1065-H1276 PolarHBondContact OH-CD2 2.91Å
1066	C	90.8	Very high	87.8	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.007	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	144.3	-174.1	-177.5	0	0	0	0	109.3	M1048 L1049 R1068 S1070 V1071 L1272	M1048-C1066 CarbonylContact C-O 3.59Å; M1048-C1066 WeakPolarHBondContact CA-O 3.27Å; M1048-C1066 WeakPolarHBondContact CG-O 3.18Å; L1049-C1066 PolarHBondContact N-O 3.37Å; L1049-C1066 PolarHBondContact O-N 3.28Å; C1066-R1068 PolarHBondContact O-N 2.89Å; C1066-S1070 VanDerWaalsContact SG-CB 3.51Å; C1066-V1071 HydrophobicContact CB-CG2 4.3Å; C1066-L1272 HydrophobicContact CB-CB 4.15Å; C1066-L1272 HydrophobicContact CB-CD2 3.91Å; C1066-L1272 HydrophobicContact CB-CG 4.04Å
1067	D	90.4	Very high	87.7	Confident	86 Å²	86	60.4 Å²	60.4	46%	0.46	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	136.6	165.9	-175.2	-36.6	0	0	0	108.9	A1069 S1070 V1071	D1067-A1069 PolarHBondContact O-N 2.82Å; D1067-A1069 WeakPolarHBondContact OD1-CB 3.46Å; D1067-A1069 PolarHBondContact OD1-N 3.12Å; D1067-S1070 WeakPolarHBondContact O-CA 3.14Å; D1067-S1070 WeakPolarHBondContact O-CB 3.4Å; D1067-S1070 PolarHBondContact O-N 3.43Å; D1067-V1071 PolarHBondContact O-N 3.06Å
1068	R	89.1	Confident	86.9	Confident	79 Å²	79	56.3 Å²	56.3	30%	0.298	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-58.8	-34.5	179	-173.7	179.4	-177.6	-144.1	0.3	111.8	L1044 N1046 D1047 C1066 S1070 V1071 A1299	L1044-R1068 HydrophobicContact CD1-CG 4.08Å; N1046-R1068 VanDerWaalsContact O-CD 3.23Å; N1046-R1068 WeakPolarHBondContact O-CD 3.42Å; D1047-R1068 PolarHBondContact O-N 3.02Å; C1066-R1068 PolarHBondContact O-N 2.89Å; R1068-S1070 PolarHBondContact O-N 3.44Å; R1068-V1071 PolarHBondContact O-N 2.82Å; R1068-A1299 PolarHBondContact NH2-O 3.19Å
1069	A	88.9	Confident	85.7	Confident	92 Å²	92	53.6 Å²	53.6	76%	0.76	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-67.2	-17.9	175.2	0	0	0	0	0	113.4	D1067	D1067-A1069 PolarHBondContact O-N 2.82Å; D1067-A1069 WeakPolarHBondContact OD1-CB 3.46Å; D1067-A1069 PolarHBondContact OD1-N 3.12Å
1070	S	89	Confident	84.2	Confident	36 Å²	36	52.1 Å²	52.1	25%	0.252	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-97.9	2.1	176.7	-66.6	0	0	0	0	113.8	C1066 D1067 R1068 L1273	C1066-S1070 VanDerWaalsContact SG-CB 3.51Å; D1067-S1070 WeakPolarHBondContact O-CA 3.14Å; D1067-S1070 WeakPolarHBondContact O-CB 3.4Å; D1067-S1070 PolarHBondContact O-N 3.43Å; R1068-S1070 PolarHBondContact O-N 3.44Å; S1070-L1273 WeakPolarHBondContact O-CB 3.21Å; S1070-L1273 PolarHBondContact O-N 3.42Å
1071	V	88.5	Confident	81.8	Confident	16 Å²	16	57.5 Å²	57.5	10%	0.097	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119	173.8	-179.1	0	0	0	0	109.4	L1049 C1066 D1067 R1068 P1073 L1270 F1300	L1049-V1071 HydrophobicContact CB-CG2 4.03Å; L1049-V1071 HydrophobicContact CD2-CG1 4.23Å; L1049-V1071 HydrophobicContact CD2-CG2 3.87Å; C1066-V1071 HydrophobicContact CB-CG2 4.3Å; D1067-V1071 PolarHBondContact O-N 3.06Å; R1068-V1071 PolarHBondContact O-N 2.82Å; V1071-P1073 VanDerWaalsContact O-CD 3.26Å; V1071-P1073 WeakPolarHBondContact O-CD 3.39Å; V1071-L1270 HydrophobicContact CG1-CD2 4.19Å; V1071-F1300 HydrophobicContact CG1-CE1 4.41Å
1072	Q	88.4	Confident	79.1	Confident	108 Å²	108	63.3 Å²	63.3	51%	0.505	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	104.6	170	-73.9	-172.7	-15.7	0	0	110.4	K1271 L1273	Q1072-K1271 HydrophobicContact CB-CB 4.22Å; Q1072-K1271 PolarHBondContact N-O 3.29Å; Q1072-K1271 PolarHBondContact O-N 2.71Å; Q1072-L1273 HydrophobicContact CG-CD1 3.99Å
1073	P	87.9	Confident	76.4	Confident	41 Å²	41	69.2 Å²	69.2	27%	0.266	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	142.9	172.7	34.9	-36.3	0	0	0	112	V1071 H1269 L1270 F1300 V1302	V1071-P1073 VanDerWaalsContact O-CD 3.26Å; V1071-P1073 WeakPolarHBondContact O-CD 3.39Å; P1073-H1269 CarbonylContact C-O 3.56Å; P1073-H1269 WeakPolarHBondContact CA-O 3.46Å; P1073-L1270 HydrophobicContact CB-CD2 3.82Å; P1073-F1300 HydrophobicContact CB-CB 4.07Å; P1073-F1300 HydrophobicContact CB-CG 4.46Å; P1073-F1300 HydrophobicContact CG-CB 4.13Å; P1073-V1302 HydrophobicContact CB-CG2 3.79Å; P1073-V1302 HydrophobicContact CG-CG2 3.42Å; P1073-V1302 VanDerWaalsContact CG-CG2 3.42Å
1074	L	87.8	Confident	73.5	Confident	116 Å²	116	72 Å²	72	61%	0.607	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.5	126.4	169.1	172	65.9	0	0	0	108.9	H1269	L1074-H1269 HydrophobicContact CB-CB 4.29Å; L1074-H1269 PolarHBondContact N-O 2.84Å; L1074-H1269 PolarHBondContact O-N 2.83Å
1075	V	85.1	Confident	70.5	Confident	27 Å²	27	73.6 Å²	73.6	16%	0.164	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	135.6	-179.2	164.4	0	0	0	0	110.5	R1077 I1268 F1293 V1302	V1075-R1077 HydrophobicContact CG1-CG 4.12Å; V1075-I1268 HydrophobicContact CG2-CG1 4.47Å; V1075-F1293 HydrophobicContact CG1-CZ 3.89Å; V1075-V1302 HydrophobicContact CB-CG1 3.94Å; V1075-V1302 HydrophobicContact CG2-CB 4.07Å; V1075-V1302 HydrophobicContact CG2-CG1 3.61Å
1076	Q	79.2	Confident	67.7	Low	39 Å²	39	78.1 Å²	78.1	18%	0.182	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.8	168.6	-176.3	-180	-6	0	0	109.2	I1267	Q1076-I1267 PolarHBondContact N-O 2.85Å; Q1076-I1267 PolarHBondContact O-N 2.83Å
1077	R	80.1	Confident	64.7	Low	101 Å²	101	85 Å²	85	38%	0.381	50%	0.497	S	S	.	.			trans	-98.9	151	179.9	-62.4	176	175.8	-100.3	-6.6	110.6	V1075 G1079 D1080 N1266 E1294	V1075-R1077 HydrophobicContact CG1-CG 4.12Å; R1077-G1079 PolarHBondContact O-N 2.9Å; R1077-D1080 WeakPolarHBondContact CA-OD2 3.17Å; R1077-D1080 WeakPolarHBondContact CB-OD2 3.47Å; R1077-D1080 PolarHBondContact N-OD2 2.58Å; R1077-D1080 PolarHBondContact O-N 3.29Å; R1077-N1266 WeakPolarHBondContact CA-OD1 3.35Å; R1077-E1294 IonicContact CZ-OE1 3.71Å; R1077-E1294 VanDerWaalsContact CZ-OE1 3.24Å; R1077-E1294 IonicContact NH1-OE1 2.75Å; R1077-E1294 PolarHBondContact NH1-OE1 2.59Å; R1077-E1294 IonicContact NH2-OE1 3.64Å; R1077-E1294 PolarHBondContact NH2-OE1 3.08Å; R1077-E1294 IonicContact NH2-OE2 2.75Å
1078	S	63.2	Low	62	Low	64 Å²	64	87.8 Å²	87.8	45%	0.448	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	96.2	179.8	168.5	0	0	0	0	111	N1266	S1078-N1266 PolarHBondContact N-OD1 3.44Å
1079	G	56.4	Low	59	Low	62 Å²	62	92.4 Å²	92.4	64%	0.639	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	133.4	-11.2	-179.6	0	0	0	0	0	114.4	R1077 P1081	R1077-G1079 PolarHBondContact O-N 2.9Å; G1079-P1081 WeakPolarHBondContact O-CD 3.43Å
1080	D	57.2	Low	56.3	Low	84 Å²	84	96.2 Å²	96.2	45%	0.449	54%	0.54	S	S	.	.			trans	-65.1	122.8	-179.8	-67.3	-29	0	0	0	111.4	R1077 F1082	R1077-D1080 WeakPolarHBondContact CA-OD2 3.17Å; R1077-D1080 WeakPolarHBondContact CB-OD2 3.47Å; R1077-D1080 PolarHBondContact N-OD2 2.58Å; R1077-D1080 PolarHBondContact O-N 3.29Å; D1080-F1082 PolarHBondContact O-N 2.92Å
1081	P	42.2	Very low	53.3	Low	116 Å²	116	101.5 Å²	101.5	75%	0.753	57%	0.565	S	S	*	*			trans	-73.6	129.4	179.5	28.8	-33.5	0	0	0	111.3	G1079 N1083	G1079-P1081 WeakPolarHBondContact O-CD 3.43Å; P1081-N1083 PolarHBondContact O-N 2.78Å
1082	F	35.7	Very low	50.6	Low	163 Å²	163	106.2 Å²	106.2	72%	0.715	60%	0.597	S	S	*	*			trans	-61.9	98.1	-176.9	-126.2	-82.5	0	0	0	112.2	D1080 S1084	D1080-F1082 PolarHBondContact O-N 2.92Å; F1082-S1084 PolarHBondContact O-N 3.41Å
1083	N	33.4	Very low	47.7	Very low	124 Å²	124	110.3 Å²	110.3	66%	0.663	61%	0.613	S	S	*	*			trans	-93.3	84	176.4	-167.4	1	0	0	0	110.6	P1081 G1085	P1081-N1083 PolarHBondContact O-N 2.78Å; N1083-G1085 PolarHBondContact O-N 2.62Å
1084	S	29.7	Very low	44.8	Very low	113 Å²	113	116.3 Å²	116.3	79%	0.79	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	42.4	-179.3	-51	0	0	0	0	114	F1082	F1082-S1084 PolarHBondContact O-N 3.41Å
1085	G	27.2	Very low	42	Very low	40 Å²	40	116.3 Å²	116.3	41%	0.412	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.1	-11.4	-162.9	0	0	0	0	0	117.2	N1083 N1087	N1083-G1085 PolarHBondContact O-N 2.62Å; G1085-N1087 VanDerWaalsContact C-N 3.27Å; G1085-N1087 PolarHBondContact O-N 3.48Å; G1085-N1087 PolarHBondContact O-ND2 3.48Å
1086	T	32.3	Very low	39.2	Very low	132 Å²	132	122.8 Å²	122.8	81%	0.81	68%	0.684	S	S	*	*			trans	-80.7	69	-179.9	41.6	0	0	0	0	112.9	L1088	T1086-L1088 PolarHBondContact O-N 2.92Å
1087	N	27.9	Very low	36.6	Very low	145 Å²	145	126.4 Å²	126.4	78%	0.775	71%	0.714	S	S	*	*			trans	-60.1	129.7	164.9	-68.3	-96	0	0	0	110.4	G1085	G1085-N1087 VanDerWaalsContact C-N 3.27Å; G1085-N1087 PolarHBondContact O-N 3.48Å; G1085-N1087 PolarHBondContact O-ND2 3.48Å
1088	L	32.4	Very low	34.2	Very low	146 Å²	146	126.3 Å²	126.3	76%	0.764	74%	0.735	S	S	*	*			trans	-156.6	52.7	144.7	-113.7	178.3	0	0	0	114.4	T1086 K1090	T1086-L1088 PolarHBondContact O-N 2.92Å; L1088-K1090 HydrophobicContact CD2-CB 4.08Å; L1088-K1090 HydrophobicContact CD2-CD 4.07Å; L1088-K1090 PolarHBondContact O-N 2.91Å
1089	L	27.2	Very low	32.4	Very low	175 Å²	175	130.2 Å²	130.2	92%	0.916	75%	0.746	S	S	*	*			trans	-62.8	113.1	150.3	-105.8	77.6	0	0	0	108.4
1090	K	31.3	Very low	31.2	Very low	172 Å²	172	133.7 Å²	133.7	75%	0.748	76%	0.757	S	S	*	*			trans	-156.4	114.1	161.8	-110.4	159.7	-170.5	174.8	0	112	L1088	L1088-K1090 HydrophobicContact CD2-CB 4.08Å; L1088-K1090 HydrophobicContact CD2-CD 4.07Å; L1088-K1090 PolarHBondContact O-N 2.91Å
1091	N	27.2	Very low	29.6	Very low	147 Å²	147	135.1 Å²	135.1	79%	0.786	76%	0.764	S	S	*	*			trans	55.8	93.5	163.4	-62.6	-1.6	0	0	0	118.8
1092	P	30	Very low	28.9	Very low	116 Å²	116	134.9 Å²	134.9	75%	0.753	76%	0.764	S	S	*	*	S	Bend	trans	-65.3	158.1	138.4	33	-34.7	0	0	0	110.3
1093	K	28.2	Very low	28.4	Very low	194 Å²	194	134.4 Å²	134.4	84%	0.843	76%	0.764	S	S	*	*	S	Bend	trans	74	67.9	176.6	-47.8	175.3	-175.4	177.5	0	116.4
1094	N	27.6	Very low	28.1	Very low	167 Å²	167	135.2 Å²	135.2	89%	0.893	77%	0.766	S	S	*	*			trans	178.5	78.9	130	-93.8	-2	0	0	0	111.7
1095	S	28.4	Very low	27.8	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	76%	0.76	S	S	*	*			trans	-150.6	116.7	160.9	45.2	0	0	0	0	109.2
1096	I	27.7	Very low	27.8	Very low	163 Å²	163	141.2 Å²	141.2	84%	0.836	78%	0.779	S	S	*	*			trans	-95	143.5	164.1	-66.2	170.7	0	0	0	105.7
1097	S	24.4	Very low	27.5	Very low	116 Å²	116	138.7 Å²	138.7	81%	0.811	77%	0.767	S	S	*	*			trans	51.6	102.4	179.1	58.1	0	0	0	0	116.5
1098	A	29.7	Very low	27.7	Very low	99 Å²	99	138.9 Å²	138.9	82%	0.818	77%	0.768	S	S	*	*			trans	-153.3	130.6	154.6	0	0	0	0	0	109.3
1099	E	24.5	Very low	27.7	Very low	146 Å²	146	138.9 Å²	138.9	68%	0.682	77%	0.769	S	S	*	*			trans	-83	157.5	173.8	-61.8	163.3	126.8	0	0	110.7	L1101	E1099-L1101 HydrophobicContact CB-CG 4.07Å; E1099-L1101 PolarHBondContact O-N 2.98Å
1100	P	30.4	Very low	27.8	Very low	134 Å²	134	137.5 Å²	137.5	87%	0.87	76%	0.762	S	S	*	*			trans	-74.6	67.1	161.7	33.8	-34	0	0	0	110.2	C1102	P1100-C1102 PolarHBondContact O-N 3.31Å; P1100-C1102 VanDerWaalsContact O-N 3.12Å
1101	L	25	Very low	27.8	Very low	115 Å²	115	137.3 Å²	137.3	60%	0.602	77%	0.769	S	S	*	*			trans	-66.5	106.4	176.4	-87.6	164.7	0	0	0	111.1	E1099 H1103	E1099-L1101 HydrophobicContact CB-CG 4.07Å; E1099-L1101 PolarHBondContact O-N 2.98Å; L1101-H1103 VanDerWaalsContact CD2-CD2 3.49Å; L1101-H1103 WeakPolarHBondContact CD2-CD2 3.43Å
1102	C	26.8	Very low	27.8	Very low	110 Å²	110	139.2 Å²	139.2	74%	0.743	77%	0.77	S	S	*	*			trans	-129.6	53.9	159	58	0	0	0	0	111.5	P1100 I1104	P1100-C1102 PolarHBondContact O-N 3.31Å; P1100-C1102 VanDerWaalsContact O-N 3.12Å; C1102-I1104 VanDerWaalsContact C-N 3.32Å; C1102-I1104 PolarHBondContact O-N 3.3Å
1103	H	24.8	Very low	27.6	Very low	154 Å²	154	140.1 Å²	140.1	71%	0.713	77%	0.773	S	S	*	*			trans	-58.5	95.6	158.6	-79.3	-56.9	0	0	0	109.6	L1101 N1105	L1101-H1103 VanDerWaalsContact CD2-CD2 3.49Å; L1101-H1103 WeakPolarHBondContact CD2-CD2 3.43Å; H1103-N1105 PolarHBondContact O-N 3.18Å
1104	I	27.2	Very low	27.6	Very low	141 Å²	141	136 Å²	136	72%	0.723	76%	0.764	S	S	*	*			trans	-78.4	95.3	160.8	-60.7	-179.2	0	0	0	106.6	C1102 L1106	C1102-I1104 VanDerWaalsContact C-N 3.32Å; C1102-I1104 PolarHBondContact O-N 3.3Å; I1104-L1106 HydrophobicContact CG2-CD1 3.93Å; I1104-L1106 HydrophobicContact CG2-CG 4.12Å; I1104-L1106 PolarHBondContact O-N 3.21Å
1105	N	23.8	Very low	27.7	Very low	124 Å²	124	134 Å²	134	66%	0.663	76%	0.76	S	S	*	*			trans	-66.7	117.1	168.6	-75	-18.5	0	0	0	109	H1103	H1103-N1105 PolarHBondContact O-N 3.18Å
1106	L	27.4	Very low	27.6	Very low	154 Å²	154	136 Å²	136	81%	0.806	76%	0.757	S	S	*	*			trans	-130.1	71.1	168.7	-85.3	165.9	0	0	0	108.4	I1104	I1104-L1106 HydrophobicContact CG2-CD1 3.93Å; I1104-L1106 HydrophobicContact CG2-CG 4.12Å; I1104-L1106 PolarHBondContact O-N 3.21Å
1107	S	26.3	Very low	27.6	Very low	79 Å²	79	138 Å²	138	55%	0.552	76%	0.76	S	S	*	*			trans	-146.9	153	164	47.4	0	0	0	0	104.9
1108	N	32.4	Very low	27.8	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	76%	0.755	S	S	*	*			trans	77.6	121.1	-140.7	-52.6	6.7	0	0	0	111.6
1109	D	32.2	Very low	27.7	Very low	146 Å²	146	141.1 Å²	141.1	78%	0.781	75%	0.752	S	S	*	*			cis	174.8	154.8	-36.7	-92.2	-10.1	0	0	0	104.1
1110	D	28.7	Very low	27.9	Very low	147 Å²	147	145.8 Å²	145.8	79%	0.786	76%	0.764	S	S	*	*			trans	5.1	120.7	165.1	-76.6	-22	0	0	0	119.9
1111	L	30.7	Very low	27.9	Very low	167 Å²	167	148 Å²	148	87%	0.874	76%	0.76	S	S	*	*				-147.4	128.4	116.6	-112	168.1	0	0	0	111.8	V1113	L1111-V1113 PolarHBondContact O-N 2.87Å
1112	K	27.3	Very low	27.9	Very low	187 Å²	187	150.1 Å²	150.1	81%	0.813	77%	0.771	S	S	*	*			trans	-64	124.9	-179.7	-64.3	167.5	-178.8	166.8	0	111.1
1113	V	27.5	Very low	27.9	Very low	135 Å²	135	150.5 Å²	150.5	82%	0.818	78%	0.775	S	S	*	*			trans	-129.1	109.3	158.9	-176.4	0	0	0	0	110.1	L1111	L1111-V1113 PolarHBondContact O-N 2.87Å
1114	V	26.8	Very low	28.4	Very low	109 Å²	109	147.5 Å²	147.5	66%	0.661	77%	0.769	S	S	*	*			trans	-78	135.9	170.1	179.1	0	0	0	0	108.4	Q1116	V1114-Q1116 HydrophobicContact CG1-CB 4.35Å; V1114-Q1116 PolarHBondContact O-N 3.16Å
1115	P	29.1	Very low	28.5	Very low	125 Å²	125	149.6 Å²	149.6	81%	0.812	78%	0.776	S	S	*	*			trans	-73.6	68.2	168.2	31.7	-34.8	0	0	0	110.2	K1117	P1115-K1117 PolarHBondContact O-N 3.49Å; P1115-K1117 VanDerWaalsContact O-N 3.14Å
1116	Q	28.1	Very low	28.9	Very low	157 Å²	157	148.2 Å²	148.2	73%	0.734	78%	0.776	S	S	*	*			trans	-72.4	106	-177.1	-169.1	176.3	14.3	0	0	109.7	V1114 S1118	V1114-Q1116 HydrophobicContact CG1-CB 4.35Å; V1114-Q1116 PolarHBondContact O-N 3.16Å; Q1116-S1118 PolarHBondContact O-N 2.85Å
1117	K	26.2	Very low	29.1	Very low	205 Å²	205	149.2 Å²	149.2	89%	0.891	78%	0.777	S	S	*	*			trans	-63.1	105.2	172.4	-69.9	-178.7	177.8	179.5	0	109.5	P1115	P1115-K1117 PolarHBondContact O-N 3.49Å; P1115-K1117 VanDerWaalsContact O-N 3.14Å
1118	S	29	Very low	29.4	Very low	101 Å²	101	152 Å²	152	71%	0.706	79%	0.786	S	S	*	*			trans	-148.1	138.8	168.8	-79.1	0	0	0	0	111.1	Q1116	Q1116-S1118 PolarHBondContact O-N 2.85Å
1119	K	28.1	Very low	29.6	Very low	178 Å²	178	151.4 Å²	151.4	77%	0.774	78%	0.782	S	S	*	*			trans	-86.5	128.1	-171.1	-59	171.4	-178.3	176.2	0	110.5	F1121	K1119-F1121 HydrophobicContact CB-CD2 4Å; K1119-F1121 HydrophobicContact CD-CD2 4.43Å; K1119-F1121 HydrophobicContact CD-CE2 4.15Å
1120	R	29.1	Very low	29.8	Very low	245 Å²	245	149.3 Å²	149.3	93%	0.925	77%	0.774	S	S	*	*			trans	-99.4	129.2	132.6	-68.8	178.7	-178.8	165.7	-0.4	104.4
1121	F	28.6	Very low	29.9	Very low	180 Å²	180	148.8 Å²	148.8	79%	0.789	77%	0.772	S	S	*	*			cis	54.5	69.9	27.9	-77.3	-66.1	0	0	0	112.3	K1119	K1119-F1121 HydrophobicContact CB-CD2 4Å; K1119-F1121 HydrophobicContact CD-CD2 4.43Å; K1119-F1121 HydrophobicContact CD-CE2 4.15Å
1122	L	25.4	Very low	30	Very low	160 Å²	160	146.7 Å²	146.7	84%	0.838	76%	0.76	S	S	*	*			trans	-73.9	166.2	144.2	-74.5	164	0	0	0	110
1123	S	27.6	Very low	30.3	Very low	117 Å²	117	143.6 Å²	143.6	82%	0.818	75%	0.752	S	S	*	*			trans	117.6	152.6	168.5	-69.7	0	0	0	0	113.9
1124	P	35.2	Very low	30.6	Very low	91 Å²	91	145.9 Å²	145.9	59%	0.591	75%	0.751	S	S	*	*			cis	-121.9	174.5	-1.9	41.1	-28.1	0	0	0	114.4
1125	E	28.6	Very low	31	Very low	185 Å²	185	145.1 Å²	145.1	86%	0.864	75%	0.75	S	S	*	*			trans	59.4	156.6	149.1	-74	135.8	-150.8	0	0	119.6
1126	S	32.6	Very low	31.3	Very low	96 Å²	96	149.7 Å²	149.7	67%	0.671	75%	0.751	S	S	*	*			cis	-144.7	140.7	4.2	55.2	0	0	0	0	112.6
1127	E	31.1	Very low	31.6	Very low	175 Å²	175	147.4 Å²	147.4	82%	0.818	75%	0.748	S	S	*	*			trans	51.9	150.3	136.2	-63.4	-175.3	141.7	0	0	124.6
1128	D	34.1	Very low	32	Very low	138 Å²	138	145.5 Å²	145.5	74%	0.738	74%	0.74	S	S	*	*			trans	79.6	116.1	152.4	-63.4	-5.8	0	0	0	125.2
1129	D	36.3	Very low	32.2	Very low	135 Å²	135	146.5 Å²	146.5	72%	0.722	74%	0.742	S	S	*	*				102.4	92.7	125.8	-92	23.2	0	0	0	124.7
1130	V	34.9	Very low	32.5	Very low	102 Å²	102	146 Å²	146	62%	0.618	74%	0.74	S	S	*	*				87.3	117.9	105.2	155.3	0	0	0	0	121.5
1131	N	32.1	Very low	32.5	Very low	137 Å²	137	143.9 Å²	143.9	73%	0.733	73%	0.732	S	S	*	*			trans	73.7	149.9	145.1	-84.5	-17.9	0	0	0	119.5
1132	I	31.9	Very low	32.7	Very low	123 Å²	123	140.7 Å²	140.7	63%	0.631	72%	0.719	S	S	*	*			cis	-166.1	169.6	7.4	-137.7	164.4	0	0	0	114.6
1133	L	34.4	Very low	33.2	Very low	122 Å²	122	142.4 Å²	142.4	64%	0.639	71%	0.714	S	S	*	*			trans	66.6	119.1	164	-90.2	40.8	0	0	0	118.5
1134	K	32.9	Very low	33.4	Very low	182 Å²	182	145 Å²	145	79%	0.791	71%	0.713	S	S	*	*				86.6	141.8	58	-77.7	175.3	-158.4	162.5	0	113.1
1135	S	36.1	Very low	33.3	Very low	93 Å²	93	150.9 Å²	150.9	65%	0.65	73%	0.73	S	S	*	*			cis	-173	159.2	12.3	45.6	0	0	0	0	116.7
1136	R	35	Very low	33.4	Very low	221 Å²	221	149.8 Å²	149.8	83%	0.834	72%	0.722	S	S	*	*			trans	72.4	155.2	141.7	-78.3	160.5	79.1	145.3	-1.7	117.4
1137	T	35.5	Very low	33.4	Very low	110 Å²	110	151.6 Å²	151.6	68%	0.675	73%	0.729	S	S	*	*			cis	-164.8	164.8	8.6	2.9	0	0	0	0	109.3
1138	K	33.6	Very low	33.2	Very low	165 Å²	165	147.4 Å²	147.4	72%	0.717	72%	0.716	S	S	*	*			cis	-170	123.1	-12.5	-144.4	-176.6	-170.1	-179.3	0	113.5
1139	T	33.1	Very low	33.2	Very low	122 Å²	122	147.6 Å²	147.6	75%	0.748	72%	0.722	S	S	*	*			trans	66.8	169	146.4	59.3	0	0	0	0	119.9
1140	K	34	Very low	32.9	Very low	167 Å²	167	147.4 Å²	147.4	73%	0.726	72%	0.721	S	S	*	*			cis	-166.1	119	25.1	-155.5	175.2	-177.3	-174	0	117.4
1141	R	30.4	Very low	32.7	Very low	201 Å²	201	152.7 Å²	152.7	76%	0.758	74%	0.736	S	S	*	*			trans	62.2	160	140.4	-69.2	-176.2	176.3	-174.7	-0.3	120.3
1142	H	32.5	Very low	32.6	Very low	113 Å²	113	154 Å²	154	52%	0.523	74%	0.735	S	S	.	*			cis	-163	152.5	6.2	-128.5	-15.2	0	0	0	115.1
1143	R	34.6	Very low	32.4	Very low	195 Å²	195	153.7 Å²	153.7	74%	0.736	74%	0.735	S	S	*	*			trans	68.1	134.1	151.4	-62.5	166.9	-162.9	-171.2	2.5	117.9
1144	H	33.2	Very low	32.2	Very low	171 Å²	171	154 Å²	154	79%	0.792	74%	0.741	S	S	*	*			cis	99.7	118.9	26	-76.1	-52.2	0	0	0	115
1145	F	31.6	Very low	31.9	Very low	215 Å²	215	150.6 Å²	150.6	94%	0.943	73%	0.731	S	S	*	*				-151.4	175.6	123.2	-119.1	-81.9	0	0	0	110.6
1146	K	31.5	Very low	31.5	Very low	162 Å²	162	152.7 Å²	152.7	70%	0.704	74%	0.735	S	S	*	*			trans	-156.8	139.7	-154.5	165.9	-170.2	171.7	-176.6	0	114.2	T1148	K1146-T1148 HydrophobicContact CD-CG2 4.3Å; K1146-T1148 HydrophobicContact CG-CG2 4.03Å
1147	T	32.3	Very low	31.3	Very low	134 Å²	134	150 Å²	150	82%	0.822	74%	0.736	S	S	*	*			trans	-164.8	133.3	146.9	26	0	0	0	0	107.2
1148	T	27.8	Very low	30.9	Very low	88 Å²	88	151.2 Å²	151.2	54%	0.54	74%	0.738	S	S	.	*			cis	77.2	111.3	22.9	69.4	0	0	0	0	118.7	K1146	K1146-T1148 HydrophobicContact CD-CG2 4.3Å; K1146-T1148 HydrophobicContact CG-CG2 4.03Å
1149	V	33.2	Very low	30.7	Very low	142 Å²	142	150.4 Å²	150.4	86%	0.861	74%	0.742	S	S	*	*				-147.5	142.7	124.9	177.8	0	0	0	0	108.3
1150	D	30.2	Very low	30.5	Very low	131 Å²	131	151.1 Å²	151.1	70%	0.701	74%	0.741	S	S	*	*			trans	-99.2	166.9	179.7	-55.3	-96.3	0	0	0	113.4
1151	F	30.8	Very low	30.5	Very low	213 Å²	213	149.8 Å²	149.8	93%	0.934	74%	0.742	S	S	*	*			trans	-153.6	162.7	136.2	-111.4	-72.2	0	0	0	110.7
1152	K	29.5	Very low	30.7	Very low	165 Å²	165	147 Å²	147	72%	0.717	74%	0.742	S	S	*	*			trans	-165.4	155.3	-145.2	167.8	172	176.7	179.7	0	115
1153	N	27.4	Very low	30.7	Very low	116 Å²	116	149.7 Å²	149.7	62%	0.62	75%	0.752	S	S	*	*			trans	70.7	163.6	177.1	-60.8	-5.8	0	0	0	114.2	I1155	N1153-I1155 HydrophobicContact CB-CD1 4.37Å
1154	V	30	Very low	30.7	Very low	127 Å²	127	146.6 Å²	146.6	77%	0.77	75%	0.75	S	S	*	*			cis	-141.8	131.2	25.2	166.8	0	0	0	0	107.2
1155	I	27.8	Very low	30.8	Very low	111 Å²	111	147.4 Å²	147.4	57%	0.569	75%	0.754	S	S	*	*				87.9	121.7	57.4	-71.6	169.9	0	0	0	113.8	N1153	N1153-I1155 HydrophobicContact CB-CD1 4.37Å
1156	D	26.9	Very low	30.8	Very low	138 Å²	138	142.3 Å²	142.3	74%	0.738	74%	0.741	S	S	*	*			trans	48.8	141.7	158.1	-48.7	-11.1	0	0	0	121
1157	L	32.2	Very low	30.7	Very low	163 Å²	163	141.4 Å²	141.4	85%	0.853	74%	0.744	S	S	*	*				-170.4	160.4	68.2	-91.4	170.8	0	0	0	115.4
1158	N	25.7	Very low	30.7	Very low	136 Å²	136	146.4 Å²	146.4	73%	0.727	75%	0.748	S	S	*	*			trans	-44.1	153.8	169.6	-68.9	-16.2	0	0	0	116.3
1159	N	31	Very low	31.1	Very low	149 Å²	149	149.2 Å²	149.2	80%	0.797	76%	0.758	S	S	*	*				-168.7	169.4	76.9	-100.4	-40.3	0	0	0	115.5
1160	N	27.7	Very low	31	Very low	136 Å²	136	149.4 Å²	149.4	73%	0.727	75%	0.753	S	S	*	*			trans	-69.3	165.8	172	-53.2	-54	0	0	0	111.9
1161	D	33.6	Very low	30.9	Very low	139 Å²	139	147 Å²	147	74%	0.743	75%	0.746	S	S	*	*				-175.4	170.8	82.3	-95.2	-29.5	0	0	0	113.9
1162	N	35.8	Very low	30.9	Very low	142 Å²	142	144.9 Å²	144.9	76%	0.759	74%	0.739	S	S	*	*			trans	61.5	87.5	161.5	-58	-32.6	0	0	0	117.2
1163	K	31.9	Very low	30.9	Very low	171 Å²	171	143.9 Å²	143.9	74%	0.743	74%	0.74	S	S	*	*				67.6	142.6	53.4	-145.5	-161.3	175.7	-160.3	0	114.7
1164	D	34.8	Very low	30.8	Very low	129 Å²	129	146.6 Å²	146.6	69%	0.69	75%	0.749	S	S	*	*			trans	67.2	135.7	171.6	-52.2	-38	0	0	0	114.9
1165	E	35.7	Very low	30.7	Very low	189 Å²	189	146 Å²	146	88%	0.883	75%	0.746	S	S	*	*			cis	-131.3	150.7	35	-173	164.4	-155.2	0	0	114.1
1166	T	31.2	Very low	30.7	Very low	107 Å²	107	146.9 Å²	146.9	66%	0.656	75%	0.752	S	S	*	*			trans	-144.2	157.1	179.6	57.2	0	0	0	0	112.3
1167	N	29.2	Very low	30.9	Very low	144 Å²	144	148.2 Å²	148.2	77%	0.77	75%	0.754	S	S	*	*			trans	66	130.6	166.1	-55.1	-66.8	0	0	0	118.3
1168	R	33.2	Very low	30.7	Very low	239 Å²	239	144.4 Å²	144.4	90%	0.902	74%	0.741	S	S	*	*				-164.6	147.1	123.8	-109.1	160.1	-159.9	-131.4	1.3	113.5
1169	I	35.8	Very low	30.8	Very low	147 Å²	147	144.8 Å²	144.8	75%	0.754	74%	0.742	S	S	*	*			trans	70.4	96.7	171.8	-56.7	171.4	0	0	0	113.2
1170	L	30.2	Very low	30.9	Very low	146 Å²	146	145.2 Å²	145.2	76%	0.764	74%	0.737	S	S	*	*				65.1	95.2	62	-61.4	155.3	0	0	0	111.1
1171	S	27.9	Very low	31	Very low	79 Å²	79	145.9 Å²	145.9	55%	0.552	74%	0.736	S	S	*	*				65.3	122	87.1	74	0	0	0	0	114.3
1172	H	31.5	Very low	30.9	Very low	169 Å²	169	144.7 Å²	144.7	78%	0.782	74%	0.737	S	S	*	*				-176.8	148.3	120.5	-99.1	-56.6	0	0	0	113.9
1173	I	30.2	Very low	30.9	Very low	145 Å²	145	143.2 Å²	143.2	74%	0.744	74%	0.738	S	S	*	*			trans	71	95.8	140.8	-65.9	166.2	0	0	0	117.3
1174	E	25.7	Very low	30.9	Very low	173 Å²	173	139.6 Å²	139.6	81%	0.808	74%	0.735	S	S	*	*			trans	-50.7	167.6	144.6	-60.3	165.6	113.4	0	0	113.6
1175	T	27.6	Very low	30.8	Very low	114 Å²	114	140.5 Å²	140.5	70%	0.699	74%	0.739	S	S	*	*			trans	73.6	142	162.1	68.4	0	0	0	0	118.3
1176	N	27.3	Very low	30.8	Very low	130 Å²	130	137.2 Å²	137.2	70%	0.695	73%	0.727	S	S	*	*			trans	67.5	156.1	155.5	-63	13.3	0	0	0	116.7
1177	E	31.7	Very low	31	Very low	166 Å²	166	138.2 Å²	138.2	78%	0.776	73%	0.728	S	S	*	*			cis	-149.3	-178.6	-4.3	-132.5	155.5	-139.4	0	0	112.3
1178	S	28.1	Very low	31.4	Very low	83 Å²	83	138.1 Å²	138.1	58%	0.58	72%	0.723	S	S	*	*			trans	-74.4	158.9	-173.5	60.5	0	0	0	0	116.8
1179	N	26.8	Very low	31.6	Very low	143 Å²	143	132.5 Å²	132.5	77%	0.765	71%	0.711	S	S	*	*			trans	71.3	121.1	149.4	-53.5	-31.4	0	0	0	120.1
1180	K	32.7	Very low	31.7	Very low	158 Å²	158	131.3 Å²	131.3	69%	0.687	71%	0.706	S	S	*	*				167	129.1	112.1	-90.5	178.3	166.8	-74.8	0	111
1181	E	30.9	Very low	32	Very low	151 Å²	151	130.3 Å²	130.3	71%	0.706	70%	0.7	S	S	*	*				64.7	138.5	106.1	-60.3	165.9	179.1	0	0	114.5
1182	C	31.6	Very low	32.4	Very low	113 Å²	113	132.6 Å²	132.6	76%	0.764	71%	0.706	S	S	*	*			cis	-157	177.3	14.7	-152.2	0	0	0	0	113.1
1183	S	34.3	Very low	32.5	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	70%	0.701	S	S	*	*			trans	65.2	135.4	166.4	49.5	0	0	0	0	118.6
1184	S	33.1	Very low	32.6	Very low	96 Å²	96	128.8 Å²	128.8	67%	0.671	70%	0.697	S	S	*	*			cis	-167.6	127.9	-3.6	45.3	0	0	0	0	113.2
1185	L	32.5	Very low	33	Very low	148 Å²	148	125.1 Å²	125.1	78%	0.775	70%	0.696	S	S	*	*			trans	63	140.3	142.8	-48.9	175.9	0	0	0	118.8
1186	D	34.6	Very low	33.2	Very low	120 Å²	120	125.6 Å²	125.6	64%	0.642	69%	0.694	S	S	*	*			cis	-159.8	164.9	-6.5	-102.8	-20.1	0	0	0	111.6
1187	D	35.4	Very low	33.3	Very low	127 Å²	127	125.9 Å²	125.9	68%	0.679	69%	0.694	S	S	*	*			trans	59.5	139	154.2	-63.4	-5.6	0	0	0	121.4
1188	H	38.9	Very low	33.2	Very low	143 Å²	143	122.3 Å²	122.3	66%	0.662	69%	0.688	S	S	*	*			cis	-163.2	137.9	-7.9	-121	-49.9	0	0	0	110
1189	N	36.6	Very low	33.3	Very low	120 Å²	120	123.6 Å²	123.6	64%	0.642	69%	0.692	S	S	*	*			trans	57.6	157.3	150.1	-68.7	35.8	0	0	0	119.8
1190	D	38.3	Very low	33.7	Very low	122 Å²	122	122 Å²	122	65%	0.652	69%	0.688	S	S	*	*			cis	-165.5	163.9	-11.3	-99.1	-19.1	0	0	0	107.8
1191	I	36.8	Very low	33.6	Very low	126 Å²	126	120.9 Å²	120.9	65%	0.646	69%	0.689	S	S	*	*			cis	-169.7	160.6	-30.8	-163.3	168	0	0	0	108.8
1192	N	36.5	Very low	33.7	Very low	126 Å²	126	119.1 Å²	119.1	67%	0.674	69%	0.689	S	S	*	*			trans	67.1	158.7	163.9	-75.4	-27.5	0	0	0	120.4
1193	N	33	Very low	33.6	Very low	127 Å²	127	120.1 Å²	120.1	68%	0.679	69%	0.687	S	S	*	*			cis	-165	147.6	-47.5	-124.9	-28.4	0	0	0	113.2
1194	V	33.1	Very low	33.4	Very low	107 Å²	107	120.5 Å²	120.5	65%	0.648	68%	0.684	S	S	*	*			trans	14.2	127.4	139.4	173.1	0	0	0	0	120.2
1195	A	34.5	Very low	33.3	Very low	96 Å²	96	121.4 Å²	121.4	79%	0.793	69%	0.686	S	S	*	*				175.9	163.1	112.1	0	0	0	0	0	112.5
1196	N	30	Very low	33.2	Very low	125 Å²	125	119.9 Å²	119.9	67%	0.668	68%	0.683	S	S	*	*			cis	160	145.5	-39.7	-112.7	-11.3	0	0	0	108.7
1197	I	31	Very low	33.1	Very low	135 Å²	135	123.1 Å²	123.1	69%	0.692	69%	0.692	S	S	*	*			trans	71.6	86.5	141	-63.7	170.3	0	0	0	118.6
1198	S	28.3	Very low	32.8	Very low	91 Å²	91	121.7 Å²	121.7	64%	0.636	70%	0.698	S	S	*	*				81.9	166	108.9	83.4	0	0	0	0	124.8
1199	T	29.8	Very low	32.5	Very low	111 Å²	111	118.7 Å²	118.7	68%	0.681	70%	0.697	S	S	*	*			trans	89.5	133.6	142.1	31.7	0	0	0	0	122.7
1200	T	35	Very low	32.3	Very low	110 Å²	110	120.4 Å²	120.4	68%	0.675	71%	0.707	S	S	*	*			trans	67.6	97.9	146	52.3	0	0	0	0	121
1201	D	31	Very low	31.8	Very low	133 Å²	133	118.5 Å²	118.5	71%	0.711	70%	0.703	S	S	*	*				67	121.7	102.9	-61.5	-23.6	0	0	0	122.8
1202	T	32.9	Very low	31.4	Very low	115 Å²	115	120 Å²	120	71%	0.706	71%	0.712	S	S	*	*			trans	82.3	121.7	134.3	59.5	0	0	0	0	122
1203	N	30.6	Very low	31.1	Very low	134 Å²	134	119.1 Å²	119.1	72%	0.717	71%	0.71	S	S	*	*				75.4	105.5	127.2	-65.4	-14.1	0	0	0	121.8
1204	T	30.6	Very low	30.9	Very low	118 Å²	118	118.9 Å²	118.9	72%	0.724	71%	0.713	S	S	*	*				85.8	124.6	121.6	59.3	0	0	0	0	121.5
1205	T	30.1	Very low	30.8	Very low	115 Å²	115	118.3 Å²	118.3	71%	0.706	71%	0.714	S	S	*	*			trans	76.8	115.1	138.1	47.5	0	0	0	0	122
1206	T	31.1	Very low	30.5	Very low	117 Å²	117	118.7 Å²	118.7	72%	0.718	71%	0.711	S	S	*	*				90.2	134.7	127.7	56.1	0	0	0	0	122.3
1207	K	32.6	Very low	30.6	Very low	187 Å²	187	118.8 Å²	118.8	81%	0.813	72%	0.716	S	S	*	*			trans	72.8	81.7	141.8	-73.5	169.6	-179.4	175.6	0	119.1
1208	A	29	Very low	30.5	Very low	98 Å²	98	118.4 Å²	118.4	81%	0.81	72%	0.715	S	S	*	*				68.8	155.4	98.6	0	0	0	0	0	121.7
1209	A	31.3	Very low	30.7	Very low	79 Å²	79	120 Å²	120	65%	0.653	72%	0.722	S	S	*	*			trans	88.1	140.2	155.6	0	0	0	0	0	117.9
1210	N	32.1	Very low	30.8	Very low	157 Å²	157	119.4 Å²	119.4	84%	0.84	72%	0.722	S	S	*	*			trans	75.8	147.3	152.1	-61.9	-14	0	0	0	118
1211	S	28.7	Very low	30.6	Very low	81 Å²	81	122.6 Å²	122.6	57%	0.566	73%	0.726	S	S	*	*			cis	-175.4	125.8	-13.9	157.2	0	0	0	0	111.3
1212	L	29.3	Very low	30.5	Very low	159 Å²	159	122.2 Å²	122.2	83%	0.832	72%	0.723	S	S	*	*			trans	61.4	179.7	154	-81.8	56	0	0	0	113.8
1213	V	28.8	Very low	30.4	Very low	107 Å²	107	122.7 Å²	122.7	65%	0.648	73%	0.726	S	S	*	*			cis	-157.7	149.1	-0.6	98.3	0	0	0	0	111
1214	T	30.3	Very low	30.4	Very low	121 Å²	121	124.3 Å²	124.3	74%	0.742	73%	0.727	S	S	*	*			trans	59.4	167.8	159.4	59.7	0	0	0	0	119.2
1215	S	30	Very low	30.2	Very low	95 Å²	95	126.5 Å²	126.5	66%	0.664	73%	0.733	S	S	*	*			cis	-151.8	126	-6.1	11.6	0	0	0	0	108.3
1216	S	28.7	Very low	30.3	Very low	104 Å²	104	125 Å²	125	73%	0.727	73%	0.727	S	S	*	*				90.1	166.8	84.2	-57.9	0	0	0	0	113.4
1217	V	32.4	Very low	30.5	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	74%	0.736	S	S	*	*			trans	74.9	128.2	165.7	-176.6	0	0	0	0	115.6
1218	N	29	Very low	30.5	Very low	127 Å²	127	127 Å²	127	68%	0.679	73%	0.733	S	S	*	*			cis	-170.6	156.7	-21.6	-115.6	-18.9	0	0	0	110.7
1219	T	30.7	Very low	30.8	Very low	125 Å²	125	125.7 Å²	125.7	77%	0.767	73%	0.729	S	S	*	*			trans	61.2	160.3	151.7	54	0	0	0	0	117.6
1220	S	32.4	Very low	30.9	Very low	98 Å²	98	127.4 Å²	127.4	69%	0.685	74%	0.736	S	S	*	*			cis	-170.5	166.5	-6.1	33.2	0	0	0	0	107.4
1221	K	31.6	Very low	30.9	Very low	176 Å²	176	125 Å²	125	77%	0.765	73%	0.731	S	S	*	*			cis	-164	146.5	-9.6	-108.6	167.1	-179.3	173.6	0	107.8
1222	I	28.5	Very low	31.1	Very low	125 Å²	125	128.3 Å²	128.3	64%	0.641	74%	0.742	S	S	*	*			trans	36.7	115.6	135.9	-48.7	166.5	0	0	0	119.2	K1224	I1222-K1224 HydrophobicContact CG2-CD 4.31Å; I1222-K1224 HydrophobicContact CG2-CG 4.36Å
1223	T	31.2	Very low	31.2	Very low	125 Å²	125	126 Å²	126	77%	0.767	74%	0.74	S	S	*	*				178.6	105.6	114.4	-69.9	0	0	0	0	107.5
1224	K	29.5	Very low	31.1	Very low	169 Å²	169	123.7 Å²	123.7	74%	0.735	74%	0.737	S	S	*	*				78.1	140.1	60.6	-79.7	-167.7	171.6	-176.8	0	115	I1222	I1222-K1224 HydrophobicContact CG2-CD 4.31Å; I1222-K1224 HydrophobicContact CG2-CG 4.36Å
1225	L	27.9	Very low	31.1	Very low	163 Å²	163	129.4 Å²	129.4	85%	0.853	75%	0.747	S	S	*	*			trans	81.4	137.3	166.2	-59.7	143.4	0	0	0	115.9
1226	S	31.5	Very low	30.9	Very low	85 Å²	85	132.6 Å²	132.6	59%	0.594	75%	0.751	S	S	*	*			cis	-166.8	149	-10.6	54.7	0	0	0	0	115.2
1227	R	34.3	Very low	30.9	Very low	238 Å²	238	136.1 Å²	136.1	90%	0.898	76%	0.761	S	S	*	*			trans	65.2	155.1	146	-77	172.8	164.4	167.3	-7.6	117.7
1228	S	34.1	Very low	30.5	Very low	107 Å²	107	139.7 Å²	139.7	75%	0.748	76%	0.76	S	S	*	*			cis	-163.5	137.4	-15.9	40.3	0	0	0	0	106.8
1229	G	33.9	Very low	30.4	Very low	71 Å²	71	142.5 Å²	142.5	73%	0.732	77%	0.767	S	S	*	*				127.3	165.2	69.9	0	0	0	0	0	107.9
1230	S	34.6	Very low	30.3	Very low	114 Å²	114	143.2 Å²	143.2	80%	0.797	77%	0.766	S	S	*	*			cis	-159.4	156.2	4.3	-65.7	0	0	0	0	110.3
1231	S	30.9	Very low	30	Very low	106 Å²	106	146.9 Å²	146.9	74%	0.741	77%	0.772	S	S	*	*			trans	39.2	138.4	143.7	-126.2	0	0	0	0	120.9
1232	L	34.6	Very low	30	Very low	151 Å²	151	147.4 Å²	147.4	79%	0.791	78%	0.777	S	S	*	*			cis	-140.6	144.5	33.3	-72.8	151.5	0	0	0	109
1233	S	29.7	Very low	29.9	Very low	112 Å²	112	150.1 Å²	150.1	78%	0.783	79%	0.785	S	S	*	*				53.1	120.9	71.2	-165.3	0	0	0	0	114
1234	G	28.2	Very low	29.7	Very low	57 Å²	57	151 Å²	151	59%	0.588	78%	0.784	S	S	*	*			cis	145.4	124.4	-4.7	0	0	0	0	0	112
1235	Y	30	Very low	29.7	Very low	241 Å²	241	154.5 Å²	154.5	95%	0.945	79%	0.793	S	S	*	*			trans	-142.1	138	165	-86.3	-73	0	0	0	110
1236	Q	26.3	Very low	29.7	Very low	162 Å²	162	155.1 Å²	155.1	76%	0.757	79%	0.791	S	S	*	*			trans	-136.2	115.4	-171.8	179.6	177.6	-2.3	0	0	109.4
1237	L	28	Very low	29.7	Very low	179 Å²	179	159.5 Å²	159.5	94%	0.937	81%	0.807	S	S	*	*			trans	-102.7	125.6	169.3	-77.5	171	0	0	0	110.2
1238	R	23	Very low	29.3	Very low	202 Å²	202	157.8 Å²	157.8	76%	0.762	81%	0.806	S	S	*	*			trans	-115.6	-168.7	171.6	-126.3	-176.1	-172.1	-170.8	4.2	107.7
1239	F	28.2	Very low	29.3	Very low	187 Å²	187	158.1 Å²	158.1	82%	0.82	81%	0.806	S	S	*	*			trans	79.5	137.5	-179.8	-49.5	-65.7	0	0	0	114.6
1240	N	28.4	Very low	28.8	Very low	139 Å²	139	159.7 Å²	159.7	74%	0.743	81%	0.806	S	S	*	*			cis	-151.7	167.4	-20.5	-131.5	8.7	0	0	0	111.8
1241	Q	26.1	Very low	28.6	Very low	176 Å²	176	160.4 Å²	160.4	82%	0.822	80%	0.799	S	S	*	*			trans	-82.3	138.5	161	-67	178.6	-16.4	0	0	109.8
1242	E	30.3	Very low	28.6	Very low	186 Å²	186	164.7 Å²	164.7	87%	0.869	81%	0.805	S	S	*	*			trans	-151	167.4	152.1	-148.4	90.9	-112.1	0	0	109.3
1243	K	27.3	Very low	28.2	Very low	182 Å²	182	164 Å²	164	79%	0.791	80%	0.802	S	S	*	*			trans	-111.4	150.5	-159.5	-63.1	168.6	-177.4	166	0	113.8
1244	N	26	Very low	28.2	Very low	143 Å²	143	164.8 Å²	164.8	77%	0.765	80%	0.802	S	S	*	*			trans	44.8	111.2	146.2	-64.9	-21.9	0	0	0	118.9
1245	R	30.8	Very low	28.2	Very low	244 Å²	244	166 Å²	166	92%	0.921	80%	0.802	S	S	*	*				-171.5	166.4	105.3	-100.2	155.9	-174.3	-175.2	1.9	113.2
1246	H	28	Very low	28.1	Very low	175 Å²	175	163 Å²	163	81%	0.81	80%	0.797	S	S	*	*			trans	-60.4	143.9	179.9	-59.5	-114.7	0	0	0	112.4
1247	L	30.4	Very low	28.2	Very low	178 Å²	178	161.5 Å²	161.5	93%	0.932	80%	0.8	S	S	*	*				-162.4	170.7	109.5	-99.9	159.7	0	0	0	110.5
1248	K	26.2	Very low	28.1	Very low	201 Å²	201	158 Å²	158	87%	0.874	79%	0.791	S	S	*	*			trans	-112	-178.8	-163.5	-118.1	-162.7	171	178.4	0	111.9
1249	P	33.8	Very low	28.4	Very low	114 Å²	114	154 Å²	154	74%	0.74	79%	0.79	S	S	*	*			trans	-108.8	-173.7	-135.4	44.2	-34.4	0	0	0	113.7
1250	S	25	Very low	28.4	Very low	105 Å²	105	151.4 Å²	151.4	73%	0.734	79%	0.791	S	S	*	*			trans	137.4	165.6	135.1	-162.5	0	0	0	0	113.6
1251	I	28.8	Very low	28.6	Very low	129 Å²	129	150 Å²	150	66%	0.662	79%	0.787	S	S	*	*			trans	64.6	96.5	166.8	-40.6	-176.1	0	0	0	116.3
1252	F	32.4	Very low	28.9	Very low	196 Å²	196	147.7 Å²	147.7	86%	0.86	78%	0.781	S	S	*	*				-153.9	113.9	95.1	-112.7	-77.6	0	0	0	112
1253	N	26	Very low	29.7	Very low	137 Å²	137	140.5 Å²	140.5	73%	0.733	75%	0.75	S	S	*	*			trans	-74.2	173.8	162.9	-66.5	-34.9	0	0	0	108.1
1254	T	28.3	Very low	30.9	Very low	127 Å²	127	140.4 Å²	140.4	78%	0.779	75%	0.75	S	S	*	*			cis	-172.3	129.9	44.2	-46	0	0	0	0	112.5
1255	S	29.9	Very low	32.9	Very low	83 Å²	83	136.6 Å²	136.6	58%	0.58	73%	0.732	S	S	*	*			trans	-158.7	124.8	131.2	63.8	0	0	0	0	108.4	R1025	R1025-S1255 PolarHBondContact NH2-OG 2.88Å
1256	Q	27.1	Very low	35.4	Very low	179 Å²	179	126.4 Å²	126.4	84%	0.836	70%	0.696	S	S	*	*			trans	-71	157.9	-168.7	-81.5	-176.3	-24.6	0	0	114.3
1257	P	27.3	Very low	38.1	Very low	129 Å²	129	118.5 Å²	118.5	84%	0.838	66%	0.659	S	S	*	*			trans	-75.4	131.4	174.7	31.5	-34.6	0	0	0	111.6
1258	S	27	Very low	40.8	Very low	105 Å²	105	110.1 Å²	110.1	73%	0.734	62%	0.615	S	S	*	*			trans	-99.5	108.7	178.6	52.8	0	0	0	0	112.1
1259	T	29.5	Very low	43.7	Very low	120 Å²	120	103 Å²	103	74%	0.736	59%	0.585	S	S	*	*			trans	58.6	131.2	160.4	53.2	0	0	0	0	119.3	V1261	T1259-V1261 PolarHBondContact O-N 2.83Å
1260	P	27.4	Very low	46.3	Very low	131 Å²	131	97.7 Å²	97.7	85%	0.851	55%	0.55	S	S	*	*			trans	-74	117.1	172.1	30.8	-32.7	0	0	0	110.8	N1262	P1260-N1262 PolarHBondContact O-N 2.82Å
1261	V	33.3	Very low	49.3	Very low	110 Å²	110	96 Å²	96	67%	0.667	53%	0.53	S	S	*	.			trans	-75.8	109.7	171.8	-179.3	0	0	0	0	108.7	T1259 C1263	T1259-V1261 PolarHBondContact O-N 2.83Å; V1261-C1263 PolarHBondContact O-N 2.8Å
1262	N	32.9	Very low	52.1	Low	128 Å²	128	89.9 Å²	89.9	68%	0.684	50%	0.499	S	S	*	.			trans	-75.7	103.4	176.4	-172	-1.7	0	0	0	109.9	P1260 K1264	P1260-N1262 PolarHBondContact O-N 2.82Å; N1262-K1264 PolarHBondContact O-N 2.92Å
1263	C	45.7	Very low	54.3	Low	34 Å²	34	84.6 Å²	84.6	23%	0.23	48%	0.479	C	S	.	.			trans	-67.2	95.4	-178.7	-64	0	0	0	0	111.5	V1261 T1265 I1267	V1261-C1263 PolarHBondContact O-N 2.8Å; C1263-T1265 PolarHBondContact O-N 2.8Å; C1263-I1267 HydrophobicContact CB-CD1 4.27Å
1264	K	53.5	Low	56.6	Low	181 Å²	181	79.8 Å²	79.8	79%	0.787	46%	0.461	S	S	*	.			trans	-69.1	6.4	177.7	-60.2	-178	179.1	178.8	0	114.9	N1262	N1262-K1264 PolarHBondContact O-N 2.92Å
1265	T	68.1	Low	59	Low	62 Å²	62	74.2 Å²	74.2	38%	0.38	43%	0.428	S	S	.	.	S	Bend	trans	-143	143.9	-168.6	50.1	0	0	0	0	109.2	C1263	C1263-T1265 PolarHBondContact O-N 2.8Å
1266	N	82.3	Confident	61.3	Low	30 Å²	30	73.4 Å²	73.4	16%	0.16	41%	0.414	C	S	.	.			trans	-72.1	140.4	174.7	-56.7	-45.4	0	0	0	110.4	R1077 S1078 N1290 F1293	R1077-N1266 WeakPolarHBondContact CA-OD1 3.35Å; S1078-N1266 PolarHBondContact N-OD1 3.44Å; N1266-N1290 PolarHBondContact ND2-OD1 2.88Å; N1266-F1293 HydrophobicContact CB-CD1 4.02Å; N1266-F1293 HydrophobicContact CB-CD2 3.86Å; N1266-F1293 HydrophobicContact CB-CE1 3.71Å; N1266-F1293 HydrophobicContact CB-CE2 3.52Å; N1266-F1293 HydrophobicContact CB-CG 4.11Å; N1266-F1293 HydrophobicContact CB-CZ 3.46Å; N1266-F1293 VanDerWaalsContact CB-CZ 3.46Å
1267	I	85.4	Confident	63.3	Low	10 Å²	10	67.8 Å²	67.8	5%	0.051	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.9	-171.5	-65.8	172.5	0	0	0	110.2	Q1076 C1263 T1284 L1285	Q1076-I1267 PolarHBondContact N-O 2.85Å; Q1076-I1267 PolarHBondContact O-N 2.83Å; C1263-I1267 HydrophobicContact CB-CD1 4.27Å; I1267-T1284 HydrophobicContact CG2-CG2 3.51Å; I1267-L1285 CarbonylContact C-O 3.57Å; I1267-L1285 WeakPolarHBondContact CA-O 3.39Å
1268	I	87.4	Confident	65.1	Low	1 Å²	1	65.2 Å²	65.2	1%	0.005	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.2	167.4	-46.1	-177	0	0	0	107.6	V1075 L1270 L1285 F1293 W1296	V1075-I1268 HydrophobicContact CG2-CG1 4.47Å; I1268-L1270 HydrophobicContact CG2-CD2 3.71Å; I1268-L1270 HydrophobicContact CG2-CG 4.18Å; I1268-L1285 PolarHBondContact N-O 2.81Å; I1268-L1285 WeakPolarHBondContact O-CB 3.44Å; I1268-L1285 PolarHBondContact O-N 3.22Å; I1268-F1293 HydrophobicContact CD1-CD2 4.11Å; I1268-F1293 HydrophobicContact CD1-CE2 4.08Å; I1268-F1293 HydrophobicContact CG1-CD2 3.88Å; I1268-F1293 HydrophobicContact CG1-CE2 3.42Å; I1268-F1293 VanDerWaalsContact CG1-CE2 3.42Å; I1268-F1293 HydrophobicContact CG1-CZ 4.22Å; I1268-W1296 HydrophobicContact CD1-CB 3.66Å
1269	H	87.3	Confident	67	Low	52 Å²	52	64.3 Å²	64.3	24%	0.241	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.3	165.5	-61.8	-92	0	0	0	108.6	P1073 L1074 L1283 T1284	P1073-H1269 CarbonylContact C-O 3.56Å; P1073-H1269 WeakPolarHBondContact CA-O 3.46Å; L1074-H1269 HydrophobicContact CB-CB 4.29Å; L1074-H1269 PolarHBondContact N-O 2.84Å; L1074-H1269 PolarHBondContact O-N 2.83Å; H1269-L1283 CarbonylContact C-O 3.55Å; H1269-L1283 WeakPolarHBondContact CA-O 3.18Å; H1269-T1284 WeakPolarHBondContact CE1-CG2 3.45Å; H1269-T1284 PolarHBondContact CE1-OG1 2.9Å; H1269-T1284 WeakPolarHBondContact ND1-CG2 3.45Å; H1269-T1284 PolarHBondContact ND1-OG1 2.9Å
1270	L	88.9	Confident	68.9	Low	2 Å²	2	61.6 Å²	61.6	1%	0.01	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.6	173.3	-59.3	-179.6	0	0	0	109.2	L1042 L1049 V1071 P1073 I1268 L1272 E1282 L1283 L1285 F1300	L1042-L1270 HydrophobicContact CD1-CD1 3.8Å; L1049-L1270 HydrophobicContact CD2-CD1 4.26Å; V1071-L1270 HydrophobicContact CG1-CD2 4.19Å; P1073-L1270 HydrophobicContact CB-CD2 3.82Å; I1268-L1270 HydrophobicContact CG2-CD2 3.71Å; I1268-L1270 HydrophobicContact CG2-CG 4.18Å; L1270-L1272 HydrophobicContact CB-CD1 4.06Å; L1270-E1282 WeakPolarHBondContact O-CA 3.34Å; L1270-L1283 HydrophobicContact CB-CB 4.45Å; L1270-L1283 PolarHBondContact N-O 2.88Å; L1270-L1283 PolarHBondContact O-N 2.85Å; L1270-L1285 HydrophobicContact CD1-CD1 3.78Å; L1270-L1285 HydrophobicContact CG-CD1 4.34Å; L1270-F1300 HydrophobicContact CD1-CE1 4.46Å; L1270-F1300 HydrophobicContact CD1-CE2 4.04Å; L1270-F1300 HydrophobicContact CD1-CZ 3.75Å; L1270-F1300 HydrophobicContact CD2-CD2 4.18Å; L1270-F1300 HydrophobicContact CD2-CE1 4.36Å; L1270-F1300 HydrophobicContact CD2-CE2 3.99Å; L1270-F1300 HydrophobicContact CD2-CG 4.45Å; L1270-F1300 HydrophobicContact CD2-CZ 4.1Å
1271	K	86.9	Confident	71.4	Confident	71 Å²	71	56.9 Å²	56.9	31%	0.309	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114	174.9	-175.5	-170.8	-169.1	82.7	0	109.2	Q1072 L1273 C1280 E1282	Q1072-K1271 HydrophobicContact CB-CB 4.22Å; Q1072-K1271 PolarHBondContact N-O 3.29Å; Q1072-K1271 PolarHBondContact O-N 2.71Å; K1271-L1273 HydrophobicContact CD-CD2 3.97Å; K1271-L1273 HydrophobicContact CD-CG 4.33Å; K1271-L1273 HydrophobicContact CG-CD2 4.06Å; K1271-L1273 HydrophobicContact CG-CG 4.31Å; K1271-L1273 PolarHBondContact O-N 3.14Å; K1271-C1280 VanDerWaalsContact CG-SG 3.59Å; K1271-E1282 HydrophobicContact CB-CG 4.29Å; K1271-E1282 HydrophobicContact CG-CG 3.96Å; K1271-E1282 IonicContact NZ-OE1 2.66Å; K1271-E1282 PolarHBondContact NZ-OE1 2.86Å
1272	L	88.3	Confident	73.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	88.8	-174	-72.2	68.4	0	0	0	109.5	V1051 C1066 L1270 G1274 T1281 L1283	V1051-L1272 HydrophobicContact CG2-CD2 3.9Å; C1066-L1272 HydrophobicContact CB-CB 4.15Å; C1066-L1272 HydrophobicContact CB-CD2 3.91Å; C1066-L1272 HydrophobicContact CB-CG 4.04Å; L1270-L1272 HydrophobicContact CB-CD1 4.06Å; L1272-G1274 PolarHBondContact O-N 2.64Å; L1272-T1281 PolarHBondContact N-O 2.76Å; L1272-L1283 HydrophobicContact CD1-CD1 4.37Å; L1272-L1283 HydrophobicContact CD1-CG 4.48Å
1273	L	78.2	Confident	76.2	Confident	85 Å²	85	51.9 Å²	51.9	45%	0.445	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	28.3	-179.8	-65.3	-176.8	0	0	0	113.7	S1070 Q1072 K1271	S1070-L1273 WeakPolarHBondContact O-CB 3.21Å; S1070-L1273 PolarHBondContact O-N 3.42Å; Q1072-L1273 HydrophobicContact CG-CD1 3.99Å; K1271-L1273 HydrophobicContact CD-CD2 3.97Å; K1271-L1273 HydrophobicContact CD-CG 4.33Å; K1271-L1273 HydrophobicContact CG-CD2 4.06Å; K1271-L1273 HydrophobicContact CG-CG 4.31Å; K1271-L1273 PolarHBondContact O-N 3.14Å
1274	G	75	Confident	78.2	Confident	35 Å²	35	51.3 Å²	51.3	36%	0.361	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-170.7	28.7	-173.3	0	0	0	0	0	113.3	L1272	L1272-G1274 PolarHBondContact O-N 2.64Å
1275	S	78.7	Confident	79.7	Confident	11 Å²	11	42.7 Å²	42.7	8%	0.077	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-51	137.5	172.6	171.1	0	0	0	0	111.7	D1064 N1277 G1278 T1279	D1064-S1275 PolarHBondContact OD1-OG 3.35Å; D1064-S1275 WeakPolarHBondContact OD2-CB 3.47Å; D1064-S1275 PolarHBondContact OD2-OG 3.31Å; S1275-N1277 PolarHBondContact O-N 3.35Å; S1275-N1277 VanDerWaalsContact O-N 3.17Å; S1275-N1277 PolarHBondContact OG-N 3.19Å; S1275-G1278 PolarHBondContact O-N 3.26Å; S1275-T1279 WeakPolarHBondContact CB-O 3.42Å
1276	H	76.3	Confident	80.6	Confident	65 Å²	65	40 Å²	40	30%	0.301	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-35.6	168.2	169.1	-91.6	0	0	0	112.7	N999 K1001 D1064 Y1065 G1278	N999-H1276 PolarHBondContact O-CE1 2.59Å; K1001-H1276 VanDerWaalsContact CB-NE2 3.26Å; K1001-H1276 WeakPolarHBondContact CB-NE2 3.34Å; K1001-H1276 PolarHBondContact N-CE1 3.49Å; K1001-H1276 PolarHBondContact N-NE2 2.98Å; D1064-H1276 PolarHBondContact OD1-N 3.17Å; Y1065-H1276 HydrophobicContact CD1-CB 3.67Å; Y1065-H1276 HydrophobicContact CD2-CB 4.38Å; Y1065-H1276 HydrophobicContact CE1-CB 3.42Å; Y1065-H1276 VanDerWaalsContact CE1-CB 3.42Å; Y1065-H1276 AromaticContact CE1-CD2 3.52Å; Y1065-H1276 AromaticContact CE1-CG 3.41Å; Y1065-H1276 VanDerWaalsContact CE1-CG 3.41Å; Y1065-H1276 HydrophobicContact CE2-CB 4.16Å; Y1065-H1276 HydrophobicContact CG-CB 4.18Å; Y1065-H1276 AromaticContact CZ-CD2 3.51Å; Y1065-H1276 AromaticContact CZ-CG 3.77Å; Y1065-H1276 PolarHBondContact O-N 3.47Å; Y1065-H1276 PolarHBondContact OH-CD2 2.91Å; H1276-G1278 PolarHBondContact O-N 2.84Å
1277	N	69.9	Low	80.5	Confident	61 Å²	61	39.5 Å²	39.5	33%	0.326	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	1.9	-176.2	-56.8	-30.6	0	0	0	112.7	L1063 S1275 T1279	L1063-N1277 PolarHBondContact O-ND2 2.93Å; S1275-N1277 PolarHBondContact O-N 3.35Å; S1275-N1277 VanDerWaalsContact O-N 3.17Å; S1275-N1277 PolarHBondContact OG-N 3.19Å; N1277-T1279 PolarHBondContact O-N 3.13Å; N1277-T1279 VanDerWaalsContact O-N 3.16Å
1278	G	65.7	Low	80	Confident	75 Å²	75	45.2 Å²	45.2	77%	0.773	27%	0.268	S	S	*	.	S	Bend	trans	73.8	-3.4	178.4	0	0	0	0	0	114.9	S1275 H1276	S1275-G1278 PolarHBondContact O-N 3.26Å; H1276-G1278 PolarHBondContact O-N 2.84Å
1279	T	66.9	Low	79.8	Confident	86 Å²	86	49.1 Å²	49.1	53%	0.528	29%	0.289	S	S	.	.	S	Bend	trans	-99.4	140.2	180	50	0	0	0	0	111.1	S1275 N1277 T1281	S1275-T1279 WeakPolarHBondContact CB-O 3.42Å; N1277-T1279 PolarHBondContact O-N 3.13Å; N1277-T1279 VanDerWaalsContact O-N 3.16Å; T1279-T1281 VanDerWaalsContact C-N 3.35Å; T1279-T1281 PolarHBondContact O-N 3.04Å
1280	C	70	Confident	79.5	Confident	63 Å²	63	51.4 Å²	51.4	43%	0.426	30%	0.303	S	S	.	.			trans	-68.3	91.7	170.1	177.8	0	0	0	0	110.1	K1271 E1282	K1271-C1280 VanDerWaalsContact CG-SG 3.59Å; C1280-E1282 PolarHBondContact O-N 3.37Å
1281	T	78.7	Confident	79.3	Confident	32 Å²	32	58.7 Å²	58.7	20%	0.196	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	126.2	175.1	-51.3	0	0	0	0	109.1	D1064 L1272 T1279 L1283	D1064-T1281 PolarHBondContact OD2-OG1 2.92Å; L1272-T1281 PolarHBondContact N-O 2.76Å; T1279-T1281 VanDerWaalsContact C-N 3.35Å; T1279-T1281 PolarHBondContact O-N 3.04Å; T1281-L1283 HydrophobicContact CG2-CD2 4.05Å; T1281-L1283 HydrophobicContact CG2-CG 4.21Å
1282	E	83.1	Confident	79.2	Confident	124 Å²	124	57.4 Å²	57.4	58%	0.579	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.9	174	-75.3	179.4	-161.8	0	0	109.4	L1270 K1271 C1280	L1270-E1282 WeakPolarHBondContact O-CA 3.34Å; K1271-E1282 HydrophobicContact CB-CG 4.29Å; K1271-E1282 HydrophobicContact CG-CG 3.96Å; K1271-E1282 IonicContact NZ-OE1 2.66Å; K1271-E1282 PolarHBondContact NZ-OE1 2.86Å; C1280-E1282 PolarHBondContact O-N 3.37Å
1283	L	84.8	Confident	79.1	Confident	9 Å²	9	57.5 Å²	57.5	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.3	179.5	-58.4	177.2	0	0	0	109.1	F1040 V1051 H1269 L1270 L1272 T1281 L1285	F1040-L1283 HydrophobicContact CE2-CD2 4Å; F1040-L1283 HydrophobicContact CZ-CD2 4.02Å; V1051-L1283 HydrophobicContact CG1-CD1 3.89Å; V1051-L1283 HydrophobicContact CG2-CD1 3.79Å; H1269-L1283 CarbonylContact C-O 3.55Å; H1269-L1283 WeakPolarHBondContact CA-O 3.18Å; L1270-L1283 HydrophobicContact CB-CB 4.45Å; L1270-L1283 PolarHBondContact N-O 2.88Å; L1270-L1283 PolarHBondContact O-N 2.85Å; L1272-L1283 HydrophobicContact CD1-CD1 4.37Å; L1272-L1283 HydrophobicContact CD1-CG 4.48Å; T1281-L1283 HydrophobicContact CG2-CD2 4.05Å; T1281-L1283 HydrophobicContact CG2-CG 4.21Å; L1283-L1285 HydrophobicContact CB-CD1 4.16Å; L1283-L1285 HydrophobicContact CB-CD2 4.19Å; L1283-L1285 HydrophobicContact CB-CG 3.99Å
1284	T	85.8	Confident	79.5	Confident	23 Å²	23	56.3 Å²	56.3	14%	0.141	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.2	172.3	-58.6	0	0	0	0	108.4	E1018 C1019 T1021 I1267 H1269	E1018-T1284 CarbonylContact C-O 3.57Å; E1018-T1284 WeakPolarHBondContact CA-O 3.45Å; C1019-T1284 HydrophobicContact CB-CG2 4.01Å; C1019-T1284 PolarHBondContact N-O 3.5Å; T1021-T1284 HydrophobicContact CG2-CG2 4.29Å; I1267-T1284 HydrophobicContact CG2-CG2 3.51Å; H1269-T1284 WeakPolarHBondContact CE1-CG2 3.45Å; H1269-T1284 PolarHBondContact CE1-OG1 2.9Å; H1269-T1284 WeakPolarHBondContact ND1-CG2 3.45Å; H1269-T1284 PolarHBondContact ND1-OG1 2.9Å
1285	L	86.9	Confident	80.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	147.7	-163.1	-61.4	178.9	0	0	0	112.8	L1016 R1017 F1040 L1042 I1267 I1268 L1270 L1283	L1016-L1285 HydrophobicContact CB-CB 4.13Å; L1016-L1285 HydrophobicContact CB-CD1 4.17Å; L1016-L1285 HydrophobicContact CB-CD2 4.32Å; L1016-L1285 HydrophobicContact CB-CG 4.45Å; L1016-L1285 HydrophobicContact CD1-CB 4.19Å; L1016-L1285 HydrophobicContact CD1-CD1 3.81Å; R1017-L1285 CarbonylContact O-C 3.58Å; R1017-L1285 WeakPolarHBondContact O-CA 3.4Å; F1040-L1285 HydrophobicContact CD2-CD2 3.74Å; F1040-L1285 HydrophobicContact CE2-CD2 4.36Å; L1042-L1285 HydrophobicContact CD1-CD1 3.88Å; I1267-L1285 CarbonylContact C-O 3.57Å; I1267-L1285 WeakPolarHBondContact CA-O 3.39Å; I1268-L1285 PolarHBondContact N-O 2.81Å; I1268-L1285 WeakPolarHBondContact O-CB 3.44Å; I1268-L1285 PolarHBondContact O-N 3.22Å; L1270-L1285 HydrophobicContact CD1-CD1 3.78Å; L1270-L1285 HydrophobicContact CG-CD1 4.34Å; L1283-L1285 HydrophobicContact CB-CD1 4.16Å; L1283-L1285 HydrophobicContact CB-CD2 4.19Å; L1283-L1285 HydrophobicContact CB-CG 3.99Å
1286	S	85.5	Confident	80.8	Confident	6 Å²	6	56.4 Å²	56.4	4%	0.042	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	156.2	171.6	63.6	0	0	0	0	112.1	R1017 C1019	R1017-S1286 PolarHBondContact N-O 2.84Å; R1017-S1286 PolarHBondContact O-N 2.72Å; R1017-S1286 PolarHBondContact O-OG 2.96Å; C1019-S1286 VanDerWaalsContact SG-CB 3.58Å; C1019-S1286 PolarHBondContact SG-OG 3.44Å
1287	S	81.9	Confident	81.4	Confident	19 Å²	19	53.3 Å²	53.3	13%	0.133	31%	0.306	C	S	.	.			trans	-113.9	157.4	158.6	-174.4	0	0	0	0	110	D1289 E1292	S1287-D1289 VanDerWaalsContact C-N 3.31Å; S1287-D1289 PolarHBondContact OG-N 3.37Å; S1287-D1289 VanDerWaalsContact OG-N 3.08Å; S1287-E1292 WeakPolarHBondContact CB-OE2 3.38Å; S1287-E1292 PolarHBondContact OG-OE2 3.5Å
1288	N	74.6	Confident	82.3	Confident	129 Å²	129	56.7 Å²	56.7	69%	0.69	32%	0.317	S	S	*	.	S	Bend	trans	-75.3	-22.8	165.3	-93.7	-5.6	0	0	0	111.8	R1017	R1017-N1288 PolarHBondContact NH1-ND2 3.22Å; R1017-N1288 PolarHBondContact NH1-OD1 3.09Å; R1017-N1288 PolarHBondContact NH2-OD1 3.24Å
1289	D	81.9	Confident	83.4	Confident	83 Å²	83	53.7 Å²	53.7	44%	0.444	29%	0.286	S	S	.	.			trans	-99.9	119	-177.5	-176.1	3.5	0	0	0	110.8	S1287 Q1291 E1292 F1293	S1287-D1289 VanDerWaalsContact C-N 3.31Å; S1287-D1289 PolarHBondContact OG-N 3.37Å; S1287-D1289 VanDerWaalsContact OG-N 3.08Å; D1289-Q1291 PolarHBondContact O-N 2.78Å; D1289-Q1291 WeakPolarHBondContact OD1-CB 3.45Å; D1289-Q1291 PolarHBondContact OD1-N 3.35Å; D1289-E1292 HydrophobicContact CB-CB 3.96Å; D1289-E1292 PolarHBondContact O-N 2.93Å; D1289-F1293 WeakPolarHBondContact O-CB 3.38Å; D1289-F1293 PolarHBondContact O-N 3.2Å
1290	N	81.6	Confident	84.5	Confident	101 Å²	101	50.7 Å²	50.7	54%	0.54	27%	0.265	S	S	.	.	H	α-helix	trans	-64.6	-27.8	175.3	-76.7	-33.4	0	0	0	112.5	N1266 E1294	N1266-N1290 PolarHBondContact ND2-OD1 2.88Å; N1290-E1294 WeakPolarHBondContact O-CB 3.34Å; N1290-E1294 WeakPolarHBondContact O-CG 3.36Å; N1290-E1294 PolarHBondContact O-N 3.29Å
1291	Q	84.5	Confident	85.2	Confident	154 Å²	154	52.4 Å²	52.4	72%	0.72	28%	0.278	S	S	*	.	H	α-helix	trans	-72.5	-39.2	175.2	-174.3	174.8	-6.3	0	0	111.3	D1289 S1295	D1289-Q1291 PolarHBondContact O-N 2.78Å; D1289-Q1291 WeakPolarHBondContact OD1-CB 3.45Å; D1289-Q1291 PolarHBondContact OD1-N 3.35Å; Q1291-S1295 WeakPolarHBondContact O-CB 3.5Å; Q1291-S1295 PolarHBondContact O-N 2.99Å
1292	E	85.5	Confident	85.2	Confident	44 Å²	44	55.1 Å²	55.1	21%	0.206	29%	0.294	C	S	.	.	H	α-helix	trans	-67.1	-42.6	172.8	-167.6	-170.9	-158.4	0	0	111.4	E1015 S1287 D1289 S1295 W1296	E1015-E1292 PolarHBondContact N-OE1 3.19Å; S1287-E1292 WeakPolarHBondContact CB-OE2 3.38Å; S1287-E1292 PolarHBondContact OG-OE2 3.5Å; D1289-E1292 HydrophobicContact CB-CB 3.96Å; D1289-E1292 PolarHBondContact O-N 2.93Å; E1292-S1295 CarbonylContact O-C 3.59Å; E1292-S1295 WeakPolarHBondContact O-CB 3.12Å; E1292-S1295 PolarHBondContact O-N 3.02Å; E1292-W1296 PolarHBondContact O-N 3.38Å
1293	F	86.3	Confident	85.3	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.009	28%	0.28	C	S	.	.	H	α-helix	trans	-57	-56.3	175	174.7	-92	0	0	0	111.8	V1075 N1266 I1268 D1289 S1295 W1296 C1297	V1075-F1293 HydrophobicContact CG1-CZ 3.89Å; N1266-F1293 HydrophobicContact CB-CD1 4.02Å; N1266-F1293 HydrophobicContact CB-CD2 3.86Å; N1266-F1293 HydrophobicContact CB-CE1 3.71Å; N1266-F1293 HydrophobicContact CB-CE2 3.52Å; N1266-F1293 HydrophobicContact CB-CG 4.11Å; N1266-F1293 HydrophobicContact CB-CZ 3.46Å; N1266-F1293 VanDerWaalsContact CB-CZ 3.46Å; I1268-F1293 HydrophobicContact CD1-CD2 4.11Å; I1268-F1293 HydrophobicContact CD1-CE2 4.08Å; I1268-F1293 HydrophobicContact CG1-CD2 3.88Å; I1268-F1293 HydrophobicContact CG1-CE2 3.42Å; I1268-F1293 VanDerWaalsContact CG1-CE2 3.42Å; I1268-F1293 HydrophobicContact CG1-CZ 4.22Å; D1289-F1293 WeakPolarHBondContact O-CB 3.38Å; D1289-F1293 PolarHBondContact O-N 3.2Å; F1293-S1295 PolarHBondContact O-N 2.66Å; F1293-W1296 PolarHBondContact O-N 3.24Å; F1293-C1297 VanDerWaalsContact CE1-SG 3.58Å; F1293-C1297 PolarHBondContact O-N 3.33Å; F1293-C1297 PolarHBondContact O-SG 2.79Å
1294	E	86.4	Confident	85.4	Confident	60 Å²	60	53.9 Å²	53.9	28%	0.28	29%	0.292	S	S	.	.	H	α-helix	trans	-61.8	-28.2	176.6	-74.2	-73.6	164.7	0	0	112.3	R1077 N1290 K1298	R1077-E1294 IonicContact CZ-OE1 3.71Å; R1077-E1294 VanDerWaalsContact CZ-OE1 3.24Å; R1077-E1294 IonicContact NH1-OE1 2.75Å; R1077-E1294 PolarHBondContact NH1-OE1 2.59Å; R1077-E1294 IonicContact NH2-OE1 3.64Å; R1077-E1294 PolarHBondContact NH2-OE1 3.08Å; R1077-E1294 IonicContact NH2-OE2 2.75Å; N1290-E1294 WeakPolarHBondContact O-CB 3.34Å; N1290-E1294 WeakPolarHBondContact O-CG 3.36Å; N1290-E1294 PolarHBondContact O-N 3.29Å; E1294-K1298 WeakPolarHBondContact O-CB 3.31Å; E1294-K1298 WeakPolarHBondContact O-CD 3.38Å; E1294-K1298 VanDerWaalsContact O-CG 3.24Å; E1294-K1298 WeakPolarHBondContact O-CG 3.44Å; E1294-K1298 PolarHBondContact O-N 2.85Å; E1294-K1298 VanDerWaalsContact O-N 3.16Å
1295	S	89.4	Confident	85.3	Confident	48 Å²	48	55.6 Å²	55.6	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-70.4	-35.2	172.3	176.1	0	0	0	0	112.7	K1012 Q1291 E1292 F1293 A1299	K1012-S1295 WeakPolarHBondContact CE-OG 3.48Å; K1012-S1295 PolarHBondContact NZ-OG 3.36Å; Q1291-S1295 WeakPolarHBondContact O-CB 3.5Å; Q1291-S1295 PolarHBondContact O-N 2.99Å; E1292-S1295 CarbonylContact O-C 3.59Å; E1292-S1295 WeakPolarHBondContact O-CB 3.12Å; E1292-S1295 PolarHBondContact O-N 3.02Å; F1293-S1295 PolarHBondContact O-N 2.66Å; S1295-A1299 WeakPolarHBondContact O-CB 3.39Å; S1295-A1299 PolarHBondContact O-N 3.23Å
1296	W	91.6	Very high	85.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-72.1	-44	173	-84.7	114.9	0	0	0	112.1	K1012 L1016 L1042 L1044 I1268 E1292 F1293 K1298 A1299 F1300	K1012-W1296 HydrophobicContact CB-CH2 4.36Å; K1012-W1296 HydrophobicContact CB-CZ3 4.14Å; K1012-W1296 HydrophobicContact CD-CD2 3.73Å; K1012-W1296 HydrophobicContact CD-CE3 3.7Å; K1012-W1296 HydrophobicContact CD-CG 4.2Å; K1012-W1296 HydrophobicContact CD-CH2 4.34Å; K1012-W1296 HydrophobicContact CD-CZ2 4.39Å; K1012-W1296 HydrophobicContact CD-CZ3 4.02Å; K1012-W1296 VanDerWaalsContact CE-CD1 3.47Å; K1012-W1296 HydrophobicContact CG-CD2 4.37Å; K1012-W1296 HydrophobicContact CG-CE3 4.17Å; K1012-W1296 HydrophobicContact CG-CH2 3.94Å; K1012-W1296 HydrophobicContact CG-CZ2 4.17Å; K1012-W1296 HydrophobicContact CG-CZ3 3.95Å; L1016-W1296 HydrophobicContact CD1-CD2 4.15Å; L1016-W1296 HydrophobicContact CD1-CG 4.08Å; L1042-W1296 HydrophobicContact CB-CH2 3.51Å; L1042-W1296 HydrophobicContact CB-CZ2 3.81Å; L1042-W1296 HydrophobicContact CB-CZ3 4.27Å; L1044-W1296 HydrophobicContact CB-CZ3 4.11Å; I1268-W1296 HydrophobicContact CD1-CB 3.66Å; E1292-W1296 PolarHBondContact O-N 3.38Å; F1293-W1296 PolarHBondContact O-N 3.24Å; W1296-K1298 VanDerWaalsContact C-N 3.34Å; W1296-K1298 PolarHBondContact O-N 3.41Å; W1296-A1299 PolarHBondContact O-N 3.19Å; W1296-A1299 VanDerWaalsContact O-N 3.09Å; W1296-F1300 HydrophobicContact CB-CD2 4.49Å; W1296-F1300 HydrophobicContact CB-CE2 4.44Å; W1296-F1300 HydrophobicContact CD2-CE2 4.22Å; W1296-F1300 HydrophobicContact CE3-CD2 4.17Å; W1296-F1300 AromaticContact CE3-CE2 3.44Å; W1296-F1300 HydrophobicContact CE3-CE2 3.44Å; W1296-F1300 VanDerWaalsContact CE3-CE2 3.44Å; W1296-F1300 AromaticContact CE3-CZ 3.8Å; W1296-F1300 HydrophobicContact CE3-CZ 3.8Å; W1296-F1300 HydrophobicContact CZ3-CE2 4.07Å; W1296-F1300 AromaticContact CZ3-CZ 3.93Å; W1296-F1300 HydrophobicContact CZ3-CZ 3.93Å; W1296-F1300 WeakPolarHBondContact O-CD2 3.43Å; W1296-F1300 PolarHBondContact O-N 3.32Å
1297	C	88.7	Confident	85.2	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.007	34%	0.335	C	S	.	.	H	α-helix	trans	-53.7	-51	175.1	-61	0	0	0	0	110.9	F1293 A1299 F1300 S1301 V1302	F1293-C1297 VanDerWaalsContact CE1-SG 3.58Å; F1293-C1297 PolarHBondContact O-N 3.33Å; F1293-C1297 PolarHBondContact O-SG 2.79Å; C1297-A1299 VanDerWaalsContact C-N 3.34Å; C1297-A1299 PolarHBondContact O-N 3.26Å; C1297-F1300 CarbonylContact O-C 3.55Å; C1297-F1300 PolarHBondContact O-N 2.95Å; C1297-F1300 VanDerWaalsContact O-N 3.17Å; C1297-S1301 PolarHBondContact O-N 3.14Å; C1297-V1302 CarbonylContact C-O 3.55Å; C1297-V1302 VanDerWaalsContact CB-O 3.25Å; C1297-V1302 WeakPolarHBondContact CB-O 3.48Å; C1297-V1302 PolarHBondContact O-N 2.93Å
1298	K	89.4	Confident	85.4	Confident	131 Å²	131	65.1 Å²	65.1	57%	0.57	35%	0.349	S	S	*	.	H	α-helix	trans	-58.1	-39	175.1	-71.2	167.2	-172	173.8	0	114	E1294 W1296 S1301	E1294-K1298 WeakPolarHBondContact O-CB 3.31Å; E1294-K1298 WeakPolarHBondContact O-CD 3.38Å; E1294-K1298 VanDerWaalsContact O-CG 3.24Å; E1294-K1298 WeakPolarHBondContact O-CG 3.44Å; E1294-K1298 PolarHBondContact O-N 2.85Å; E1294-K1298 VanDerWaalsContact O-N 3.16Å; W1296-K1298 VanDerWaalsContact C-N 3.34Å; W1296-K1298 PolarHBondContact O-N 3.41Å; K1298-S1301 PolarHBondContact O-N 3.18Å; K1298-S1301 VanDerWaalsContact O-N 3.14Å
1299	A	88.9	Confident	86.2	Confident	13 Å²	13	60.5 Å²	60.5	11%	0.107	33%	0.325	C	S	.	.	H	α-helix	trans	-70.8	-32.2	179.4	0	0	0	0	0	113.1	I1011 K1012 L1044 R1068 S1295 W1296 C1297 S1301	I1011-A1299 HydrophobicContact CG2-CB 4.31Å; K1012-A1299 HydrophobicContact CB-CB 4.06Å; K1012-A1299 HydrophobicContact CD-CB 3.81Å; L1044-A1299 HydrophobicContact CD2-CB 3.97Å; R1068-A1299 PolarHBondContact NH2-O 3.19Å; S1295-A1299 WeakPolarHBondContact O-CB 3.39Å; S1295-A1299 PolarHBondContact O-N 3.23Å; W1296-A1299 PolarHBondContact O-N 3.19Å; W1296-A1299 VanDerWaalsContact O-N 3.09Å; C1297-A1299 VanDerWaalsContact C-N 3.34Å; C1297-A1299 PolarHBondContact O-N 3.26Å; A1299-S1301 VanDerWaalsContact C-N 3.33Å
1300	F	88.5	Confident	86.5	Confident	23 Å²	23	58.8 Å²	58.8	10%	0.101	32%	0.315	C	S	.	.	H	α-helix	trans	-84.4	-5.4	169.1	-66.3	-57.4	0	0	0	113.7	L1042 L1044 L1049 V1071 P1073 L1270 W1296 C1297 V1302	L1042-F1300 HydrophobicContact CD1-CZ 4.23Å; L1044-F1300 HydrophobicContact CD1-CE1 4.27Å; L1044-F1300 HydrophobicContact CD2-CD1 4.17Å; L1044-F1300 HydrophobicContact CD2-CE1 4.04Å; L1049-F1300 HydrophobicContact CD1-CE1 4.39Å; L1049-F1300 HydrophobicContact CD1-CZ 4.38Å; L1049-F1300 HydrophobicContact CD2-CE1 4.19Å; L1049-F1300 HydrophobicContact CD2-CZ 4.38Å; V1071-F1300 HydrophobicContact CG1-CE1 4.41Å; P1073-F1300 HydrophobicContact CB-CB 4.07Å; P1073-F1300 HydrophobicContact CB-CG 4.46Å; P1073-F1300 HydrophobicContact CG-CB 4.13Å; L1270-F1300 HydrophobicContact CD1-CE1 4.46Å; L1270-F1300 HydrophobicContact CD1-CE2 4.04Å; L1270-F1300 HydrophobicContact CD1-CZ 3.75Å; L1270-F1300 HydrophobicContact CD2-CD2 4.18Å; L1270-F1300 HydrophobicContact CD2-CE1 4.36Å; L1270-F1300 HydrophobicContact CD2-CE2 3.99Å; L1270-F1300 HydrophobicContact CD2-CG 4.45Å; L1270-F1300 HydrophobicContact CD2-CZ 4.1Å; W1296-F1300 HydrophobicContact CB-CD2 4.49Å; W1296-F1300 HydrophobicContact CB-CE2 4.44Å; W1296-F1300 HydrophobicContact CD2-CE2 4.22Å; W1296-F1300 HydrophobicContact CE3-CD2 4.17Å; W1296-F1300 AromaticContact CE3-CE2 3.44Å; W1296-F1300 HydrophobicContact CE3-CE2 3.44Å; W1296-F1300 VanDerWaalsContact CE3-CE2 3.44Å; W1296-F1300 AromaticContact CE3-CZ 3.8Å; W1296-F1300 HydrophobicContact CE3-CZ 3.8Å; W1296-F1300 HydrophobicContact CZ3-CE2 4.07Å; W1296-F1300 AromaticContact CZ3-CZ 3.93Å; W1296-F1300 HydrophobicContact CZ3-CZ 3.93Å; W1296-F1300 WeakPolarHBondContact O-CD2 3.43Å; W1296-F1300 PolarHBondContact O-N 3.32Å; C1297-F1300 CarbonylContact O-C 3.55Å; C1297-F1300 PolarHBondContact O-N 2.95Å; C1297-F1300 VanDerWaalsContact O-N 3.17Å; F1300-V1302 HydrophobicContact CB-CG2 4.47Å
1301	S	85.4	Confident	87	Confident	99 Å²	99	55.3 Å²	55.3	69%	0.692	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	48.1	-178.9	-52.9	0	0	0	0	114.2	C1297 K1298 A1299	C1297-S1301 PolarHBondContact O-N 3.14Å; K1298-S1301 PolarHBondContact O-N 3.18Å; K1298-S1301 VanDerWaalsContact O-N 3.14Å; A1299-S1301 VanDerWaalsContact C-N 3.33Å
1302	V	79.1	Confident	87.2	Confident	88 Å²	88	46.3 Å²	46.3	53%	0.533	26%	0.258	S	S	.	.			trans	-125.5	0	173.7	-168.1	0	0	0	0	110.5	P1073 V1075 C1297 F1300	P1073-V1302 HydrophobicContact CB-CG2 3.79Å; P1073-V1302 HydrophobicContact CG-CG2 3.42Å; P1073-V1302 VanDerWaalsContact CG-CG2 3.42Å; V1075-V1302 HydrophobicContact CB-CG1 3.94Å; V1075-V1302 HydrophobicContact CG2-CB 4.07Å; V1075-V1302 HydrophobicContact CG2-CG1 3.61Å; C1297-V1302 CarbonylContact C-O 3.55Å; C1297-V1302 VanDerWaalsContact CB-O 3.25Å; C1297-V1302 WeakPolarHBondContact CB-O 3.48Å; C1297-V1302 PolarHBondContact O-N 2.93Å; F1300-V1302 HydrophobicContact CB-CG2 4.47Å

Retrieved 1,302 of 1,302 residues in 245.9 ms (Link to these results)

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