A0A3Q0KIR7_SCHMA Loading...

Putative forkhead protein/ forkhead protein domain

AlphaFold DB , UniProt , Accession A0A3Q0KIR7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,011 aa.

						>A0A3Q0KIR7_SCHMA|A0A3Q0KIR7
MDKVHSHALYSYSDINKLSPLDVDMTVINNSDSDKSGVFLDTWSVKHSSDLVSTPNDLVSLAWLQKRDILQIAPLDGEEDGSDSVSSPVTGRPEDEDNFETNPILHMDSLEPVVNRSPSLVPVSQFSVLDRCVRRPASVSGDQLSHSEQSRFSTNPTVALGTHGLTKPNYSYTHLIFMAIESTPQKCMTVNQIYNWCESNFPFYKHAGVGWKNSLRHNLSINKSFKRLPRDSRGPGRGAFWTVEPRERASLLDAIKRNPWNFASVTAMGCHLSDGSHDVTSASAYPVRRFGLAHSAPGHLLRAEGLGRDKLESTPQIRLLYTSDGKVLATYDASFVDPSKFEYDLTAGKENAAVLSSDVPLSDIRYWTLPSGDTTSTDGATAKVEWPAEEEEKYLDTLRLLNEGEEKVTKSQSTITEPSDENSMSKAKSEALESFIGTHILDDAKLVTKQKRKSRLLPTRIRKCNECKENTSGCESCLAKRYEVLNSNYVRSALKEYDLDIGNMLDCDQEPGPAGGPLVKTITTRISKSASPVAEENESDVDSCDEKPANPETLIYSSDEVYVTPPPYIDHEYSHCQAQLRRPEENQLVNKFNDNYYTSRLSELMNLYPLLKAFVDSIVLETDANYETDEFDDGFSSSENDIYSEEDFDGENRELKESGIQDLCDCEYTFCRRSSRRRHPVSPYYEARKTRSFRIPSRGVKQRKGTRSMKLSSLNSCPTRRSKRVIKAPRRPYDDFERSQYYNYELDDESRILIFDGREGNFGSSARSNMMERYSRHSPNSQSDIDSESAEKSMDIENSRYRYQNHYRSLKRAHQPISGTQPHLDNIVGRSSPDLEDYDFSSDQEESYLRAASTLQVRKNGTTFSSSHPLSKRSQTKKQETHLDVADGWNSMKCPVGRKIDESSINGVKLGESHNGFSDDERVIQRELSDKIQTYKETVEEPVLKRNKQTAVDAARLLLGISQIQNLRQKSECVDTSVASSTLDFKRTSISNTDNATSESIILQEVPATLI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	32.4	Very low	212 Å²	212	156 Å²	156	100%	1.044	81%	0.814	S	S	*	*				0	74.8	0	-109.7	-66.8	-160.9	0	0	107.4	K3	M1-K3 PolarHBondContact O-N 3.36Å
2	D	30.3	Very low	31.8	Very low	162 Å²	162	163.3 Å²	163.3	87%	0.866	83%	0.826	S	S	*	*			trans	-106.9	69.4	-139.4	-45.7	-64.9	0	0	0	112
3	K	34	Very low	31.4	Very low	194 Å²	194	157.5 Å²	157.5	84%	0.843	81%	0.81	S	S	*	*			trans	-142.9	136.6	166.2	-58.6	-178	-177.2	179.1	0	105.1	M1	M1-K3 PolarHBondContact O-N 3.36Å
4	V	36.2	Very low	31.3	Very low	134 Å²	134	157.3 Å²	157.3	81%	0.812	81%	0.811	S	S	*	*			cis	-131.9	147.5	35.9	170.8	0	0	0	0	111.4
5	H	34.5	Very low	31.3	Very low	163 Å²	163	156.9 Å²	156.9	76%	0.755	81%	0.809	S	S	*	*			trans	-74.3	143	176	-116.7	-85.3	0	0	0	112.7	H7	H5-H7 PolarHBondContact O-N 3.31Å
6	S	30.4	Very low	31.2	Very low	104 Å²	104	157.7 Å²	157.7	73%	0.727	82%	0.815	S	S	*	*			trans	-7.6	113.9	151.7	54.2	0	0	0	0	116.6
7	H	33.6	Very low	31.3	Very low	176 Å²	176	159.7 Å²	159.7	82%	0.815	82%	0.816	S	S	*	*			trans	-120.4	135.6	168.6	-108.8	-96.9	0	0	0	111.4	H5	H5-H7 PolarHBondContact O-N 3.31Å
8	A	31.8	Very low	31.1	Very low	70 Å²	70	159.9 Å²	159.9	58%	0.579	82%	0.818	S	S	*	*			trans	49.2	91.9	163.6	0	0	0	0	0	118.2	Y10	A8-Y10 HydrophobicContact CB-CD2 4.03Å; A8-Y10 HydrophobicContact CB-CE2 3.97Å; A8-Y10 PolarHBondContact O-N 3.35Å
9	L	29	Very low	31.2	Very low	184 Å²	184	156.8 Å²	156.8	96%	0.963	81%	0.813	S	S	*	*			trans	-63.2	110.1	145.2	-71.9	169.2	0	0	0	108.2	S11	L9-S11 PolarHBondContact O-N 2.6Å
10	Y	30.2	Very low	31.3	Very low	217 Å²	217	155.4 Å²	155.4	85%	0.851	81%	0.813	S	S	*	*			trans	-77.2	117.1	172.1	-96	-93.7	0	0	0	110.3	A8	A8-Y10 HydrophobicContact CB-CD2 4.03Å; A8-Y10 HydrophobicContact CB-CE2 3.97Å; A8-Y10 PolarHBondContact O-N 3.35Å
11	S	29.5	Very low	31.3	Very low	100 Å²	100	155.5 Å²	155.5	70%	0.699	81%	0.814	S	S	*	*			trans	-70.3	135.4	176.7	52.1	0	0	0	0	111.7	L9 S13	L9-S11 PolarHBondContact O-N 2.6Å; S11-S13 PolarHBondContact O-N 3.23Å; S11-S13 VanDerWaalsContact O-N 3.15Å
12	Y	25.2	Very low	31	Very low	243 Å²	243	153.1 Å²	153.1	95%	0.953	81%	0.805	S	S	*	*			trans	-89.6	78	-166.9	-157.4	-92.1	0	0	0	112.7
13	S	27.2	Very low	31.1	Very low	89 Å²	89	150.7 Å²	150.7	62%	0.622	80%	0.796	S	S	*	*			trans	-152.5	158.6	175.6	48.8	0	0	0	0	112.4	S11	S11-S13 PolarHBondContact O-N 3.23Å; S11-S13 VanDerWaalsContact O-N 3.15Å
14	D	29.4	Very low	30.9	Very low	154 Å²	154	149 Å²	149	82%	0.824	80%	0.796	S	S	*	*			trans	75.5	51	169.7	-59.3	-15.7	0	0	0	120.4
15	I	31.7	Very low	30.4	Very low	152 Å²	152	150.5 Å²	150.5	78%	0.779	80%	0.797	S	S	*	*			trans	-128.6	69.5	145.5	-47	-179.5	0	0	0	110.9
16	N	29.6	Very low	30.3	Very low	169 Å²	169	148.7 Å²	148.7	90%	0.904	80%	0.797	S	S	*	*			trans	-108.3	47	166.5	-109.7	-14.2	0	0	0	110.4
17	K	32.4	Very low	30.3	Very low	192 Å²	192	149.5 Å²	149.5	84%	0.835	80%	0.797	S	S	*	*			trans	-145.3	70.2	-178.3	-69.5	-168.5	-177.4	179	0	112.7
18	L	28.7	Very low	30.1	Very low	163 Å²	163	147.6 Å²	147.6	85%	0.853	79%	0.792	S	S	*	*			trans	-132	90.1	161.1	-73.1	176	0	0	0	108.5
19	S	33.1	Very low	29.9	Very low	102 Å²	102	151 Å²	151	71%	0.713	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.7	144.4	166.4	47.6	0	0	0	0	109.7
20	P	33.6	Very low	29.9	Very low	127 Å²	127	149.4 Å²	149.4	83%	0.825	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-56.9	145.7	172.4	-22.4	33.8	0	0	0	111.5
21	L	30.6	Very low	29.7	Very low	159 Å²	159	144.1 Å²	144.1	83%	0.832	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-88.7	119.4	172	-70.4	168	0	0	0	108.9
22	D	29.9	Very low	29.7	Very low	161 Å²	161	147 Å²	147	86%	0.861	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.1	133.1	162.8	-78.9	-46.6	0	0	0	109.5
23	V	33.1	Very low	30	Very low	112 Å²	112	140.1 Å²	140.1	68%	0.679	78%	0.782	S	S	*	*			trans	-132.4	88	172.6	-177	0	0	0	0	107.7	M25	V23-M25 HydrophobicContact CG1-CG 4.4Å; V23-M25 PolarHBondContact O-N 3.01Å; V23-M25 VanDerWaalsContact O-N 3.08Å
24	D	30	Very low	30	Very low	157 Å²	157	143.6 Å²	143.6	84%	0.84	79%	0.794	S	S	*	*			trans	-60.3	108.1	171.6	-81	-48.1	0	0	0	110.2
25	M	25.6	Very low	30.1	Very low	167 Å²	167	145.8 Å²	145.8	82%	0.823	80%	0.796	S	S	*	*			trans	-103.2	105.5	164.5	-75.1	-165.6	-71.8	0	0	109.3	V23 V27	V23-M25 HydrophobicContact CG1-CG 4.4Å; V23-M25 PolarHBondContact O-N 3.01Å; V23-M25 VanDerWaalsContact O-N 3.08Å; M25-V27 PolarHBondContact O-N 3.19Å
26	T	32.3	Very low	29.8	Very low	124 Å²	124	144.6 Å²	144.6	76%	0.761	80%	0.802	S	S	*	*			trans	-68.2	126	-175.9	42.1	0	0	0	0	112	I28	T26-I28 PolarHBondContact O-N 3.08Å
27	V	28.8	Very low	29.7	Very low	121 Å²	121	140 Å²	140	73%	0.733	79%	0.794	S	S	*	*			trans	-74.4	112.2	176.3	179.7	0	0	0	0	109.6	M25 N29	M25-V27 PolarHBondContact O-N 3.19Å; V27-N29 PolarHBondContact O-N 3.4Å
28	I	30.9	Very low	29.4	Very low	137 Å²	137	138 Å²	138	70%	0.703	80%	0.798	S	S	*	*			trans	-84.2	105.1	173	-60.3	178.4	0	0	0	108.8	T26 N30	T26-I28 PolarHBondContact O-N 3.08Å; I28-N30 PolarHBondContact O-N 2.9Å; I28-N30 VanDerWaalsContact O-N 3.12Å
29	N	26.8	Very low	29.3	Very low	140 Å²	140	139.9 Å²	139.9	75%	0.749	80%	0.8	S	S	*	*			trans	-76.2	92.9	177	-71.6	-32.3	0	0	0	111.2	V27 S31	V27-N29 PolarHBondContact O-N 3.4Å; N29-S31 PolarHBondContact O-N 2.52Å
30	N	29.6	Very low	29	Very low	152 Å²	152	141.7 Å²	141.7	81%	0.813	80%	0.801	S	S	*	*			trans	-89	90.5	166.9	-75.1	-12.2	0	0	0	110.2	I28	I28-N30 PolarHBondContact O-N 2.9Å; I28-N30 VanDerWaalsContact O-N 3.12Å
31	S	26.4	Very low	28.4	Very low	106 Å²	106	143.4 Å²	143.4	74%	0.741	80%	0.803	S	S	*	*			trans	-85.8	122.2	164.5	54.2	0	0	0	0	110	N29	N29-S31 PolarHBondContact O-N 2.52Å
32	D	29.2	Very low	28.2	Very low	160 Å²	160	141.8 Å²	141.8	86%	0.856	80%	0.799	S	S	*	*			trans	-162.3	141.9	153.9	-125	-27	0	0	0	116.8
33	S	31.9	Very low	27.8	Very low	98 Å²	98	145.9 Å²	145.9	69%	0.685	80%	0.803	S	S	*	*			trans	57.4	114.4	160.2	68.7	0	0	0	0	121.5
34	D	25.5	Very low	27.4	Very low	162 Å²	162	146 Å²	146	87%	0.866	81%	0.808	S	S	*	*			trans	-65.6	141.8	159.4	-51.8	-94.3	0	0	0	112.5
35	K	32.6	Very low	27.2	Very low	200 Å²	200	144.2 Å²	144.2	87%	0.87	80%	0.803	S	S	*	*			trans	-138.6	120.4	152.9	-72.3	-167.1	178.5	173.6	0	111.9
36	S	25.6	Very low	27.4	Very low	128 Å²	128	145.6 Å²	145.6	90%	0.895	81%	0.805	S	S	*	*			trans	-67.1	136.6	172.5	52.8	0	0	0	0	111.9
37	G	27.8	Very low	27	Very low	73 Å²	73	148.4 Å²	148.4	75%	0.753	81%	0.809	S	S	*	*			trans	-163.6	103.3	172.7	0	0	0	0	0	111
38	V	25	Very low	26.9	Very low	150 Å²	150	147.8 Å²	147.8	91%	0.909	81%	0.81	S	S	*	*			trans	-70	129.4	174.3	177.6	0	0	0	0	108.8
39	F	26.6	Very low	26.8	Very low	202 Å²	202	146 Å²	146	89%	0.886	81%	0.809	S	S	*	*			trans	-134.1	153.9	163.8	-143.2	-97.5	0	0	0	111.2
40	L	26.4	Very low	27.1	Very low	140 Å²	140	146.4 Å²	146.4	73%	0.733	81%	0.812	S	S	*	*			trans	-97.8	139.6	-161.2	-171.2	68.7	0	0	0	111.7	T42	L40-T42 PolarHBondContact O-N 3.15Å
41	D	21.7	Very low	27.3	Very low	163 Å²	163	146.5 Å²	146.5	87%	0.872	81%	0.811	S	S	*	*			trans	-60.6	127.4	168.5	-84.4	-51.2	0	0	0	110.8
42	T	26.5	Very low	27.6	Very low	124 Å²	124	148 Å²	148	76%	0.761	82%	0.815	S	S	*	*			trans	-150.7	139.6	167.3	-63.7	0	0	0	0	108.5	L40	L40-T42 PolarHBondContact O-N 3.15Å
43	W	20.8	Very low	27.7	Very low	248 Å²	248	145.8 Å²	145.8	94%	0.939	81%	0.813	S	S	*	*			trans	-59.1	142.9	-164.6	-62.6	-41	0	0	0	114.9
44	S	26.3	Very low	28	Very low	113 Å²	113	146.1 Å²	146.1	79%	0.79	81%	0.811	S	S	*	*			trans	-135.4	110	154.3	-163.2	0	0	0	0	109.3	K46	S44-K46 PolarHBondContact O-N 3.11Å
45	V	25.2	Very low	28.4	Very low	121 Å²	121	144.3 Å²	144.3	73%	0.733	81%	0.808	S	S	*	*			trans	-78.8	111.7	-179.1	175.4	0	0	0	0	108.8
46	K	29.3	Very low	28.8	Very low	195 Å²	195	140.9 Å²	140.9	85%	0.848	80%	0.799	S	S	*	*			trans	-82.5	119.8	168.9	-78	-174.5	174.4	180	0	109.8	S44 S48	S44-K46 PolarHBondContact O-N 3.11Å; K46-S48 PolarHBondContact O-N 3.22Å
47	H	24.8	Very low	29.7	Very low	184 Å²	184	139.6 Å²	139.6	85%	0.852	78%	0.782	S	S	*	*			trans	-63.2	126	169.7	-70.4	-109.6	0	0	0	109.7
48	S	25.8	Very low	30	Very low	108 Å²	108	144 Å²	144	76%	0.755	79%	0.788	S	S	*	*			trans	-110.1	117.4	156.8	-173.4	0	0	0	0	106.5	K46 D50	K46-S48 PolarHBondContact O-N 3.22Å; S48-D50 PolarHBondContact O-N 2.91Å
49	S	30	Very low	31.6	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	78%	0.782	S	S	*	*			trans	-86.2	105.8	-179.9	52.5	0	0	0	0	109.7	L51	S49-L51 PolarHBondContact O-N 2.58Å
50	D	31.2	Very low	32.7	Very low	150 Å²	150	135.9 Å²	135.9	80%	0.802	76%	0.757	S	S	*	*			trans	-64	105.1	171.6	-68.7	-44.5	0	0	0	109.6	S48 V52	S48-D50 PolarHBondContact O-N 2.91Å; D50-V52 PolarHBondContact O-N 3.14Å
51	L	34.1	Very low	33.7	Very low	153 Å²	153	134.8 Å²	134.8	80%	0.801	75%	0.751	S	S	*	*			trans	-73.1	114.2	177.2	-72.1	173.5	0	0	0	109.5	S49 S53	S49-L51 PolarHBondContact O-N 2.58Å; L51-S53 PolarHBondContact O-N 2.99Å; L51-S53 VanDerWaalsContact O-N 3.15Å
52	V	32.8	Very low	35.6	Very low	137 Å²	137	129.3 Å²	129.3	83%	0.83	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-58.8	116.3	-179.7	178	0	0	0	0	110	D50 T54	D50-V52 PolarHBondContact O-N 3.14Å; V52-T54 PolarHBondContact O-N 2.98Å
53	S	32	Very low	36.9	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-69.9	123.7	178.3	-53.9	0	0	0	0	110.6	L51	L51-S53 PolarHBondContact O-N 2.99Å; L51-S53 VanDerWaalsContact O-N 3.15Å
54	T	37.7	Very low	38	Very low	105 Å²	105	123 Å²	123	64%	0.644	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-84.3	161.1	178	53.5	0	0	0	0	111.7	V52 N56	V52-T54 PolarHBondContact O-N 2.98Å; T54-N56 PolarHBondContact O-N 3.14Å
55	P	34.8	Very low	39.4	Very low	123 Å²	123	125.5 Å²	125.5	80%	0.799	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-69	4.3	-166	-22.7	35.5	0	0	0	117.6	D57	P55-D57 VanDerWaalsContact C-N 3.31Å; P55-D57 PolarHBondContact O-N 3.32Å
56	N	39.9	Very low	40.4	Very low	129 Å²	129	126.6 Å²	126.6	69%	0.69	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-79.4	-2.1	-169.8	-99.8	40.1	0	0	0	115.5	T54 L58 V59	T54-N56 PolarHBondContact O-N 3.14Å; N56-L58 PolarHBondContact O-N 3.32Å; N56-V59 PolarHBondContact O-N 3.1Å
57	D	45.5	Very low	41.1	Very low	100 Å²	100	128.4 Å²	128.4	54%	0.535	69%	0.692	S	S	.	*	G	3₁₀ helix	trans	-69.5	-7.9	-169.4	-151.8	39.5	0	0	0	114.4	P55 V59 S60	P55-D57 VanDerWaalsContact C-N 3.31Å; P55-D57 PolarHBondContact O-N 3.32Å; D57-V59 PolarHBondContact O-N 2.97Å; D57-S60 WeakPolarHBondContact O-CB 3.28Å; D57-S60 PolarHBondContact O-N 3.41Å; D57-S60 WeakPolarHBondContact OD1-CB 3.27Å; D57-S60 PolarHBondContact OD1-OG 2.9Å
58	L	33.5	Very low	42	Very low	167 Å²	167	125.8 Å²	125.8	87%	0.874	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-64	-17.8	173.2	-65.4	-179.4	0	0	0	114	N56	N56-L58 PolarHBondContact O-N 3.32Å
59	V	59.5	Low	42.7	Very low	130 Å²	130	126.5 Å²	126.5	79%	0.788	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-84.7	-19.7	172.7	-173.6	0	0	0	0	111.5	N56 D57	N56-V59 PolarHBondContact O-N 3.1Å; D57-V59 PolarHBondContact O-N 2.97Å
60	S	49.1	Very low	42.9	Very low	51 Å²	51	128.7 Å²	128.7	36%	0.357	68%	0.681	S	S	.	*			trans	-91.6	108.3	-176.4	-62.3	0	0	0	0	111.8	D57 A62	D57-S60 WeakPolarHBondContact O-CB 3.28Å; D57-S60 PolarHBondContact O-N 3.41Å; D57-S60 WeakPolarHBondContact OD1-CB 3.27Å; D57-S60 PolarHBondContact OD1-OG 2.9Å; S60-A62 PolarHBondContact O-N 3.37Å
61	L	47.4	Very low	43.1	Very low	116 Å²	116	130.9 Å²	130.9	61%	0.607	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	24.3	169.7	-56.9	178.6	0	0	0	113.4	W63 L64 Q65	L61-W63 VanDerWaalsContact C-N 3.27Å; L61-W63 PolarHBondContact O-N 2.89Å; L61-L64 HydrophobicContact CD2-CD1 4.24Å; L61-L64 WeakPolarHBondContact O-CB 3.19Å; L61-L64 PolarHBondContact O-N 2.95Å; L61-Q65 PolarHBondContact O-N 3.2Å
62	A	60.5	Low	43	Very low	48 Å²	48	130.7 Å²	130.7	40%	0.397	69%	0.685	S	S	.	*	H	α-helix	trans	-63.4	-32.3	177.8	0	0	0	0	0	112	S60 L64 Q65 K66	S60-A62 PolarHBondContact O-N 3.37Å; A62-L64 PolarHBondContact O-N 3.43Å; A62-Q65 PolarHBondContact O-N 3.18Å; A62-K66 PolarHBondContact O-N 3.19Å; A62-K66 VanDerWaalsContact O-N 3.14Å
63	W	55.1	Low	43	Very low	155 Å²	155	127.7 Å²	127.7	59%	0.587	68%	0.675	S	S	*	*	H	α-helix	trans	-64.9	-20.1	172.8	70.9	-95.4	0	0	0	113.5	L61	L61-W63 VanDerWaalsContact C-N 3.27Å; L61-W63 PolarHBondContact O-N 2.89Å
64	L	44.2	Very low	43.1	Very low	84 Å²	84	127.4 Å²	127.4	44%	0.44	67%	0.67	S	S	.	*	H	α-helix	trans	-87.5	-16.4	172.2	-99	159.6	0	0	0	113.2	L61 A62 I69	L61-L64 HydrophobicContact CD2-CD1 4.24Å; L61-L64 WeakPolarHBondContact O-CB 3.19Å; L61-L64 PolarHBondContact O-N 2.95Å; A62-L64 PolarHBondContact O-N 3.43Å; L64-I69 HydrophobicContact CD2-CD1 4.15Å
65	Q	54.8	Low	43	Very low	166 Å²	166	131 Å²	131	78%	0.776	68%	0.684	S	S	*	*	H	α-helix	trans	-81.6	-28.4	168.8	-67.8	-172.1	-15	0	0	111.9	L61 A62 R67	L61-Q65 PolarHBondContact O-N 3.2Å; A62-Q65 PolarHBondContact O-N 3.18Å; Q65-R67 PolarHBondContact O-N 2.78Å
66	K	47.2	Very low	42.9	Very low	144 Å²	144	132 Å²	132	63%	0.626	68%	0.683	S	S	*	*	S	Bend	trans	-63.2	111.9	159.4	-67.4	-177.9	-179.5	176	0	108.1	A62 D68	A62-K66 PolarHBondContact O-N 3.19Å; A62-K66 VanDerWaalsContact O-N 3.14Å; K66-D68 PolarHBondContact O-N 3Å
67	R	43.9	Very low	42.6	Very low	234 Å²	234	129.4 Å²	129.4	88%	0.883	69%	0.686	S	S	*	*			trans	-76.5	21.7	-174.6	-77.5	-175.4	161.4	109.9	-6.5	113.8	Q65 I69	Q65-R67 PolarHBondContact O-N 2.78Å; R67-I69 PolarHBondContact O-N 2.93Å
68	D	43.6	Very low	42.2	Very low	129 Å²	129	133.7 Å²	133.7	69%	0.69	70%	0.703	S	S	*	*			trans	-84.2	35	-169.1	-53.5	-37	0	0	0	112.6	K66 L70	K66-D68 PolarHBondContact O-N 3Å; D68-L70 PolarHBondContact O-N 2.84Å
69	I	39.7	Very low	42.3	Very low	123 Å²	123	134.8 Å²	134.8	63%	0.631	70%	0.704	S	S	*	*	S	Bend	trans	-77.2	80.8	173.7	-54.6	-178.1	0	0	0	108.6	L64 R67	L64-I69 HydrophobicContact CD2-CD1 4.15Å; R67-I69 PolarHBondContact O-N 2.93Å
70	L	33.8	Very low	41.2	Very low	143 Å²	143	136.9 Å²	136.9	75%	0.749	71%	0.711	S	S	*	*			trans	56.8	71.3	163.9	-56.2	176.7	0	0	0	115	D68 I72	D68-L70 PolarHBondContact O-N 2.84Å; L70-I72 PolarHBondContact O-N 3.21Å
71	Q	35.2	Very low	40.3	Very low	196 Å²	196	138 Å²	138	92%	0.916	73%	0.73	S	S	*	*			trans	-65.1	86.2	151.2	-73.5	-170.9	-3.7	0	0	109.5	A73	Q71-A73 PolarHBondContact O-N 2.85Å
72	I	33.6	Very low	39.4	Very low	150 Å²	150	137.4 Å²	137.4	77%	0.769	74%	0.736	S	S	*	*			trans	-75.9	100	159.2	-57.6	177.5	0	0	0	105.5	L70	L70-I72 PolarHBondContact O-N 3.21Å
73	A	32	Very low	37.8	Very low	74 Å²	74	141.7 Å²	141.7	61%	0.612	75%	0.752	S	S	*	*			trans	-56.4	142.7	176.2	0	0	0	0	0	110.3	Q71 L75	Q71-A73 PolarHBondContact O-N 2.85Å; A73-L75 PolarHBondContact O-N 2.93Å
74	P	34	Very low	36.7	Very low	108 Å²	108	139.8 Å²	139.8	70%	0.701	76%	0.762	S	S	*	*			trans	-54.6	137.6	167	-21.7	33.7	0	0	0	109.8	D76	P74-D76 PolarHBondContact O-N 3.41Å
75	L	34.9	Very low	36	Very low	180 Å²	180	142.2 Å²	142.2	94%	0.942	78%	0.781	S	S	*	*			trans	-82.7	104.8	163.7	-75.1	165.1	0	0	0	106.3	A73	A73-L75 PolarHBondContact O-N 2.93Å
76	D	34.1	Very low	34.8	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-62.5	154.2	176.4	-65.3	-52.4	0	0	0	111.1	P74	P74-D76 PolarHBondContact O-N 3.41Å
77	G	33.4	Very low	33.7	Very low	73 Å²	73	137 Å²	137	75%	0.753	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-81.4	125.2	-177.9	0	0	0	0	0	111.9
78	E	36.6	Very low	33.1	Very low	191 Å²	191	131.9 Å²	131.9	89%	0.893	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-57.7	140.7	167	-59.8	-82.1	151.6	0	0	110.3
79	E	35.8	Very low	32.3	Very low	189 Å²	189	131.3 Å²	131.3	88%	0.883	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-79.7	137.3	-174.9	-60.1	-178.5	135.8	0	0	112.2	G81	E79-G81 PolarHBondContact O-N 3.1Å
80	D	35.8	Very low	31.7	Very low	174 Å²	174	132.1 Å²	132.1	93%	0.93	79%	0.789	S	S	*	*			trans	-69.3	99.5	175.9	-82.2	-53	0	0	0	110.7
81	G	31.3	Very low	31.4	Very low	75 Å²	75	128.8 Å²	128.8	77%	0.773	79%	0.79	S	S	*	*			trans	-61.4	139.7	178.6	0	0	0	0	0	113.6	E79	E79-G81 PolarHBondContact O-N 3.1Å
82	S	27.7	Very low	30.9	Very low	104 Å²	104	130.6 Å²	130.6	73%	0.727	79%	0.788	S	S	*	*			trans	-72.2	148.1	178.7	62.9	0	0	0	0	112.7
83	D	28.1	Very low	31	Very low	138 Å²	138	127.4 Å²	127.4	74%	0.738	78%	0.777	S	S	*	*				177.3	122.3	110	-88.3	-2.4	0	0	0	111.8	V85	D83-V85 PolarHBondContact O-N 3.38Å; D83-V85 VanDerWaalsContact O-N 3.14Å
84	S	31.2	Very low	31	Very low	114 Å²	114	133.2 Å²	133.2	80%	0.797	79%	0.792	S	S	*	*			trans	-81.7	88.4	178.8	55.3	0	0	0	0	111.5	S86	S84-S86 PolarHBondContact O-N 3Å
85	V	29.9	Very low	31	Very low	136 Å²	136	134.8 Å²	134.8	82%	0.824	79%	0.794	S	S	*	*			trans	-76.6	84.9	174.6	-174.7	0	0	0	0	110.7	D83	D83-V85 PolarHBondContact O-N 3.38Å; D83-V85 VanDerWaalsContact O-N 3.14Å
86	S	28.5	Very low	30.7	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	79%	0.785	S	S	*	*			trans	-115.5	103.5	172.2	56.6	0	0	0	0	110.9	S84	S84-S86 PolarHBondContact O-N 3Å
87	S	25.7	Very low	30.3	Very low	104 Å²	104	132.9 Å²	132.9	73%	0.727	78%	0.779	S	S	*	*			trans	-117.4	94.9	178.8	-60.5	0	0	0	0	111.7
88	P	31.3	Very low	30	Very low	126 Å²	126	135 Å²	135	82%	0.818	77%	0.773	S	S	*	*			trans	-78.6	143.8	167.1	-4.2	22.8	0	0	0	110.4
89	V	25.6	Very low	29.6	Very low	118 Å²	118	134.2 Å²	134.2	72%	0.715	77%	0.768	S	S	*	*			trans	-137.8	140.2	-172.9	179.1	0	0	0	0	111.8
90	T	28.4	Very low	29.3	Very low	140 Å²	140	133.4 Å²	133.4	86%	0.859	76%	0.764	S	S	*	*			trans	70	137.2	166.4	39.6	0	0	0	0	121.4
91	G	27.1	Very low	28.7	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	76%	0.759	S	S	*	*			trans	88.2	111.4	170.6	0	0	0	0	0	114.3
92	R	24.4	Very low	28.5	Very low	234 Å²	234	135.1 Å²	135.1	88%	0.883	76%	0.76	S	S	*	*			cis	76.5	133	9.1	-133.6	-133.1	178.8	-151.4	-2.9	116.1
93	P	36.1	Very low	28.7	Very low	83 Å²	83	134.6 Å²	134.6	54%	0.539	75%	0.754	S	S	.	*			cis	-133.3	136.6	-49.1	33.9	-18.3	0	0	0	113.6
94	E	32.1	Very low	28.5	Very low	196 Å²	196	134.6 Å²	134.6	92%	0.916	75%	0.753	S	S	*	*			trans	-151	138.8	175.1	-57.4	170.2	124.8	0	0	108.7
95	D	32.3	Very low	28.4	Very low	140 Å²	140	137.7 Å²	137.7	75%	0.749	76%	0.759	S	S	*	*			cis	-161.6	153.8	-36.6	-115.7	2.8	0	0	0	111.1
96	E	28.9	Very low	28.1	Very low	161 Å²	161	138.2 Å²	138.2	75%	0.752	75%	0.753	S	S	*	*			trans	63.1	150.9	161.5	-61.9	-67.5	78	0	0	124.8
97	D	26.8	Very low	28.1	Very low	125 Å²	125	140.4 Å²	140.4	67%	0.668	75%	0.754	S	S	*	*			trans	66.1	108.9	154.4	-80.7	-24.3	0	0	0	124.4
98	N	26.5	Very low	28.2	Very low	117 Å²	117	141.3 Å²	141.3	63%	0.626	75%	0.751	S	S	*	*			trans	53.5	139.1	133.5	-47.9	-50	0	0	0	120.9
99	F	27.8	Very low	27.9	Very low	176 Å²	176	140.1 Å²	140.1	77%	0.772	75%	0.745	S	S	*	*			cis	-149.7	155.4	39.9	-94.4	-91.7	0	0	0	114.6
100	E	28.8	Very low	28.1	Very low	172 Å²	172	142.9 Å²	142.9	80%	0.804	76%	0.755	S	S	*	*			trans	51	82	148.7	-73.4	171.6	-175	0	0	120
101	T	24.4	Very low	28.1	Very low	134 Å²	134	144.8 Å²	144.8	82%	0.822	75%	0.754	S	S	*	*			trans	-72.7	128.1	148.7	-51.6	0	0	0	0	110.6
102	N	27	Very low	28.1	Very low	151 Å²	151	146.8 Å²	146.8	81%	0.807	75%	0.754	S	S	*	*			trans	-160.9	158.2	157.5	-101.7	-39	0	0	0	110.8
103	P	31.4	Very low	28.4	Very low	92 Å²	92	142.7 Å²	142.7	60%	0.597	76%	0.755	S	S	*	*				-127.5	153	-122.7	38.5	-24.5	0	0	0	116.7
104	I	24.1	Very low	28.1	Very low	138 Å²	138	144.1 Å²	144.1	71%	0.708	76%	0.762	S	S	*	*			trans	35.8	96.7	133.5	-47.4	169.4	0	0	0	115.6
105	L	29.4	Very low	27.7	Very low	179 Å²	179	141.5 Å²	141.5	94%	0.937	75%	0.754	S	S	*	*			trans	-87.7	113.6	148	-72.5	-177.3	0	0	0	109.1
106	H	24.2	Very low	27.5	Very low	147 Å²	147	146.6 Å²	146.6	68%	0.681	76%	0.763	S	S	*	*			trans	-79	-179.3	172.6	-124.2	-88.5	0	0	0	110.6
107	M	27.4	Very low	27.2	Very low	143 Å²	143	144.5 Å²	144.5	70%	0.704	77%	0.766	S	S	*	*			trans	80.8	135.5	169.2	-43.8	-78.8	81.3	0	0	115.7
108	D	28.2	Very low	27.5	Very low	123 Å²	123	144.7 Å²	144.7	66%	0.658	77%	0.774	S	S	*	*			cis	-155.8	171.9	-29.4	-137.9	-35.6	0	0	0	111.8
109	S	25	Very low	27.6	Very low	100 Å²	100	143.9 Å²	143.9	70%	0.699	78%	0.778	S	S	*	*			trans	-53.5	132.4	-177.1	-48.7	0	0	0	0	114.9
110	L	28.8	Very low	27.4	Very low	177 Å²	177	143.9 Å²	143.9	93%	0.927	79%	0.785	S	S	*	*			trans	-131.8	132.9	152.6	-74.3	178.7	0	0	0	109.1
111	E	29.3	Very low	27.5	Very low	179 Å²	179	142.4 Å²	142.4	84%	0.836	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-82.2	157.2	-164.5	-77.4	-161.3	148.9	0	0	115.1
112	P	27.5	Very low	27.8	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-73.3	128.4	-172.7	28.7	-35.8	0	0	0	113.5	V114	P112-V114 PolarHBondContact O-N 3.42Å
113	V	30.7	Very low	27.7	Very low	148 Å²	148	140.3 Å²	140.3	90%	0.897	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-71.9	116.5	174.6	177.8	0	0	0	0	110.6
114	V	28.5	Very low	27.5	Very low	113 Å²	113	140.4 Å²	140.4	69%	0.685	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-78.3	129.3	-176.4	172.8	0	0	0	0	112.8	P112	P112-V114 PolarHBondContact O-N 3.42Å
115	N	24.2	Very low	27.7	Very low	141 Å²	141	142.2 Å²	142.2	75%	0.754	79%	0.79	S	S	*	*			trans	27.1	111.8	155.2	-58.6	-13.6	0	0	0	119.4
116	R	28.9	Very low	27.7	Very low	247 Å²	247	142.1 Å²	142.1	93%	0.932	78%	0.782	S	S	*	*			trans	-139.4	101.9	142.2	-71	-165.2	178.1	-175.1	-0.3	111.4	P118	R116-P118 WeakPolarHBondContact O-CD 3.44Å
117	S	23.5	Very low	27.7	Very low	118 Å²	118	140.6 Å²	140.6	83%	0.825	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74.6	123.7	170.6	-51.4	0	0	0	0	110.3
118	P	31.4	Very low	27.9	Very low	128 Å²	128	140.1 Å²	140.1	83%	0.831	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.7	143.3	172.2	-17	32.2	0	0	0	111.4	R116	R116-P118 WeakPolarHBondContact O-CD 3.44Å
119	S	28.8	Very low	27.8	Very low	101 Å²	101	141.7 Å²	141.7	71%	0.706	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-83.5	137.7	179.9	54	0	0	0	0	113.2
120	L	23.5	Very low	27.9	Very low	176 Å²	176	144.9 Å²	144.9	92%	0.921	81%	0.81	S	S	*	*			trans	16.8	120.2	142.2	-66.7	163.2	0	0	0	118.1
121	V	31.3	Very low	27.8	Very low	140 Å²	140	146 Å²	146	85%	0.848	80%	0.802	S	S	*	*			trans	-133.7	134.2	153.9	-145.2	0	0	0	0	108.7
122	P	30.2	Very low	27.4	Very low	119 Å²	119	143 Å²	143	77%	0.773	80%	0.799	S	S	*	*			trans	-88.2	154.2	-166.2	-10.4	29.6	0	0	0	115.6
123	V	24.9	Very low	27.4	Very low	123 Å²	123	144 Å²	144	75%	0.745	80%	0.802	S	S	*	*			trans	-6.6	123.9	157.5	-175.2	0	0	0	0	116.8	Q125	V123-Q125 HydrophobicContact CG1-CG 3.89Å
124	S	28.3	Very low	27.2	Very low	93 Å²	93	146.4 Å²	146.4	65%	0.65	80%	0.796	S	S	*	*			trans	-111.4	131.1	151.1	59.2	0	0	0	0	110.3
125	Q	29	Very low	26.9	Very low	176 Å²	176	152.4 Å²	152.4	82%	0.822	81%	0.806	S	S	*	*			trans	-95.2	100.5	179.9	-66.2	179.3	-4.5	0	0	109.7	V123	V123-Q125 HydrophobicContact CG1-CG 3.89Å
126	F	27.5	Very low	27.3	Very low	177 Å²	177	151.5 Å²	151.5	78%	0.776	81%	0.807	S	S	*	*			trans	-99.4	91.1	173.7	-83.5	-80.9	0	0	0	111.5	V128	F126-V128 PolarHBondContact O-N 2.97Å; F126-V128 VanDerWaalsContact O-N 3.1Å
127	S	24.8	Very low	27.2	Very low	116 Å²	116	144.6 Å²	144.6	81%	0.811	80%	0.804	S	S	*	*			trans	-75.2	85.5	170.3	40.1	0	0	0	0	111.1	L129	S127-L129 PolarHBondContact O-N 2.9Å
128	V	31.6	Very low	27.3	Very low	133 Å²	133	144.3 Å²	144.3	81%	0.806	80%	0.801	S	S	*	*			trans	-79.3	112.2	175.4	-176.1	0	0	0	0	110.1	F126	F126-V128 PolarHBondContact O-N 2.97Å; F126-V128 VanDerWaalsContact O-N 3.1Å
129	L	27.1	Very low	27.2	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	80%	0.798	S	S	*	*			trans	-59.9	156.8	-179.7	-81.5	145.9	0	0	0	114.5	S127 R131	S127-L129 PolarHBondContact O-N 2.9Å; L129-R131 PolarHBondContact O-N 3.48Å
130	D	25.2	Very low	27.1	Very low	167 Å²	167	145.1 Å²	145.1	89%	0.893	81%	0.805	S	S	*	*			trans	-44.8	101.4	172.4	-79.7	-66.3	0	0	0	113.3	C132	D130-C132 PolarHBondContact O-N 3.36Å
131	R	27	Very low	27.2	Very low	202 Å²	202	140.4 Å²	140.4	76%	0.762	80%	0.798	S	S	*	*			trans	-89.9	92.5	173.8	-160.5	170.9	-161.3	168.1	8.5	110.4	L129	L129-R131 PolarHBondContact O-N 3.48Å
132	C	22.6	Very low	27.2	Very low	114 Å²	114	141.5 Å²	141.5	77%	0.77	80%	0.799	S	S	*	*			trans	-43.5	139.5	-179.2	-170.4	0	0	0	0	113.9	D130 R134	D130-C132 PolarHBondContact O-N 3.36Å; C132-R134 PolarHBondContact O-N 2.9Å
133	V	26.6	Very low	27.3	Very low	137 Å²	137	144.6 Å²	144.6	83%	0.83	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-53.1	117.7	-168.7	-179.9	0	0	0	0	112
134	R	26.2	Very low	27.3	Very low	199 Å²	199	146.6 Å²	146.6	75%	0.751	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-83.1	133.1	169.8	-75.7	-174.6	168.4	-170.1	-6.3	110.3	C132	C132-R134 PolarHBondContact O-N 2.9Å
135	R	23.3	Very low	27.2	Very low	239 Å²	239	147.1 Å²	147.1	90%	0.902	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-54	129.8	177.5	-167	174.8	-172.3	156.9	0.5	110.2
136	P	31.4	Very low	26.9	Very low	121 Å²	121	147.8 Å²	147.8	79%	0.786	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-65.5	141	-175.2	26.1	-34.3	0	0	0	111.5
137	A	26.7	Very low	27.1	Very low	103 Å²	103	144.8 Å²	144.8	85%	0.851	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-82.8	152.4	171.5	0	0	0	0	0	110.7
138	S	26.2	Very low	27.1	Very low	111 Å²	111	148 Å²	148	78%	0.776	82%	0.819	S	S	*	*			trans	-86.3	-177	177.7	49.7	0	0	0	0	112.5
139	V	29.2	Very low	27	Very low	127 Å²	127	150.6 Å²	150.6	77%	0.77	82%	0.822	S	S	*	*			trans	88.4	84.1	175	-167	0	0	0	0	115.2
140	S	25.9	Very low	27	Very low	120 Å²	120	148 Å²	148	84%	0.839	82%	0.817	S	S	*	*				39.2	124.7	116.6	-45.9	0	0	0	0	120.3
141	G	25.8	Very low	26.9	Very low	76 Å²	76	151.6 Å²	151.6	78%	0.784	82%	0.818	S	S	*	*			trans	134.8	88.3	145	0	0	0	0	0	114.4
142	D	31.3	Very low	26.8	Very low	164 Å²	164	150.8 Å²	150.8	88%	0.877	82%	0.82	S	S	*	*			trans	-147.8	161.7	151	-125.5	-34.5	0	0	0	111.6
143	Q	31.9	Very low	26.9	Very low	183 Å²	183	150.4 Å²	150.4	86%	0.855	82%	0.819	S	S	*	*			trans	-101	166.7	-149.3	-62.9	-169.8	49.7	0	0	117.1
144	L	25.1	Very low	26.8	Very low	165 Å²	165	150.6 Å²	150.6	86%	0.864	82%	0.821	S	S	*	*			trans	-54	175.3	-178.4	-71.1	154.3	0	0	0	116.3
145	S	26.5	Very low	26.8	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	82%	0.817	S	S	*	*			trans	90.2	84.6	159.8	69.8	0	0	0	0	118.4
146	H	24.1	Very low	27.1	Very low	189 Å²	189	141.2 Å²	141.2	88%	0.875	81%	0.809	S	S	*	*			trans	2	120.8	133.3	-62.6	-96.1	0	0	0	117.3
147	S	30	Very low	27	Very low	114 Å²	114	141.6 Å²	141.6	80%	0.797	81%	0.81	S	S	*	*			trans	-130.5	135.1	144.6	46.6	0	0	0	0	108.4
148	E	25	Very low	27.5	Very low	185 Å²	185	141.6 Å²	141.6	86%	0.864	80%	0.799	S	S	*	*			trans	-95.5	108	-162.3	-61.6	-177.6	108.6	0	0	111.9
149	Q	30.3	Very low	27.9	Very low	186 Å²	186	141.1 Å²	141.1	87%	0.869	80%	0.801	S	S	*	*			trans	-112.4	109.5	172.7	-74.6	-167	-13.2	0	0	113.4
150	S	25.9	Very low	28.5	Very low	100 Å²	100	138.7 Å²	138.7	70%	0.699	78%	0.784	S	S	*	*			trans	31.5	99.5	146.4	-160.1	0	0	0	0	118.3	F152	S150-F152 PolarHBondContact O-N 3.09Å
151	R	23.4	Very low	29.2	Very low	243 Å²	243	135.3 Å²	135.3	92%	0.917	77%	0.768	S	S	*	*			trans	-79.2	91	174.3	-55.7	179	-163.7	169	5	111.9
152	F	25.8	Very low	30.3	Very low	186 Å²	186	137 Å²	137	82%	0.816	76%	0.763	S	S	*	*			trans	-138	130	167.1	-78.9	-72.8	0	0	0	115.1	S150	S150-F152 PolarHBondContact O-N 3.09Å
153	S	24.1	Very low	31.3	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	75%	0.754	S	S	*	*			trans	65.3	40.2	156.9	-162.3	0	0	0	0	119.6	N155	S153-N155 PolarHBondContact O-N 3.02Å
154	T	24.4	Very low	32.5	Very low	141 Å²	141	127.8 Å²	127.8	87%	0.865	72%	0.717	S	S	*	*			trans	-73.1	112.5	154.7	42.3	0	0	0	0	110.1
155	N	26.4	Very low	34.7	Very low	126 Å²	126	124.8 Å²	124.8	67%	0.674	70%	0.701	S	S	*	*			trans	-60.7	144.7	172.5	-76.4	-77.3	0	0	0	110.3	S153 T157	S153-N155 PolarHBondContact O-N 3.02Å; N155-T157 PolarHBondContact O-N 2.82Å
156	P	29.2	Very low	37.4	Very low	114 Å²	114	123.9 Å²	123.9	74%	0.74	69%	0.691	S	S	*	*			trans	-72.3	80.5	171.5	31.3	-34.5	0	0	0	109.7	V158	P156-V158 HydrophobicContact CB-CG2 4.36Å; P156-V158 PolarHBondContact O-N 3.36Å
157	T	30.5	Very low	40.4	Very low	130 Å²	130	119.9 Å²	119.9	80%	0.798	67%	0.671	S	S	*	*			trans	-72.2	68.9	166.7	-53.3	0	0	0	0	108.2	N155 A159	N155-T157 PolarHBondContact O-N 2.82Å; T157-A159 PolarHBondContact O-N 3.46Å; T157-A159 VanDerWaalsContact O-N 3.16Å
158	V	36.1	Very low	43.2	Very low	102 Å²	102	115.3 Å²	115.3	62%	0.618	64%	0.639	S	S	*	*			trans	-54.4	122.1	177	178.6	0	0	0	0	107.7	P156 L160	P156-V158 HydrophobicContact CB-CG2 4.36Å; P156-V158 PolarHBondContact O-N 3.36Å; V158-L160 HydrophobicContact CG1-CB 4.42Å; V158-L160 PolarHBondContact O-N 3.18Å
159	A	34.8	Very low	46.2	Very low	101 Å²	101	110.7 Å²	110.7	84%	0.835	62%	0.62	S	S	*	*			trans	-73.4	62.9	-178.9	0	0	0	0	0	110.9	T157 G161	T157-A159 PolarHBondContact O-N 3.46Å; T157-A159 VanDerWaalsContact O-N 3.16Å; A159-G161 PolarHBondContact O-N 3.46Å
160	L	42.3	Very low	49.2	Very low	76 Å²	76	103.2 Å²	103.2	40%	0.398	58%	0.584	S	S	.	*			trans	-76.3	68.5	-176.8	-162.6	68.9	0	0	0	109.6	V158 T162 G164	V158-L160 HydrophobicContact CG1-CB 4.42Å; V158-L160 PolarHBondContact O-N 3.18Å; L160-T162 PolarHBondContact O-N 3.37Å; L160-G164 VanDerWaalsContact CD2-CA 3.41Å; L160-G164 VanDerWaalsContact CG-CA 3.47Å; L160-G164 WeakPolarHBondContact O-CA 3.43Å; L160-G164 PolarHBondContact O-N 2.8Å
161	G	40.5	Very low	52.5	Low	49 Å²	49	100.8 Å²	100.8	51%	0.505	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-51.2	133.7	-173	0	0	0	0	0	112.3	A159 H163 G164	A159-G161 PolarHBondContact O-N 3.46Å; G161-H163 WeakPolarHBondContact O-CA 3.41Å; G161-H163 WeakPolarHBondContact O-CB 3.4Å; G161-H163 PolarHBondContact O-N 3.34Å; G161-G164 PolarHBondContact O-N 2.7Å
162	T	48.3	Very low	55.9	Low	111 Å²	111	91.4 Å²	91.4	68%	0.681	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	37.3	-58.2	176.4	59.8	0	0	0	0	117.9	L160 G164 L165	L160-T162 PolarHBondContact O-N 3.37Å; T162-G164 PolarHBondContact O-N 2.78Å; T162-L165 WeakPolarHBondContact O-CB 3.35Å; T162-L165 PolarHBondContact O-N 3.05Å
163	H	52	Low	59.3	Low	147 Å²	147	83.5 Å²	83.5	68%	0.681	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-44.6	-37.3	165	-56.3	-72	0	0	0	113.3	G161 L165 T166	G161-H163 WeakPolarHBondContact O-CA 3.41Å; G161-H163 WeakPolarHBondContact O-CB 3.4Å; G161-H163 PolarHBondContact O-N 3.34Å; H163-L165 PolarHBondContact O-N 2.79Å; H163-T166 WeakPolarHBondContact O-CB 3.39Å; H163-T166 PolarHBondContact O-N 2.96Å; H163-T166 PolarHBondContact O-OG1 3.1Å
164	G	58.6	Low	62.7	Low	8 Å²	8	80.2 Å²	80.2	8%	0.082	47%	0.472	C	S	.	.	G	3₁₀ helix	trans	-65.9	-16.2	176.6	0	0	0	0	0	115.7	L160 G161 T162	L160-G164 VanDerWaalsContact CD2-CA 3.41Å; L160-G164 VanDerWaalsContact CG-CA 3.47Å; L160-G164 WeakPolarHBondContact O-CA 3.43Å; L160-G164 PolarHBondContact O-N 2.8Å; G161-G164 PolarHBondContact O-N 2.7Å; T162-G164 PolarHBondContact O-N 2.78Å
165	L	71.3	Confident	66.1	Low	101 Å²	101	73.5 Å²	73.5	53%	0.529	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-96.9	6.3	173.8	-54.4	178.6	0	0	0	112.1	T162 H163 P202 F203	T162-L165 WeakPolarHBondContact O-CB 3.35Å; T162-L165 PolarHBondContact O-N 3.05Å; H163-L165 PolarHBondContact O-N 2.79Å; L165-P202 HydrophobicContact CD2-CB 4.4Å; L165-F203 WeakPolarHBondContact O-CD2 3.43Å
166	T	82.6	Confident	69.5	Low	86 Å²	86	67.5 Å²	67.5	53%	0.528	40%	0.399	S	S	.	.	S	Bend	trans	-84.6	149	171.9	68.3	0	0	0	0	110.9	H163 P168 F203	H163-T166 WeakPolarHBondContact O-CB 3.39Å; H163-T166 PolarHBondContact O-N 2.96Å; H163-T166 PolarHBondContact O-OG1 3.1Å; T166-P168 WeakPolarHBondContact O-CD 3.39Å; T166-F203 WeakPolarHBondContact O-CB 3.38Å
167	K	87.7	Confident	72.7	Confident	105 Å²	105	62.3 Å²	62.3	46%	0.457	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-64.6	125.8	177.9	-177.7	178.2	176.4	-176.7	0	109.9	F203	K167-F203 HydrophobicContact CB-CD1 4.07Å; K167-F203 HydrophobicContact CB-CD2 4.37Å; K167-F203 HydrophobicContact CB-CE1 3.76Å; K167-F203 HydrophobicContact CB-CE2 4.07Å; K167-F203 HydrophobicContact CB-CG 4.37Å; K167-F203 HydrophobicContact CB-CZ 3.76Å; K167-F203 HydrophobicContact CD-CE1 4.16Å; K167-F203 HydrophobicContact CD-CZ 4.32Å; K167-F203 HydrophobicContact CG-CD1 4.1Å; K167-F203 HydrophobicContact CG-CE1 3.65Å; K167-F203 HydrophobicContact CG-CZ 4.04Å
168	P	88	Confident	75.9	Confident	18 Å²	18	57.9 Å²	57.9	12%	0.117	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-61.3	141.2	178.5	-21.8	32	0	0	0	112.4	T166 Y170 F201 Y204	T166-P168 WeakPolarHBondContact O-CD 3.39Å; P168-Y170 HydrophobicContact CB-CD2 3.79Å; P168-Y170 HydrophobicContact CB-CE2 4.48Å; P168-Y170 PolarHBondContact O-N 2.73Å; P168-F201 HydrophobicContact CB-CD1 3.83Å; P168-F201 HydrophobicContact CB-CE1 4.01Å; P168-F201 HydrophobicContact CB-CG 4.3Å; P168-F201 HydrophobicContact CG-CB 3.63Å; P168-F201 HydrophobicContact CG-CD1 3.33Å; P168-F201 HydrophobicContact CG-CD2 4.35Å; P168-F201 HydrophobicContact CG-CE1 4.04Å; P168-F201 HydrophobicContact CG-CG 3.51Å; P168-Y204 HydrophobicContact CG-CE2 4.11Å
169	N	89	Confident	78.8	Confident	88 Å²	88	53 Å²	53	47%	0.471	31%	0.305	S	S	.	.	S	Bend	trans	-80.6	56.8	177.1	-71.3	-44.2	0	0	0	112.1	N258 W260	N169-N258 PolarHBondContact O-ND2 3.48Å; N169-W260 HydrophobicContact CB-CB 4.14Å; N169-W260 HydrophobicContact CB-CD2 3.77Å; N169-W260 HydrophobicContact CB-CG 3.49Å; N169-W260 VanDerWaalsContact CB-CG 3.49Å; N169-W260 VanDerWaalsContact ND2-CE2 3.25Å; N169-W260 WeakPolarHBondContact ND2-CZ2 2.96Å
170	Y	92.9	Very high	81.7	Confident	30 Å²	30	48.2 Å²	48.2	12%	0.118	27%	0.266	C	S	.	.	S	Bend	trans	-128.2	147.7	174.7	-66	-83.4	0	0	0	109.8	P168 H174 M178 F201 N258 N261	P168-Y170 HydrophobicContact CB-CD2 3.79Å; P168-Y170 HydrophobicContact CB-CE2 4.48Å; P168-Y170 PolarHBondContact O-N 2.73Å; Y170-H174 HydrophobicContact CD1-CB 4.13Å; Y170-M178 HydrophobicContact CD1-CE 3.72Å; Y170-M178 HydrophobicContact CD1-SD 4.48Å; Y170-M178 HydrophobicContact CD2-CE 4.32Å; Y170-M178 HydrophobicContact CE1-CE 3.98Å; Y170-M178 HydrophobicContact CE1-SD 4.23Å; Y170-M178 HydrophobicContact CG-CE 3.92Å; Y170-F201 HydrophobicContact CD2-CE1 4.39Å; Y170-F201 HydrophobicContact CD2-CZ 4.18Å; Y170-F201 HydrophobicContact CE2-CE1 4.18Å; Y170-F201 HydrophobicContact CE2-CZ 4.09Å; Y170-N258 VanDerWaalsContact CD1-ND2 3.29Å; Y170-N258 WeakPolarHBondContact CD1-ND2 3.09Å; Y170-N258 WeakPolarHBondContact CE1-ND2 3.46Å; Y170-N261 WeakPolarHBondContact CE1-OD1 3.38Å; Y170-N261 PolarHBondContact OH-OD1 3.03Å; Y170-N261 VanDerWaalsContact OH-OD1 3.13Å
171	S	94.3	Very high	84.2	Confident	48 Å²	48	46.1 Å²	46.1	34%	0.336	25%	0.254	S	S	.	.			trans	-72.8	158.6	168.6	69.5	0	0	0	0	110.2	T173 H174 L175	S171-T173 PolarHBondContact O-N 2.7Å; S171-H174 PolarHBondContact O-N 3.26Å; S171-H174 PolarHBondContact OG-CD2 3.33Å; S171-H174 PolarHBondContact OG-N 3.18Å; S171-H174 PolarHBondContact OG-ND1 3.04Å; S171-H174 PolarHBondContact OG-NE2 3.23Å; S171-L175 WeakPolarHBondContact O-CG 3.23Å; S171-L175 PolarHBondContact O-N 3.17Å
172	Y	96.3	Very high	86.8	Confident	46 Å²	46	47.1 Å²	47.1	18%	0.18	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-35	172.1	-70.1	-58	0	0	0	111.7	L175 I176 Y204 W211 L215	Y172-L175 HydrophobicContact CD1-CD1 4.12Å; Y172-L175 PolarHBondContact O-N 3.02Å; Y172-I176 WeakPolarHBondContact O-CD1 3.47Å; Y172-I176 VanDerWaalsContact O-CG1 3.22Å; Y172-I176 WeakPolarHBondContact O-CG1 3.39Å; Y172-I176 PolarHBondContact O-N 2.89Å; Y172-Y204 HydrophobicContact CE1-CE1 4.24Å; Y172-W211 HydrophobicContact CE1-CB 4.29Å; Y172-L215 HydrophobicContact CD1-CD2 3.78Å; Y172-L215 HydrophobicContact CD1-CG 4.04Å; Y172-L215 HydrophobicContact CG-CD2 4.31Å
173	T	96.4	Very high	88.9	Confident	20 Å²	20	42.7 Å²	42.7	12%	0.123	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-45.3	171.2	-41.5	0	0	0	0	112.1	S171 F177 N218 N222 F225 L251	S171-T173 PolarHBondContact O-N 2.7Å; T173-F177 VanDerWaalsContact O-CB 3.3Å; T173-F177 WeakPolarHBondContact O-CB 3.31Å; T173-F177 PolarHBondContact O-N 3.33Å; T173-N218 PolarHBondContact OG1-OD1 3.04Å; T173-N222 PolarHBondContact OG1-ND2 3.02Å; T173-F225 HydrophobicContact CG2-CE2 3.79Å; T173-F225 HydrophobicContact CG2-CZ 3.71Å; T173-F225 WeakPolarHBondContact O-CZ 3.01Å; T173-L251 HydrophobicContact CG2-CD2 3.89Å
174	H	95.5	Very high	90.9	Very high	38 Å²	38	41.2 Å²	41.2	18%	0.176	23%	0.23	C	C	.	.	H	α-helix	trans	-66.8	-39.8	177.6	-60.6	171.5	0	0	0	111.7	Y170 S171 F177 M178 I255	Y170-H174 HydrophobicContact CD1-CB 4.13Å; S171-H174 PolarHBondContact O-N 3.26Å; S171-H174 PolarHBondContact OG-CD2 3.33Å; S171-H174 PolarHBondContact OG-N 3.18Å; S171-H174 PolarHBondContact OG-ND1 3.04Å; S171-H174 PolarHBondContact OG-NE2 3.23Å; H174-F177 PolarHBondContact O-N 2.73Å; H174-M178 WeakPolarHBondContact O-CG 3.42Å; H174-M178 PolarHBondContact O-N 3.24Å; H174-I255 HydrophobicContact CB-CD1 4.07Å; H174-I255 HydrophobicContact CB-CG1 3.95Å
175	L	95.8	Very high	92.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-47.2	177.2	-67.2	168.6	0	0	0	112	S171 Y172 F177 M178 A179 F201 Y204	S171-L175 WeakPolarHBondContact O-CG 3.23Å; S171-L175 PolarHBondContact O-N 3.17Å; Y172-L175 HydrophobicContact CD1-CD1 4.12Å; Y172-L175 PolarHBondContact O-N 3.02Å; L175-F177 VanDerWaalsContact C-N 3.31Å; L175-F177 PolarHBondContact O-N 3.24Å; L175-M178 HydrophobicContact CD2-CE 3.98Å; L175-M178 PolarHBondContact O-N 2.93Å; L175-A179 WeakPolarHBondContact O-CB 3.4Å; L175-A179 PolarHBondContact O-N 3.13Å; L175-F201 HydrophobicContact CD2-CD2 3.68Å; L175-F201 HydrophobicContact CD2-CE2 3.34Å; L175-F201 HydrophobicContact CD2-CZ 4.09Å; L175-Y204 HydrophobicContact CD1-CE2 3.81Å; L175-Y204 VanDerWaalsContact CD1-OH 3.25Å; L175-Y204 WeakPolarHBondContact CD1-OH 3.3Å
176	I	97.4	Very high	93.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-44.2	174.9	-66.2	160.6	0	0	0	110.5	Y172 A179 I180 I193 L215 N218 L219 F225	Y172-I176 WeakPolarHBondContact O-CD1 3.47Å; Y172-I176 VanDerWaalsContact O-CG1 3.22Å; Y172-I176 WeakPolarHBondContact O-CG1 3.39Å; Y172-I176 PolarHBondContact O-N 2.89Å; I176-A179 PolarHBondContact O-N 3.32Å; I176-I180 HydrophobicContact CG2-CD1 3.73Å; I176-I180 HydrophobicContact CG2-CG1 4.4Å; I176-I180 WeakPolarHBondContact O-CG1 3.36Å; I176-I180 PolarHBondContact O-N 3Å; I176-I193 HydrophobicContact CG1-CG2 4.34Å; I176-I193 HydrophobicContact CG2-CD1 4.39Å; I176-L215 HydrophobicContact CD1-CD2 3.86Å; I176-L215 HydrophobicContact CG1-CD2 3.53Å; I176-N218 HydrophobicContact CD1-CB 3.66Å; I176-L219 HydrophobicContact CD1-CD2 4.15Å; I176-L219 HydrophobicContact CD1-CG 4.01Å; I176-L219 HydrophobicContact CG1-CD2 4.45Å; I176-L219 HydrophobicContact CG2-CD2 3.58Å; I176-F225 HydrophobicContact CB-CE1 4.08Å; I176-F225 HydrophobicContact CB-CE2 4.01Å; I176-F225 HydrophobicContact CB-CZ 3.65Å; I176-F225 HydrophobicContact CD1-CD2 4.38Å; I176-F225 HydrophobicContact CD1-CE2 3.86Å; I176-F225 HydrophobicContact CD1-CZ 4.38Å; I176-F225 HydrophobicContact CG2-CD1 3.75Å; I176-F225 HydrophobicContact CG2-CD2 4.1Å; I176-F225 HydrophobicContact CG2-CE1 3.43Å; I176-F225 VanDerWaalsContact CG2-CE1 3.43Å; I176-F225 HydrophobicContact CG2-CE2 3.79Å; I176-F225 HydrophobicContact CG2-CG 4.09Å; I176-F225 HydrophobicContact CG2-CZ 3.45Å; I176-F225 VanDerWaalsContact CG2-CZ 3.45Å
177	F	97.2	Very high	94.1	Very high	5 Å²	5	43.4 Å²	43.4	2%	0.022	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-49	179.6	177.4	-87.9	0	0	0	111.9	T173 H174 L175 A179 I180 E181 F225 V243 R248 L251 L252 I255	T173-F177 VanDerWaalsContact O-CB 3.3Å; T173-F177 WeakPolarHBondContact O-CB 3.31Å; T173-F177 PolarHBondContact O-N 3.33Å; H174-F177 PolarHBondContact O-N 2.73Å; L175-F177 VanDerWaalsContact C-N 3.31Å; L175-F177 PolarHBondContact O-N 3.24Å; F177-A179 VanDerWaalsContact C-N 3.31Å; F177-A179 PolarHBondContact O-N 3.31Å; F177-I180 PolarHBondContact O-N 3.36Å; F177-E181 HydrophobicContact CD1-CG 4.1Å; F177-E181 HydrophobicContact CD2-CG 4.5Å; F177-E181 HydrophobicContact CE1-CB 4.35Å; F177-E181 HydrophobicContact CE1-CG 3.43Å; F177-E181 VanDerWaalsContact CE1-CG 3.43Å; F177-E181 HydrophobicContact CE2-CG 3.88Å; F177-E181 HydrophobicContact CZ-CG 3.27Å; F177-E181 WeakPolarHBondContact O-CB 3.24Å; F177-E181 PolarHBondContact O-N 2.97Å; F177-F225 HydrophobicContact CB-CE1 4.47Å; F177-V243 HydrophobicContact CD2-CB 4.44Å; F177-V243 HydrophobicContact CD2-CG1 3.96Å; F177-V243 HydrophobicContact CD2-CG2 3.68Å; F177-V243 HydrophobicContact CE2-CB 4.45Å; F177-V243 HydrophobicContact CE2-CG1 3.96Å; F177-V243 HydrophobicContact CE2-CG2 3.99Å; F177-R248 HydrophobicContact CE2-CG 4.04Å; F177-R248 HydrophobicContact CZ-CG 4.35Å; F177-L251 HydrophobicContact CB-CD1 4.22Å; F177-L251 HydrophobicContact CD1-CB 4.37Å; F177-L251 HydrophobicContact CD2-CB 3.48Å; F177-L251 VanDerWaalsContact CD2-CB 3.48Å; F177-L251 HydrophobicContact CD2-CD1 3.5Å; F177-L251 VanDerWaalsContact CD2-CD1 3.5Å; F177-L251 HydrophobicContact CD2-CG 4.14Å; F177-L251 HydrophobicContact CE2-CB 3.73Å; F177-L251 HydrophobicContact CE2-CD1 4.29Å; F177-L251 HydrophobicContact CG-CB 3.84Å; F177-L251 HydrophobicContact CG-CD1 4.11Å; F177-L251 HydrophobicContact CZ-CB 4.28Å; F177-L252 HydrophobicContact CE1-CD2 3.69Å; F177-L252 HydrophobicContact CE1-CG 4.06Å; F177-L252 HydrophobicContact CZ-CD2 3.63Å; F177-L252 HydrophobicContact CZ-CG 3.59Å; F177-I255 HydrophobicContact CB-CD1 4.32Å; F177-I255 HydrophobicContact CD1-CD1 3.3Å; F177-I255 HydrophobicContact CE1-CD1 3.97Å; F177-I255 HydrophobicContact CG-CD1 4.09Å
178	M	96.3	Very high	94.5	Very high	36 Å²	36	39 Å²	39	18%	0.177	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-38.1	178	-68.3	-176.3	-66.2	0	0	111.9	Y170 H174 L175 E181 S182 W196 F201 I255	Y170-M178 HydrophobicContact CD1-CE 3.72Å; Y170-M178 HydrophobicContact CD1-SD 4.48Å; Y170-M178 HydrophobicContact CD2-CE 4.32Å; Y170-M178 HydrophobicContact CE1-CE 3.98Å; Y170-M178 HydrophobicContact CE1-SD 4.23Å; Y170-M178 HydrophobicContact CG-CE 3.92Å; H174-M178 WeakPolarHBondContact O-CG 3.42Å; H174-M178 PolarHBondContact O-N 3.24Å; L175-M178 HydrophobicContact CD2-CE 3.98Å; L175-M178 PolarHBondContact O-N 2.93Å; M178-E181 PolarHBondContact O-N 3Å; M178-S182 PolarHBondContact O-N 3.21Å; M178-W196 HydrophobicContact CB-CH2 3.37Å; M178-W196 HydrophobicContact CB-CZ2 3.77Å; M178-W196 HydrophobicContact CB-CZ3 4.15Å; M178-W196 HydrophobicContact CE-CH2 4.35Å; M178-F201 HydrophobicContact CE-CE2 4.32Å; M178-F201 HydrophobicContact CE-CZ 4.26Å; M178-I255 HydrophobicContact CG-CD1 3.84Å; M178-I255 HydrophobicContact SD-CD1 4.47Å; M178-I255 HydrophobicContact SD-CG2 4.5Å
179	A	96.8	Very high	94.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-47	174.9	0	0	0	0	0	112.7	L175 I176 F177 S182 M188 I193 W196	L175-A179 WeakPolarHBondContact O-CB 3.4Å; L175-A179 PolarHBondContact O-N 3.13Å; I176-A179 PolarHBondContact O-N 3.32Å; F177-A179 VanDerWaalsContact C-N 3.31Å; F177-A179 PolarHBondContact O-N 3.31Å; A179-S182 PolarHBondContact O-N 3.07Å; A179-S182 PolarHBondContact O-OG 2.82Å; A179-M188 HydrophobicContact CB-CE 4.36Å; A179-M188 HydrophobicContact CB-SD 3.76Å; A179-M188 WeakPolarHBondContact O-CE 3.38Å; A179-I193 HydrophobicContact CB-CG1 4.39Å; A179-I193 HydrophobicContact CB-CG2 4.39Å; A179-W196 HydrophobicContact CB-CB 4.09Å; A179-W196 HydrophobicContact CB-CD2 3.5Å; A179-W196 VanDerWaalsContact CB-CD2 3.5Å; A179-W196 HydrophobicContact CB-CE3 3.55Å; A179-W196 HydrophobicContact CB-CG 3.72Å; A179-W196 HydrophobicContact CB-CZ3 4.24Å
180	I	97	Very high	95.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-40.7	178.5	-64.1	170.1	0	0	0	110.7	I176 F177 S182 T183 K186 M188 I193 F225 W241 V243	I176-I180 HydrophobicContact CG2-CD1 3.73Å; I176-I180 HydrophobicContact CG2-CG1 4.4Å; I176-I180 WeakPolarHBondContact O-CG1 3.36Å; I176-I180 PolarHBondContact O-N 3Å; F177-I180 PolarHBondContact O-N 3.36Å; I180-S182 VanDerWaalsContact C-N 3.32Å; I180-S182 PolarHBondContact O-N 3.44Å; I180-T183 PolarHBondContact O-N 3.23Å; I180-T183 PolarHBondContact O-OG1 3.5Å; I180-K186 WeakPolarHBondContact CG2-O 3.45Å; I180-M188 HydrophobicContact CG1-CB 4.06Å; I180-I193 HydrophobicContact CG1-CD1 4.48Å; I180-F225 HydrophobicContact CD1-CD1 4.03Å; I180-F225 HydrophobicContact CD1-CE1 4.38Å; I180-W241 HydrophobicContact CD1-CB 4.28Å; I180-V243 HydrophobicContact CB-CG2 4.15Å; I180-V243 HydrophobicContact CD1-CG2 4.22Å; I180-V243 HydrophobicContact CG2-CG2 3.95Å
181	E	94.8	Very high	95.2	Very high	32 Å²	32	39.7 Å²	39.7	15%	0.15	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-27.5	177.4	-81.4	-59.4	141.8	0	0	114.1	F177 M178 T183 K186 R248	F177-E181 HydrophobicContact CD1-CG 4.1Å; F177-E181 HydrophobicContact CD2-CG 4.5Å; F177-E181 HydrophobicContact CE1-CB 4.35Å; F177-E181 HydrophobicContact CE1-CG 3.43Å; F177-E181 VanDerWaalsContact CE1-CG 3.43Å; F177-E181 HydrophobicContact CE2-CG 3.88Å; F177-E181 HydrophobicContact CZ-CG 3.27Å; F177-E181 WeakPolarHBondContact O-CB 3.24Å; F177-E181 PolarHBondContact O-N 2.97Å; M178-E181 PolarHBondContact O-N 3Å; E181-T183 PolarHBondContact O-N 2.98Å; E181-K186 PolarHBondContact O-NZ 2.98Å; E181-K186 WeakPolarHBondContact OE2-CD 3.16Å; E181-K186 WeakPolarHBondContact OE2-CE 3.47Å; E181-K186 IonicContact OE2-NZ 3.56Å; E181-K186 PolarHBondContact OE2-NZ 2.94Å; E181-R248 VanDerWaalsContact CD-NH2 3.34Å; E181-R248 IonicContact OE1-CZ 3.33Å; E181-R248 IonicContact OE1-NE 2.7Å; E181-R248 PolarHBondContact OE1-NE 3.44Å; E181-R248 IonicContact OE1-NH2 3.1Å; E181-R248 PolarHBondContact OE1-NH2 3.39Å; E181-R248 VanDerWaalsContact OE1-NH2 3.1Å; E181-R248 IonicContact OE2-CZ 3.74Å; E181-R248 IonicContact OE2-NE 3.85Å; E181-R248 IonicContact OE2-NH2 2.78Å; E181-R248 PolarHBondContact OE2-NH2 2.89Å
182	S	94.1	Very high	95.2	Very high	70 Å²	70	41.6 Å²	41.6	49%	0.49	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-5.7	176.7	91	0	0	0	0	113.4	M178 A179 I180 W196	M178-S182 PolarHBondContact O-N 3.21Å; A179-S182 PolarHBondContact O-N 3.07Å; A179-S182 PolarHBondContact O-OG 2.82Å; I180-S182 VanDerWaalsContact C-N 3.32Å; I180-S182 PolarHBondContact O-N 3.44Å; S182-W196 PolarHBondContact OG-NE1 3.07Å
183	T	94	Very high	95.2	Very high	18 Å²	18	39.5 Å²	39.5	11%	0.11	21%	0.213	C	C	.	.	S	Bend	trans	-90	141.4	173.3	68.8	0	0	0	0	111.3	I180 E181 Q185 K186 C187 M188	I180-T183 PolarHBondContact O-N 3.23Å; I180-T183 PolarHBondContact O-OG1 3.5Å; E181-T183 PolarHBondContact O-N 2.98Å; T183-Q185 VanDerWaalsContact C-N 3.31Å; T183-Q185 PolarHBondContact O-N 3.48Å; T183-K186 WeakPolarHBondContact O-CD 3.26Å; T183-K186 WeakPolarHBondContact O-CE 3.38Å; T183-K186 PolarHBondContact O-N 2.89Å; T183-K186 VanDerWaalsContact OG1-CA 3.23Å; T183-K186 WeakPolarHBondContact OG1-CA 3.39Å; T183-K186 PolarHBondContact OG1-N 3.31Å; T183-C187 PolarHBondContact OG1-N 3Å; T183-C187 PolarHBondContact OG1-O 3.41Å; T183-M188 HydrophobicContact CG2-CB 4.19Å; T183-M188 HydrophobicContact CG2-CE 3.69Å; T183-M188 HydrophobicContact CG2-CG 4.43Å
184	P	92.2	Very high	95.2	Very high	117 Å²	117	39.8 Å²	39.8	76%	0.76	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-32.5	174.3	25	-30.1	0	0	0	111.8	K186	P184-K186 PolarHBondContact O-N 3.45Å
185	Q	92.3	Very high	95.2	Very high	140 Å²	140	42.1 Å²	42.1	65%	0.654	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-7.4	176.2	-56.3	85.4	-3.8	0	0	114	T183 C187	T183-Q185 VanDerWaalsContact C-N 3.31Å; T183-Q185 PolarHBondContact O-N 3.48Å; Q185-C187 PolarHBondContact O-N 3.41Å
186	K	94.8	Very high	95.2	Very high	76 Å²	76	43.5 Å²	43.5	33%	0.33	23%	0.231	S	C	.	.	S	Bend	trans	52.4	32.5	-172.3	-52.2	-63.6	168.2	177.6	0	113.2	I180 E181 T183 P184 T242	I180-K186 WeakPolarHBondContact CG2-O 3.45Å; E181-K186 PolarHBondContact O-NZ 2.98Å; E181-K186 WeakPolarHBondContact OE2-CD 3.16Å; E181-K186 WeakPolarHBondContact OE2-CE 3.47Å; E181-K186 IonicContact OE2-NZ 3.56Å; E181-K186 PolarHBondContact OE2-NZ 2.94Å; T183-K186 WeakPolarHBondContact O-CD 3.26Å; T183-K186 WeakPolarHBondContact O-CE 3.38Å; T183-K186 PolarHBondContact O-N 2.89Å; T183-K186 VanDerWaalsContact OG1-CA 3.23Å; T183-K186 WeakPolarHBondContact OG1-CA 3.39Å; T183-K186 PolarHBondContact OG1-N 3.31Å; P184-K186 PolarHBondContact O-N 3.45Å; K186-T242 WeakPolarHBondContact O-CG2 3.1Å
187	C	93.6	Very high	95.1	Very high	25 Å²	25	43.6 Å²	43.6	17%	0.169	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	137	177	77.3	0	0	0	0	110.9	T183 Q185 F240 W241 T242	T183-C187 PolarHBondContact OG1-N 3Å; T183-C187 PolarHBondContact OG1-O 3.41Å; Q185-C187 PolarHBondContact O-N 3.41Å; C187-F240 HydrophobicContact CB-CB 4.48Å; C187-W241 CarbonylContact C-O 3.47Å; C187-W241 VanDerWaalsContact CA-O 3.3Å; C187-W241 WeakPolarHBondContact CA-O 3.44Å; C187-T242 HydrophobicContact CB-CG2 3.44Å; C187-T242 VanDerWaalsContact CB-CG2 3.44Å
188	M	94.9	Very high	94.9	Very high	12 Å²	12	45.3 Å²	45.3	6%	0.059	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	146.7	-179.3	-167.5	-179.1	-98	0	0	111.1	A179 I180 T183 Q192 I193 W196 W241	A179-M188 HydrophobicContact CB-CE 4.36Å; A179-M188 HydrophobicContact CB-SD 3.76Å; A179-M188 WeakPolarHBondContact O-CE 3.38Å; I180-M188 HydrophobicContact CG1-CB 4.06Å; T183-M188 HydrophobicContact CG2-CB 4.19Å; T183-M188 HydrophobicContact CG2-CE 3.69Å; T183-M188 HydrophobicContact CG2-CG 4.43Å; M188-Q192 HydrophobicContact CE-CB 4.28Å; M188-Q192 HydrophobicContact CG-CB 3.36Å; M188-Q192 HydrophobicContact CG-CG 4.45Å; M188-Q192 VanDerWaalsContact SD-C 3.51Å; M188-Q192 HydrophobicContact SD-CB 3.83Å; M188-I193 HydrophobicContact CB-CG1 4.13Å; M188-I193 HydrophobicContact CG-CG1 3.81Å; M188-I193 HydrophobicContact SD-CB 4.18Å; M188-I193 HydrophobicContact SD-CG1 3.47Å; M188-I193 WeakPolarHBondContact SD-CG1 3.35Å; M188-I193 PolarHBondContact SD-N 3.35Å; M188-I193 VanDerWaalsContact SD-N 3.45Å; M188-W196 HydrophobicContact CE-CB 4.12Å; M188-W196 HydrophobicContact CE-CG 4.24Å; M188-W196 HydrophobicContact SD-CB 4.31Å; M188-W241 PolarHBondContact N-O 3.11Å; M188-W241 PolarHBondContact O-N 3.35Å
189	T	95.5	Very high	94.8	Very high	13 Å²	13	47.4 Å²	47.4	8%	0.08	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	156.4	174.3	66.7	0	0	0	0	111.2	N191 Q192 I193 R230 F240	T189-N191 PolarHBondContact O-N 2.85Å; T189-N191 VanDerWaalsContact O-N 3.16Å; T189-Q192 VanDerWaalsContact CG2-OE1 3.29Å; T189-Q192 PolarHBondContact O-N 3.19Å; T189-Q192 VanDerWaalsContact OG1-CD 3.3Å; T189-Q192 WeakPolarHBondContact OG1-CG 3.46Å; T189-Q192 PolarHBondContact OG1-N 2.96Å; T189-Q192 PolarHBondContact OG1-OE1 2.83Å; T189-I193 WeakPolarHBondContact O-CG1 3.44Å; T189-I193 PolarHBondContact O-N 3.16Å; T189-R230 VanDerWaalsContact CG2-CZ 3.45Å; T189-R230 VanDerWaalsContact CG2-NH2 3.3Å; T189-F240 HydrophobicContact CG2-CD1 3.49Å; T189-F240 VanDerWaalsContact CG2-CD1 3.49Å; T189-F240 HydrophobicContact CG2-CE1 3.49Å; T189-F240 VanDerWaalsContact CG2-CE1 3.49Å; T189-F240 HydrophobicContact CG2-CG 4.43Å; T189-F240 HydrophobicContact CG2-CZ 4.44Å
190	V	95.5	Very high	94.5	Very high	35 Å²	35	51.3 Å²	51.3	21%	0.212	28%	0.279	C	S	.	.	H	α-helix	trans	-55.1	-37.5	179.4	-171.2	0	0	0	0	112.3	I193 Y194 R216 L219	V190-I193 PolarHBondContact O-N 2.97Å; V190-Y194 HydrophobicContact CG1-CE1 4.02Å; V190-Y194 HydrophobicContact CG1-CE2 4.04Å; V190-Y194 PolarHBondContact O-N 2.95Å; V190-R216 HydrophobicContact CG1-CG 4.27Å; V190-L219 HydrophobicContact CG1-CD1 4.31Å; V190-L219 HydrophobicContact CG2-CD1 4.11Å
191	N	94.2	Very high	94.4	Very high	102 Å²	102	52.9 Å²	52.9	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-69	-41.7	178.7	-158.3	70.8	0	0	0	112.3	T189 I193 Y194 N195	T189-N191 PolarHBondContact O-N 2.85Å; T189-N191 VanDerWaalsContact O-N 3.16Å; N191-I193 VanDerWaalsContact C-N 3.28Å; N191-I193 PolarHBondContact O-N 3.45Å; N191-Y194 PolarHBondContact O-N 2.93Å; N191-N195 PolarHBondContact O-N 2.73Å; N191-N195 VanDerWaalsContact O-N 3.08Å; N191-N195 PolarHBondContact O-OD1 3.37Å
192	Q	95.1	Very high	94.2	Very high	89 Å²	89	53 Å²	53	42%	0.416	29%	0.29	S	S	.	.	H	α-helix	trans	-63.9	-33.7	173.6	-73.1	163	-45.4	0	0	111.9	M188 T189 N195 W196	M188-Q192 HydrophobicContact CE-CB 4.28Å; M188-Q192 HydrophobicContact CG-CB 3.36Å; M188-Q192 HydrophobicContact CG-CG 4.45Å; M188-Q192 VanDerWaalsContact SD-C 3.51Å; M188-Q192 HydrophobicContact SD-CB 3.83Å; T189-Q192 VanDerWaalsContact CG2-OE1 3.29Å; T189-Q192 PolarHBondContact O-N 3.19Å; T189-Q192 VanDerWaalsContact OG1-CD 3.3Å; T189-Q192 WeakPolarHBondContact OG1-CG 3.46Å; T189-Q192 PolarHBondContact OG1-N 2.96Å; T189-Q192 PolarHBondContact OG1-OE1 2.83Å; Q192-N195 PolarHBondContact O-N 3.03Å; Q192-W196 VanDerWaalsContact O-CB 3.26Å; Q192-W196 WeakPolarHBondContact O-CB 3.27Å; Q192-W196 PolarHBondContact O-N 3.07Å
193	I	96.8	Very high	94.1	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-41	175	-64.6	167.4	0	0	0	110.8	I176 A179 I180 M188 T189 V190 N191 W196 C197 L215 L219	I176-I193 HydrophobicContact CG1-CG2 4.34Å; I176-I193 HydrophobicContact CG2-CD1 4.39Å; A179-I193 HydrophobicContact CB-CG1 4.39Å; A179-I193 HydrophobicContact CB-CG2 4.39Å; I180-I193 HydrophobicContact CG1-CD1 4.48Å; M188-I193 HydrophobicContact CB-CG1 4.13Å; M188-I193 HydrophobicContact CG-CG1 3.81Å; M188-I193 HydrophobicContact SD-CB 4.18Å; M188-I193 HydrophobicContact SD-CG1 3.47Å; M188-I193 WeakPolarHBondContact SD-CG1 3.35Å; M188-I193 PolarHBondContact SD-N 3.35Å; M188-I193 VanDerWaalsContact SD-N 3.45Å; T189-I193 WeakPolarHBondContact O-CG1 3.44Å; T189-I193 PolarHBondContact O-N 3.16Å; V190-I193 PolarHBondContact O-N 2.97Å; N191-I193 VanDerWaalsContact C-N 3.28Å; N191-I193 PolarHBondContact O-N 3.45Å; I193-W196 PolarHBondContact O-N 2.9Å; I193-C197 PolarHBondContact O-N 3.45Å; I193-C197 PolarHBondContact O-SG 2.82Å; I193-L215 HydrophobicContact CG2-CD1 4.4Å; I193-L219 HydrophobicContact CD1-CD1 4.12Å; I193-L219 HydrophobicContact CD1-CD2 4.16Å
194	Y	95.8	Very high	94	Very high	27 Å²	27	51.6 Å²	51.6	11%	0.106	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-52.6	173.1	-55.4	-37.8	0	0	0	111.2	V190 N191 W196 C197 E198 W211 K212 L215 R216	V190-Y194 HydrophobicContact CG1-CE1 4.02Å; V190-Y194 HydrophobicContact CG1-CE2 4.04Å; V190-Y194 PolarHBondContact O-N 2.95Å; N191-Y194 PolarHBondContact O-N 2.93Å; Y194-W196 VanDerWaalsContact C-N 3.26Å; Y194-W196 PolarHBondContact O-N 3.36Å; Y194-C197 PolarHBondContact O-N 2.84Å; Y194-C197 VanDerWaalsContact O-N 3.11Å; Y194-E198 WeakPolarHBondContact O-CG 3.25Å; Y194-E198 PolarHBondContact O-N 3.46Å; Y194-W211 HydrophobicContact CD1-CZ3 4.29Å; Y194-K212 HydrophobicContact CD1-CB 4.07Å; Y194-K212 HydrophobicContact CD1-CD 4.09Å; Y194-K212 HydrophobicContact CD1-CG 3.83Å; Y194-K212 HydrophobicContact CD2-CD 4.21Å; Y194-K212 HydrophobicContact CE1-CB 3.6Å; Y194-K212 HydrophobicContact CE1-CD 4.31Å; Y194-K212 HydrophobicContact CE1-CG 3.91Å; Y194-K212 HydrophobicContact CE2-CD 4.42Å; Y194-K212 HydrophobicContact CG-CD 4.05Å; Y194-K212 HydrophobicContact CG-CG 4.3Å; Y194-L215 HydrophobicContact CD1-CD1 4.05Å; Y194-L215 HydrophobicContact CE1-CD1 4.4Å; Y194-R216 WeakPolarHBondContact OH-CD 3.33Å; Y194-R216 WeakPolarHBondContact OH-CG 3.3Å; Y194-R216 PolarHBondContact OH-NH1 2.83Å
195	N	95.4	Very high	93.9	Very high	86 Å²	86	52 Å²	52	46%	0.46	26%	0.263	S	S	.	.	H	α-helix	trans	-59.4	-36.8	-179.2	-66.3	23.6	0	0	0	111.9	N191 Q192 E198 S199	N191-N195 PolarHBondContact O-N 2.73Å; N191-N195 VanDerWaalsContact O-N 3.08Å; N191-N195 PolarHBondContact O-OD1 3.37Å; Q192-N195 PolarHBondContact O-N 3.03Å; N195-E198 PolarHBondContact O-N 3.4Å; N195-S199 WeakPolarHBondContact O-CB 3.47Å; N195-S199 PolarHBondContact O-N 3.4Å; N195-S199 PolarHBondContact O-OG 2.75Å
196	W	96.3	Very high	93.7	Very high	30 Å²	30	52.6 Å²	52.6	11%	0.114	27%	0.265	C	S	.	.	H	α-helix	trans	-67.8	-42.5	176	-174.1	99.9	0	0	0	112.1	M178 A179 S182 M188 Q192 I193 Y194 E198 S199 N200 F201	M178-W196 HydrophobicContact CB-CH2 3.37Å; M178-W196 HydrophobicContact CB-CZ2 3.77Å; M178-W196 HydrophobicContact CB-CZ3 4.15Å; M178-W196 HydrophobicContact CE-CH2 4.35Å; A179-W196 HydrophobicContact CB-CB 4.09Å; A179-W196 HydrophobicContact CB-CD2 3.5Å; A179-W196 VanDerWaalsContact CB-CD2 3.5Å; A179-W196 HydrophobicContact CB-CE3 3.55Å; A179-W196 HydrophobicContact CB-CG 3.72Å; A179-W196 HydrophobicContact CB-CZ3 4.24Å; S182-W196 PolarHBondContact OG-NE1 3.07Å; M188-W196 HydrophobicContact CE-CB 4.12Å; M188-W196 HydrophobicContact CE-CG 4.24Å; M188-W196 HydrophobicContact SD-CB 4.31Å; Q192-W196 VanDerWaalsContact O-CB 3.26Å; Q192-W196 WeakPolarHBondContact O-CB 3.27Å; Q192-W196 PolarHBondContact O-N 3.07Å; I193-W196 PolarHBondContact O-N 2.9Å; Y194-W196 VanDerWaalsContact C-N 3.26Å; Y194-W196 PolarHBondContact O-N 3.36Å; W196-E198 VanDerWaalsContact C-N 3.31Å; W196-E198 PolarHBondContact O-N 2.97Å; W196-S199 PolarHBondContact O-N 3.16Å; W196-S199 PolarHBondContact O-OG 2.81Å; W196-N200 HydrophobicContact CH2-CB 4.28Å; W196-N200 HydrophobicContact CZ2-CB 4.36Å; W196-N200 HydrophobicContact CZ3-CB 4.4Å; W196-N200 PolarHBondContact NE1-ND2 2.82Å; W196-N200 WeakPolarHBondContact O-CB 3.18Å; W196-N200 PolarHBondContact O-N 3.37Å; W196-N200 PolarHBondContact O-ND2 3.36Å; W196-F201 AromaticContact CH2-CE2 3.92Å; W196-F201 HydrophobicContact CH2-CE2 3.92Å; W196-F201 HydrophobicContact CZ3-CD2 4.28Å; W196-F201 AromaticContact CZ3-CE2 3.81Å; W196-F201 HydrophobicContact CZ3-CE2 3.81Å
197	C	94.9	Very high	93.3	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-63.4	-40.5	175	-66.7	0	0	0	0	111.1	I193 Y194 F201 Y204 W211	I193-C197 PolarHBondContact O-N 3.45Å; I193-C197 PolarHBondContact O-SG 2.82Å; Y194-C197 PolarHBondContact O-N 2.84Å; Y194-C197 VanDerWaalsContact O-N 3.11Å; C197-F201 WeakPolarHBondContact O-CB 3.39Å; C197-F201 PolarHBondContact O-N 3.09Å; C197-Y204 HydrophobicContact CB-CD2 4.15Å; C197-Y204 HydrophobicContact CB-CG 4.45Å; C197-W211 HydrophobicContact CB-CH2 4.06Å; C197-W211 HydrophobicContact CB-CZ3 3.75Å
198	E	93.5	Very high	93	Very high	42 Å²	42	51.9 Å²	51.9	20%	0.196	28%	0.281	C	S	.	.	H	α-helix	trans	-69.3	-35.3	177.7	-76.1	164.3	-147.5	0	0	113.3	Y194 N195 W196 K205 W211 K212	Y194-E198 WeakPolarHBondContact O-CG 3.25Å; Y194-E198 PolarHBondContact O-N 3.46Å; N195-E198 PolarHBondContact O-N 3.4Å; W196-E198 VanDerWaalsContact C-N 3.31Å; W196-E198 PolarHBondContact O-N 2.97Å; E198-K205 HydrophobicContact CB-CG 3.97Å; E198-K205 HydrophobicContact CG-CG 4.24Å; E198-K205 WeakPolarHBondContact O-CE 3.38Å; E198-K205 WeakPolarHBondContact O-CG 3.3Å; E198-W211 HydrophobicContact CG-CH2 3.83Å; E198-W211 HydrophobicContact CG-CZ2 3.83Å; E198-W211 WeakPolarHBondContact OE1-CH2 3.04Å; E198-W211 VanDerWaalsContact OE1-CZ2 3.29Å; E198-W211 WeakPolarHBondContact OE1-CZ2 3.44Å; E198-K212 WeakPolarHBondContact OE1-CE 3.43Å; E198-K212 IonicContact OE1-NZ 3.16Å; E198-K212 PolarHBondContact OE1-NZ 3.11Å
199	S	92.7	Very high	92.5	Very high	80 Å²	80	56.6 Å²	56.6	56%	0.559	31%	0.311	S	S	*	.	H	α-helix	trans	-77.9	-40.8	179.3	65.2	0	0	0	0	113.2	N195 W196	N195-S199 WeakPolarHBondContact O-CB 3.47Å; N195-S199 PolarHBondContact O-N 3.4Å; N195-S199 PolarHBondContact O-OG 2.75Å; W196-S199 PolarHBondContact O-N 3.16Å; W196-S199 PolarHBondContact O-OG 2.81Å
200	N	91.7	Very high	92.4	Very high	81 Å²	81	58.3 Å²	58.3	43%	0.433	33%	0.33	S	S	.	.	H	α-helix	trans	-82.7	-26.7	-177.8	-70	-97.7	0	0	0	112.9	W196	W196-N200 HydrophobicContact CH2-CB 4.28Å; W196-N200 HydrophobicContact CZ2-CB 4.36Å; W196-N200 HydrophobicContact CZ3-CB 4.4Å; W196-N200 PolarHBondContact NE1-ND2 2.82Å; W196-N200 WeakPolarHBondContact O-CB 3.18Å; W196-N200 PolarHBondContact O-N 3.37Å; W196-N200 PolarHBondContact O-ND2 3.36Å
201	F	93.5	Very high	92.3	Very high	34 Å²	34	57.1 Å²	57.1	15%	0.149	32%	0.322	C	S	.	.			trans	-135.9	89.6	-175	-59.4	-70.2	0	0	0	110.8	P168 Y170 L175 M178 W196 C197 F203 Y204	P168-F201 HydrophobicContact CB-CD1 3.83Å; P168-F201 HydrophobicContact CB-CE1 4.01Å; P168-F201 HydrophobicContact CB-CG 4.3Å; P168-F201 HydrophobicContact CG-CB 3.63Å; P168-F201 HydrophobicContact CG-CD1 3.33Å; P168-F201 HydrophobicContact CG-CD2 4.35Å; P168-F201 HydrophobicContact CG-CE1 4.04Å; P168-F201 HydrophobicContact CG-CG 3.51Å; Y170-F201 HydrophobicContact CD2-CE1 4.39Å; Y170-F201 HydrophobicContact CD2-CZ 4.18Å; Y170-F201 HydrophobicContact CE2-CE1 4.18Å; Y170-F201 HydrophobicContact CE2-CZ 4.09Å; L175-F201 HydrophobicContact CD2-CD2 3.68Å; L175-F201 HydrophobicContact CD2-CE2 3.34Å; L175-F201 HydrophobicContact CD2-CZ 4.09Å; M178-F201 HydrophobicContact CE-CE2 4.32Å; M178-F201 HydrophobicContact CE-CZ 4.26Å; W196-F201 AromaticContact CH2-CE2 3.92Å; W196-F201 HydrophobicContact CH2-CE2 3.92Å; W196-F201 HydrophobicContact CZ3-CD2 4.28Å; W196-F201 AromaticContact CZ3-CE2 3.81Å; W196-F201 HydrophobicContact CZ3-CE2 3.81Å; C197-F201 WeakPolarHBondContact O-CB 3.39Å; C197-F201 PolarHBondContact O-N 3.09Å; F201-F203 PolarHBondContact O-N 3.4Å; F201-Y204 HydrophobicContact CB-CD2 3.83Å; F201-Y204 HydrophobicContact CB-CE2 4.21Å; F201-Y204 PolarHBondContact O-N 3.26Å
202	P	90.9	Very high	92.4	Very high	35 Å²	35	54.9 Å²	54.9	23%	0.227	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-27.6	-171.7	-30.6	36.9	0	0	0	115.9	L165 Y204 K205	L165-P202 HydrophobicContact CD2-CB 4.4Å; P202-Y204 PolarHBondContact O-N 3.31Å; P202-Y204 VanDerWaalsContact O-N 3.12Å; P202-K205 WeakPolarHBondContact O-CB 3.34Å; P202-K205 PolarHBondContact O-N 3.08Å
203	F	92.1	Very high	92.4	Very high	54 Å²	54	55 Å²	55	24%	0.237	31%	0.311	C	S	.	.	H	α-helix	trans	-42.8	-42	168	170.9	-102.6	0	0	0	113.6	L165 T166 K167 F201 K205 H206 A207	L165-F203 WeakPolarHBondContact O-CD2 3.43Å; T166-F203 WeakPolarHBondContact O-CB 3.38Å; K167-F203 HydrophobicContact CB-CD1 4.07Å; K167-F203 HydrophobicContact CB-CD2 4.37Å; K167-F203 HydrophobicContact CB-CE1 3.76Å; K167-F203 HydrophobicContact CB-CE2 4.07Å; K167-F203 HydrophobicContact CB-CG 4.37Å; K167-F203 HydrophobicContact CB-CZ 3.76Å; K167-F203 HydrophobicContact CD-CE1 4.16Å; K167-F203 HydrophobicContact CD-CZ 4.32Å; K167-F203 HydrophobicContact CG-CD1 4.1Å; K167-F203 HydrophobicContact CG-CE1 3.65Å; K167-F203 HydrophobicContact CG-CZ 4.04Å; F201-F203 PolarHBondContact O-N 3.4Å; F203-K205 VanDerWaalsContact C-N 3.29Å; F203-K205 PolarHBondContact O-N 3.33Å; F203-H206 PolarHBondContact O-N 2.8Å; F203-A207 HydrophobicContact CD1-CB 4.48Å; F203-A207 HydrophobicContact CE1-CB 4.04Å; F203-A207 HydrophobicContact CZ-CB 4.1Å; F203-A207 WeakPolarHBondContact O-CB 3.4Å; F203-A207 PolarHBondContact O-N 3.26Å
204	Y	92.7	Very high	92.4	Very high	3 Å²	3	56.9 Å²	56.9	1%	0.012	33%	0.325	C	S	.	.	H	α-helix	trans	-72.6	-17.6	-177	-71.7	-62.1	0	0	0	114.4	P168 Y172 L175 C197 F201 P202 H206 A207 W211	P168-Y204 HydrophobicContact CG-CE2 4.11Å; Y172-Y204 HydrophobicContact CE1-CE1 4.24Å; L175-Y204 HydrophobicContact CD1-CE2 3.81Å; L175-Y204 VanDerWaalsContact CD1-OH 3.25Å; L175-Y204 WeakPolarHBondContact CD1-OH 3.3Å; C197-Y204 HydrophobicContact CB-CD2 4.15Å; C197-Y204 HydrophobicContact CB-CG 4.45Å; F201-Y204 HydrophobicContact CB-CD2 3.83Å; F201-Y204 HydrophobicContact CB-CE2 4.21Å; F201-Y204 PolarHBondContact O-N 3.26Å; P202-Y204 PolarHBondContact O-N 3.31Å; P202-Y204 VanDerWaalsContact O-N 3.12Å; Y204-H206 VanDerWaalsContact C-N 3.31Å; Y204-A207 HydrophobicContact CD1-CB 4.38Å; Y204-W211 HydrophobicContact CD1-CB 4.18Å; Y204-W211 AromaticContact CD1-CD2 3.46Å; Y204-W211 HydrophobicContact CD1-CD2 3.46Å; Y204-W211 VanDerWaalsContact CD1-CD2 3.46Å; Y204-W211 AromaticContact CD1-CE2 3.84Å; Y204-W211 AromaticContact CD1-CE3 3.7Å; Y204-W211 HydrophobicContact CD1-CE3 3.7Å; Y204-W211 AromaticContact CD1-CG 3.67Å; Y204-W211 HydrophobicContact CD1-CG 3.67Å; Y204-W211 HydrophobicContact CD1-CZ2 4.41Å; Y204-W211 HydrophobicContact CD1-CZ3 4.28Å; Y204-W211 HydrophobicContact CE1-CB 4.1Å; Y204-W211 HydrophobicContact CE1-CD2 4.15Å; Y204-W211 HydrophobicContact CE1-CE3 4.22Å; Y204-W211 HydrophobicContact CE1-CG 4.1Å; Y204-W211 HydrophobicContact CG-CD2 4.2Å; Y204-W211 HydrophobicContact CG-CE3 4.22Å; Y204-W211 HydrophobicContact CG-CH2 4.46Å; Y204-W211 HydrophobicContact CG-CZ2 4.42Å; Y204-W211 HydrophobicContact CG-CZ3 4.34Å; Y204-W211 WeakPolarHBondContact O-CZ2 3.29Å; Y204-W211 PolarHBondContact O-NE1 3.11Å
205	K	90.5	Very high	92.4	Very high	127 Å²	127	55.7 Å²	55.7	55%	0.552	32%	0.32	S	S	*	.	H	α-helix	trans	-66.2	-35.1	172	-60.8	-175.2	-178	-175	0	112.2	E198 P202 F203	E198-K205 HydrophobicContact CB-CG 3.97Å; E198-K205 HydrophobicContact CG-CG 4.24Å; E198-K205 WeakPolarHBondContact O-CE 3.38Å; E198-K205 WeakPolarHBondContact O-CG 3.3Å; P202-K205 WeakPolarHBondContact O-CB 3.34Å; P202-K205 PolarHBondContact O-N 3.08Å; F203-K205 VanDerWaalsContact C-N 3.29Å; F203-K205 PolarHBondContact O-N 3.33Å
206	H	87.7	Confident	92.4	Very high	151 Å²	151	56.4 Å²	56.4	70%	0.699	32%	0.316	S	S	*	.	H	α-helix	trans	-103.3	-10.2	-176.7	-55.9	-69.1	0	0	0	113.2	F203 Y204	F203-H206 PolarHBondContact O-N 2.8Å; Y204-H206 VanDerWaalsContact C-N 3.31Å
207	A	86.2	Confident	92.4	Very high	26 Å²	26	59.8 Å²	59.8	22%	0.215	33%	0.333	C	S	.	.	S	Bend	trans	-73.7	128.1	172.4	0	0	0	0	0	111	F203 Y204 W211	F203-A207 HydrophobicContact CD1-CB 4.48Å; F203-A207 HydrophobicContact CE1-CB 4.04Å; F203-A207 HydrophobicContact CZ-CB 4.1Å; F203-A207 WeakPolarHBondContact O-CB 3.4Å; F203-A207 PolarHBondContact O-N 3.26Å; Y204-A207 HydrophobicContact CD1-CB 4.38Å; A207-W211 VanDerWaalsContact CB-CD1 3.43Å; A207-W211 HydrophobicContact CB-CG 4.37Å; A207-W211 PolarHBondContact O-NE1 3.25Å
208	G	86.4	Confident	92.5	Very high	60 Å²	60	61 Å²	61	62%	0.619	34%	0.339	S	S	*	.			trans	-63.2	162.5	-179.9	0	0	0	0	0	114.5	G210 W211	G208-G210 PolarHBondContact O-N 3.49Å; G208-W211 PolarHBondContact O-N 3.23Å
209	V	85.7	Confident	92.6	Very high	112 Å²	112	59.1 Å²	59.1	68%	0.679	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-21.8	-164.2	-171.4	0	0	0	0	115.9	W211 K212 N213	V209-W211 VanDerWaalsContact C-N 3.3Å; V209-W211 PolarHBondContact O-N 3.37Å; V209-K212 WeakPolarHBondContact O-CB 3.49Å; V209-K212 PolarHBondContact O-N 3.18Å; V209-N213 PolarHBondContact O-N 2.8Å
210	G	92	Very high	92.8	Very high	48 Å²	48	59.7 Å²	59.7	50%	0.495	33%	0.334	S	S	.	.	H	α-helix	trans	-51	-37.9	177.5	0	0	0	0	0	115.3	G208 K212 N213 S214	G208-G210 PolarHBondContact O-N 3.49Å; G210-K212 VanDerWaalsContact C-N 3.32Å; G210-K212 PolarHBondContact O-N 2.9Å; G210-N213 WeakPolarHBondContact O-CA 3.41Å; G210-N213 WeakPolarHBondContact O-CB 3.24Å; G210-N213 PolarHBondContact O-N 3.28Å; G210-S214 PolarHBondContact O-N 3.15Å; G210-S214 PolarHBondContact O-OG 2.97Å
211	W	95	Very high	92.9	Very high	11 Å²	11	60.6 Å²	60.6	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-66.5	-33.6	178.3	70.8	-94.4	0	0	0	112.7	Y172 Y194 C197 E198 Y204 A207 G208 V209 N213 S214 L215	Y172-W211 HydrophobicContact CE1-CB 4.29Å; Y194-W211 HydrophobicContact CD1-CZ3 4.29Å; C197-W211 HydrophobicContact CB-CH2 4.06Å; C197-W211 HydrophobicContact CB-CZ3 3.75Å; E198-W211 HydrophobicContact CG-CH2 3.83Å; E198-W211 HydrophobicContact CG-CZ2 3.83Å; E198-W211 WeakPolarHBondContact OE1-CH2 3.04Å; E198-W211 VanDerWaalsContact OE1-CZ2 3.29Å; E198-W211 WeakPolarHBondContact OE1-CZ2 3.44Å; Y204-W211 HydrophobicContact CD1-CB 4.18Å; Y204-W211 AromaticContact CD1-CD2 3.46Å; Y204-W211 HydrophobicContact CD1-CD2 3.46Å; Y204-W211 VanDerWaalsContact CD1-CD2 3.46Å; Y204-W211 AromaticContact CD1-CE2 3.84Å; Y204-W211 AromaticContact CD1-CE3 3.7Å; Y204-W211 HydrophobicContact CD1-CE3 3.7Å; Y204-W211 AromaticContact CD1-CG 3.67Å; Y204-W211 HydrophobicContact CD1-CG 3.67Å; Y204-W211 HydrophobicContact CD1-CZ2 4.41Å; Y204-W211 HydrophobicContact CD1-CZ3 4.28Å; Y204-W211 HydrophobicContact CE1-CB 4.1Å; Y204-W211 HydrophobicContact CE1-CD2 4.15Å; Y204-W211 HydrophobicContact CE1-CE3 4.22Å; Y204-W211 HydrophobicContact CE1-CG 4.1Å; Y204-W211 HydrophobicContact CG-CD2 4.2Å; Y204-W211 HydrophobicContact CG-CE3 4.22Å; Y204-W211 HydrophobicContact CG-CH2 4.46Å; Y204-W211 HydrophobicContact CG-CZ2 4.42Å; Y204-W211 HydrophobicContact CG-CZ3 4.34Å; Y204-W211 WeakPolarHBondContact O-CZ2 3.29Å; Y204-W211 PolarHBondContact O-NE1 3.11Å; A207-W211 VanDerWaalsContact CB-CD1 3.43Å; A207-W211 HydrophobicContact CB-CG 4.37Å; A207-W211 PolarHBondContact O-NE1 3.25Å; G208-W211 PolarHBondContact O-N 3.23Å; V209-W211 VanDerWaalsContact C-N 3.3Å; V209-W211 PolarHBondContact O-N 3.37Å; W211-N213 PolarHBondContact O-N 2.84Å; W211-S214 PolarHBondContact O-N 3.26Å; W211-L215 HydrophobicContact CE3-CD1 3.43Å; W211-L215 VanDerWaalsContact CE3-CD1 3.43Å; W211-L215 HydrophobicContact CE3-CG 4.25Å; W211-L215 HydrophobicContact CZ3-CD1 3.33Å; W211-L215 PolarHBondContact O-N 2.91Å
212	K	95.5	Very high	92.9	Very high	54 Å²	54	60.9 Å²	60.9	24%	0.235	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-30.8	173.4	-61.2	-170.9	178.5	-174.4	0	111	Y194 E198 V209 G210 R216	Y194-K212 HydrophobicContact CD1-CB 4.07Å; Y194-K212 HydrophobicContact CD1-CD 4.09Å; Y194-K212 HydrophobicContact CD1-CG 3.83Å; Y194-K212 HydrophobicContact CD2-CD 4.21Å; Y194-K212 HydrophobicContact CE1-CB 3.6Å; Y194-K212 HydrophobicContact CE1-CD 4.31Å; Y194-K212 HydrophobicContact CE1-CG 3.91Å; Y194-K212 HydrophobicContact CE2-CD 4.42Å; Y194-K212 HydrophobicContact CG-CD 4.05Å; Y194-K212 HydrophobicContact CG-CG 4.3Å; E198-K212 WeakPolarHBondContact OE1-CE 3.43Å; E198-K212 IonicContact OE1-NZ 3.16Å; E198-K212 PolarHBondContact OE1-NZ 3.11Å; V209-K212 WeakPolarHBondContact O-CB 3.49Å; V209-K212 PolarHBondContact O-N 3.18Å; G210-K212 VanDerWaalsContact C-N 3.32Å; G210-K212 PolarHBondContact O-N 2.9Å; K212-R216 WeakPolarHBondContact O-CG 3.38Å; K212-R216 PolarHBondContact O-N 3.13Å; K212-R216 PolarHBondContact O-NH1 2.66Å
213	N	95.6	Very high	93.1	Very high	91 Å²	91	67.3 Å²	67.3	49%	0.487	37%	0.366	S	S	.	.	H	α-helix	trans	-71.3	-44.3	171.4	-156.6	37	0	0	0	112	V209 G210 W211 L215 R216 H217	V209-N213 PolarHBondContact O-N 2.8Å; G210-N213 WeakPolarHBondContact O-CA 3.41Å; G210-N213 WeakPolarHBondContact O-CB 3.24Å; G210-N213 PolarHBondContact O-N 3.28Å; W211-N213 PolarHBondContact O-N 2.84Å; N213-L215 VanDerWaalsContact C-N 3.28Å; N213-L215 PolarHBondContact O-N 2.96Å; N213-R216 PolarHBondContact O-N 2.9Å; N213-R216 VanDerWaalsContact O-N 3.16Å; N213-R216 PolarHBondContact OD1-NE 2.9Å; N213-R216 PolarHBondContact OD1-NH2 2.75Å; N213-H217 PolarHBondContact O-N 2.81Å
214	S	95.7	Very high	93.2	Very high	42 Å²	42	65 Å²	65	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-58.1	-38.5	175.3	-51.7	0	0	0	0	112.6	G210 W211 N218	G210-S214 PolarHBondContact O-N 3.15Å; G210-S214 PolarHBondContact O-OG 2.97Å; W211-S214 PolarHBondContact O-N 3.26Å; S214-N218 WeakPolarHBondContact O-CB 3.42Å; S214-N218 PolarHBondContact O-N 3.32Å; S214-N218 PolarHBondContact O-ND2 3.45Å
215	L	95.9	Very high	93.4	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-64.1	-45.4	174	-77.6	174.8	0	0	0	112.8	Y172 I176 I193 Y194 W211 N213 H217 N218 L219	Y172-L215 HydrophobicContact CD1-CD2 3.78Å; Y172-L215 HydrophobicContact CD1-CG 4.04Å; Y172-L215 HydrophobicContact CG-CD2 4.31Å; I176-L215 HydrophobicContact CD1-CD2 3.86Å; I176-L215 HydrophobicContact CG1-CD2 3.53Å; I193-L215 HydrophobicContact CG2-CD1 4.4Å; Y194-L215 HydrophobicContact CD1-CD1 4.05Å; Y194-L215 HydrophobicContact CE1-CD1 4.4Å; W211-L215 HydrophobicContact CE3-CD1 3.43Å; W211-L215 VanDerWaalsContact CE3-CD1 3.43Å; W211-L215 HydrophobicContact CE3-CG 4.25Å; W211-L215 HydrophobicContact CZ3-CD1 3.33Å; W211-L215 PolarHBondContact O-N 2.91Å; N213-L215 VanDerWaalsContact C-N 3.28Å; N213-L215 PolarHBondContact O-N 2.96Å; L215-H217 PolarHBondContact O-N 3.16Å; L215-N218 PolarHBondContact O-N 3.02Å; L215-N218 VanDerWaalsContact O-N 3.17Å; L215-L219 PolarHBondContact O-N 3.02Å
216	R	96.2	Very high	93.7	Very high	102 Å²	102	65.2 Å²	65.2	39%	0.385	36%	0.358	S	S	.	.	H	α-helix	trans	-59.8	-45.6	176.6	-71.5	-174.2	-59	-97.7	13.2	111.9	V190 Y194 K212 N213 N218 L219 S220	V190-R216 HydrophobicContact CG1-CG 4.27Å; Y194-R216 WeakPolarHBondContact OH-CD 3.33Å; Y194-R216 WeakPolarHBondContact OH-CG 3.3Å; Y194-R216 PolarHBondContact OH-NH1 2.83Å; K212-R216 WeakPolarHBondContact O-CG 3.38Å; K212-R216 PolarHBondContact O-N 3.13Å; K212-R216 PolarHBondContact O-NH1 2.66Å; N213-R216 PolarHBondContact O-N 2.9Å; N213-R216 VanDerWaalsContact O-N 3.16Å; N213-R216 PolarHBondContact OD1-NE 2.9Å; N213-R216 PolarHBondContact OD1-NH2 2.75Å; R216-N218 VanDerWaalsContact C-N 3.32Å; R216-N218 PolarHBondContact O-N 3.07Å; R216-L219 WeakPolarHBondContact O-CB 3.43Å; R216-L219 PolarHBondContact O-N 3.49Å; R216-S220 PolarHBondContact O-N 2.94Å; R216-S220 PolarHBondContact O-OG 3.24Å
217	H	96.3	Very high	94	Very high	100 Å²	100	66.7 Å²	66.7	46%	0.463	36%	0.357	S	S	.	.	H	α-helix	trans	-59.1	-43.3	174	170.2	87.8	0	0	0	111.6	N213 L215 L219 S220 I221	N213-H217 PolarHBondContact O-N 2.81Å; L215-H217 PolarHBondContact O-N 3.16Å; H217-L219 VanDerWaalsContact C-N 3.32Å; H217-L219 PolarHBondContact O-N 3.03Å; H217-S220 PolarHBondContact O-N 3.16Å; H217-S220 VanDerWaalsContact O-N 3.16Å; H217-S220 PolarHBondContact O-OG 2.83Å; H217-S220 VanDerWaalsContact O-OG 3.05Å; H217-I221 VanDerWaalsContact O-CG2 3.27Å; H217-I221 WeakPolarHBondContact O-CG2 3.49Å; H217-I221 PolarHBondContact O-N 3.03Å
218	N	96.9	Very high	94.3	Very high	26 Å²	26	68.2 Å²	68.2	14%	0.139	36%	0.361	C	S	.	.	H	α-helix	trans	-65.4	-32.1	177	-87	-95	0	0	0	113.2	T173 I176 S214 L215 R216 N222	T173-N218 PolarHBondContact OG1-OD1 3.04Å; I176-N218 HydrophobicContact CD1-CB 3.66Å; S214-N218 WeakPolarHBondContact O-CB 3.42Å; S214-N218 PolarHBondContact O-N 3.32Å; S214-N218 PolarHBondContact O-ND2 3.45Å; L215-N218 PolarHBondContact O-N 3.02Å; L215-N218 VanDerWaalsContact O-N 3.17Å; R216-N218 VanDerWaalsContact C-N 3.32Å; R216-N218 PolarHBondContact O-N 3.07Å; N218-N222 WeakPolarHBondContact O-CB 3.16Å; N218-N222 PolarHBondContact O-N 3.05Å; N218-N222 PolarHBondContact O-ND2 3.34Å; N218-N222 PolarHBondContact OD1-ND2 3.41Å
219	L	96.3	Very high	94.3	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-67.3	-34.2	172.3	-73.9	168.4	0	0	0	112.6	I176 V190 I193 L215 R216 H217 F225 W241	I176-L219 HydrophobicContact CD1-CD2 4.15Å; I176-L219 HydrophobicContact CD1-CG 4.01Å; I176-L219 HydrophobicContact CG1-CD2 4.45Å; I176-L219 HydrophobicContact CG2-CD2 3.58Å; V190-L219 HydrophobicContact CG1-CD1 4.31Å; V190-L219 HydrophobicContact CG2-CD1 4.11Å; I193-L219 HydrophobicContact CD1-CD1 4.12Å; I193-L219 HydrophobicContact CD1-CD2 4.16Å; L215-L219 PolarHBondContact O-N 3.02Å; R216-L219 WeakPolarHBondContact O-CB 3.43Å; R216-L219 PolarHBondContact O-N 3.49Å; H217-L219 VanDerWaalsContact C-N 3.32Å; H217-L219 PolarHBondContact O-N 3.03Å; L219-F225 HydrophobicContact CD2-CB 4.12Å; L219-F225 HydrophobicContact CD2-CD2 4.2Å; L219-F225 HydrophobicContact CD2-CG 4.09Å; L219-W241 HydrophobicContact CB-CD2 4.28Å; L219-W241 HydrophobicContact CB-CE3 4.22Å; L219-W241 HydrophobicContact CB-CH2 3.96Å; L219-W241 HydrophobicContact CB-CZ2 4.04Å; L219-W241 HydrophobicContact CB-CZ3 4.07Å; L219-W241 HydrophobicContact CD1-CD2 4.39Å; L219-W241 HydrophobicContact CD1-CG 4.42Å; L219-W241 HydrophobicContact CD2-CB 4.19Å; L219-W241 HydrophobicContact CD2-CD2 3.87Å; L219-W241 HydrophobicContact CD2-CE3 4Å; L219-W241 HydrophobicContact CD2-CG 3.96Å; L219-W241 HydrophobicContact CG-CD2 4.42Å; L219-W241 WeakPolarHBondContact O-CH2 3.46Å; L219-W241 WeakPolarHBondContact O-CZ3 2.95Å
220	S	95.1	Very high	94.1	Very high	92 Å²	92	69.5 Å²	69.5	64%	0.643	35%	0.351	S	S	*	.	H	α-helix	trans	-87	-29.4	-179.2	55	0	0	0	0	114.8	R216 H217	R216-S220 PolarHBondContact O-N 2.94Å; R216-S220 PolarHBondContact O-OG 3.24Å; H217-S220 PolarHBondContact O-N 3.16Å; H217-S220 VanDerWaalsContact O-N 3.16Å; H217-S220 PolarHBondContact O-OG 2.83Å; H217-S220 VanDerWaalsContact O-OG 3.05Å
221	I	95.5	Very high	93.4	Very high	101 Å²	101	73.9 Å²	73.9	52%	0.518	36%	0.362	S	S	.	.	H	α-helix	trans	-89.6	-34.3	-176.2	-160.1	171.5	0	0	0	113.8	H217 K223	H217-I221 VanDerWaalsContact O-CG2 3.27Å; H217-I221 WeakPolarHBondContact O-CG2 3.49Å; H217-I221 PolarHBondContact O-N 3.03Å; I221-K223 PolarHBondContact O-N 2.95Å
222	N	93.9	Very high	92	Very high	40 Å²	40	79.4 Å²	79.4	21%	0.214	40%	0.403	C	S	.	.			trans	-83.8	117.4	-176.9	-64.5	-68.5	0	0	0	110.4	T173 N218 S224 F225	T173-N222 PolarHBondContact OG1-ND2 3.02Å; N218-N222 WeakPolarHBondContact O-CB 3.16Å; N218-N222 PolarHBondContact O-N 3.05Å; N218-N222 PolarHBondContact O-ND2 3.34Å; N218-N222 PolarHBondContact OD1-ND2 3.41Å; N222-S224 PolarHBondContact O-N 3.45Å; N222-F225 HydrophobicContact CB-CD2 3.87Å; N222-F225 HydrophobicContact CB-CE2 3.99Å; N222-F225 PolarHBondContact O-N 3.35Å
223	K	93.9	Very high	90.5	Very high	169 Å²	169	88.3 Å²	88.3	74%	0.735	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.5	176.9	-66.5	169.1	-174.3	164.8	0	112.9	I221 F225	I221-K223 PolarHBondContact O-N 2.95Å; K223-F225 PolarHBondContact O-N 3.06Å; K223-F225 VanDerWaalsContact O-N 3.09Å
224	S	95	Very high	89.1	Confident	7 Å²	7	86.3 Å²	86.3	5%	0.049	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-24	172.4	-23.7	0	0	0	0	114.3	N222 V243 E244 E247	N222-S224 PolarHBondContact O-N 3.45Å; S224-V243 CarbonylContact O-C 3.5Å; S224-V243 VanDerWaalsContact O-CA 3.24Å; S224-V243 WeakPolarHBondContact O-CA 3.43Å; S224-E244 PolarHBondContact O-N 3.02Å; S224-E247 VanDerWaalsContact CA-OE2 3.27Å; S224-E247 WeakPolarHBondContact CA-OE2 3.27Å; S224-E247 WeakPolarHBondContact CB-OE2 3.48Å; S224-E247 PolarHBondContact N-OE2 3.42Å; S224-E247 PolarHBondContact OG-OE2 3.03Å
225	F	97.3	Very high	87.8	Confident	12 Å²	12	91.3 Å²	91.3	5%	0.053	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.4	-177.9	-52.7	-53.7	0	0	0	112.2	T173 I176 F177 I180 L219 N222 K223 W241 T242 V243 L251	T173-F225 HydrophobicContact CG2-CE2 3.79Å; T173-F225 HydrophobicContact CG2-CZ 3.71Å; T173-F225 WeakPolarHBondContact O-CZ 3.01Å; I176-F225 HydrophobicContact CB-CE1 4.08Å; I176-F225 HydrophobicContact CB-CE2 4.01Å; I176-F225 HydrophobicContact CB-CZ 3.65Å; I176-F225 HydrophobicContact CD1-CD2 4.38Å; I176-F225 HydrophobicContact CD1-CE2 3.86Å; I176-F225 HydrophobicContact CD1-CZ 4.38Å; I176-F225 HydrophobicContact CG2-CD1 3.75Å; I176-F225 HydrophobicContact CG2-CD2 4.1Å; I176-F225 HydrophobicContact CG2-CE1 3.43Å; I176-F225 VanDerWaalsContact CG2-CE1 3.43Å; I176-F225 HydrophobicContact CG2-CE2 3.79Å; I176-F225 HydrophobicContact CG2-CG 4.09Å; I176-F225 HydrophobicContact CG2-CZ 3.45Å; I176-F225 VanDerWaalsContact CG2-CZ 3.45Å; F177-F225 HydrophobicContact CB-CE1 4.47Å; I180-F225 HydrophobicContact CD1-CD1 4.03Å; I180-F225 HydrophobicContact CD1-CE1 4.38Å; L219-F225 HydrophobicContact CD2-CB 4.12Å; L219-F225 HydrophobicContact CD2-CD2 4.2Å; L219-F225 HydrophobicContact CD2-CG 4.09Å; N222-F225 HydrophobicContact CB-CD2 3.87Å; N222-F225 HydrophobicContact CB-CE2 3.99Å; N222-F225 PolarHBondContact O-N 3.35Å; K223-F225 PolarHBondContact O-N 3.06Å; K223-F225 VanDerWaalsContact O-N 3.09Å; F225-W241 HydrophobicContact CB-CE3 4.08Å; F225-W241 HydrophobicContact CB-CZ3 4.42Å; F225-T242 CarbonylContact C-O 3.55Å; F225-T242 WeakPolarHBondContact CA-O 3.27Å; F225-V243 HydrophobicContact CD1-CG2 4.36Å; F225-V243 HydrophobicContact CE1-CG2 4.27Å; F225-L251 HydrophobicContact CE1-CD1 4.43Å
226	K	95.2	Very high	86.3	Confident	122 Å²	122	93.3 Å²	93.3	53%	0.53	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.6	178.6	-175.5	174.1	179	179.4	0	110.7	L228 W241 T242	K226-L228 HydrophobicContact CD-CD2 4.27Å; K226-L228 HydrophobicContact CG-CD2 4.33Å; K226-L228 PolarHBondContact O-N 3.03Å; K226-W241 WeakPolarHBondContact O-CA 3.5Å; K226-T242 PolarHBondContact N-O 2.84Å; K226-T242 PolarHBondContact O-N 3.28Å; K226-T242 PolarHBondContact O-OG1 3.09Å
227	R	94.8	Very high	85.2	Confident	181 Å²	181	100.2 Å²	100.2	68%	0.683	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	119.4	168.8	-167.9	178.4	72.6	171	1.3	109.7	A239 W241	R227-A239 HydrophobicContact CG-CB 3.43Å; R227-A239 VanDerWaalsContact CG-CB 3.43Å; R227-W241 HydrophobicContact CB-CD2 4.38Å; R227-W241 HydrophobicContact CB-CE3 4.08Å; R227-W241 HydrophobicContact CB-CH2 3.94Å; R227-W241 HydrophobicContact CB-CZ2 4.23Å; R227-W241 HydrophobicContact CB-CZ3 3.85Å; R227-W241 HydrophobicContact CG-CH2 4.4Å; R227-W241 HydrophobicContact CG-CZ2 4.2Å
228	L	91.4	Very high	84.6	Confident	58 Å²	58	98.3 Å²	98.3	30%	0.304	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	140.7	170.1	-64.9	-170.2	0	0	0	110.9	K226 A239 F240 T242	K226-L228 HydrophobicContact CD-CD2 4.27Å; K226-L228 HydrophobicContact CG-CD2 4.33Å; K226-L228 PolarHBondContact O-N 3.03Å; L228-A239 WeakPolarHBondContact O-CB 3.45Å; L228-F240 HydrophobicContact CB-CB 4.31Å; L228-F240 PolarHBondContact N-O 2.94Å; L228-F240 PolarHBondContact O-N 3.46Å; L228-T242 HydrophobicContact CD1-CG2 3.44Å; L228-T242 VanDerWaalsContact CD1-CG2 3.44Å; L228-T242 HydrophobicContact CG-CG2 3.93Å
229	P	87.3	Confident	84.3	Confident	117 Å²	117	98.1 Å²	98.1	76%	0.76	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-62.3	150.4	166.9	30.2	-34.6	0	0	0	109.8
230	R	82.1	Confident	84.1	Confident	83 Å²	83	100.9 Å²	100.9	31%	0.313	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-92.8	155.7	161.3	-53.8	-149.9	-156	-160.7	19.3	109.2	T189 S232 R237 G238 F240	T189-R230 VanDerWaalsContact CG2-CZ 3.45Å; T189-R230 VanDerWaalsContact CG2-NH2 3.3Å; R230-S232 PolarHBondContact O-N 3.42Å; R230-R237 PolarHBondContact NH2-O 3.03Å; R230-G238 PolarHBondContact NE-O 3.49Å; R230-G238 PolarHBondContact NH2-O 2.89Å; R230-F240 HydrophobicContact CB-CD2 4.49Å; R230-F240 HydrophobicContact CG-CD2 3.66Å; R230-F240 HydrophobicContact CG-CE2 3.86Å; R230-F240 HydrophobicContact CG-CG 4.47Å
231	D	77.5	Confident	84.2	Confident	139 Å²	139	98.1 Å²	98.1	74%	0.743	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-59.6	121.8	164	-62.6	-59.5	0	0	0	109.9	R233 G234	D231-R233 PolarHBondContact O-N 3.49Å; D231-G234 PolarHBondContact O-N 2.93Å; D231-G234 VanDerWaalsContact O-N 3.09Å
232	S	64.3	Low	84.2	Confident	127 Å²	127	94.3 Å²	94.3	89%	0.888	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	1.7	-177.1	52.4	0	0	0	0	114.7	R230	R230-S232 PolarHBondContact O-N 3.42Å
233	R	63.6	Low	84.4	Confident	241 Å²	241	93 Å²	93	91%	0.909	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-17.9	173.9	-58.2	-176.3	-178.5	-162.8	0.4	113.1	D231	D231-R233 PolarHBondContact O-N 3.49Å
234	G	66.2	Low	84.4	Confident	49 Å²	49	87.5 Å²	87.5	51%	0.505	46%	0.463	S	S	.	.	S	Bend	trans	-87.6	132.1	-176.9	0	0	0	0	0	113.3	D231 G236	D231-G234 PolarHBondContact O-N 2.93Å; D231-G234 VanDerWaalsContact O-N 3.09Å; G234-G236 VanDerWaalsContact C-N 3.3Å; G234-G236 PolarHBondContact O-N 3.17Å
235	P	68.4	Low	84.3	Confident	148 Å²	148	92.4 Å²	92.4	96%	0.961	49%	0.494	S	S	*	.			trans	-74.3	79.5	174.4	31.4	-34.9	0	0	0	110.9
236	G	65.7	Low	84.1	Confident	42 Å²	42	101.8 Å²	101.8	43%	0.433	53%	0.529	S	S	.	.			trans	-150.5	122.6	-177.9	0	0	0	0	0	114.1	G234	G234-G236 VanDerWaalsContact C-N 3.3Å; G234-G236 PolarHBondContact O-N 3.17Å
237	R	73.6	Confident	84	Confident	247 Å²	247	99 Å²	99	93%	0.932	52%	0.519	S	S	*	.			trans	-69.3	144.1	174.4	-71.6	-178	173.8	176.2	-1.8	111.5	R230	R230-R237 PolarHBondContact NH2-O 3.03Å
238	G	83.1	Confident	83.9	Confident	60 Å²	60	94.8 Å²	94.8	62%	0.619	50%	0.503	S	S	*	.	S	Bend	trans	76.4	169.3	172.9	0	0	0	0	0	115.4	R230	R230-G238 PolarHBondContact NE-O 3.49Å; R230-G238 PolarHBondContact NH2-O 2.89Å
239	A	89.3	Confident	84	Confident	22 Å²	22	95.2 Å²	95.2	18%	0.182	51%	0.514	C	S	.	.			trans	-89.4	166.7	-177.5	0	0	0	0	0	113.5	R227 L228	R227-A239 HydrophobicContact CG-CB 3.43Å; R227-A239 VanDerWaalsContact CG-CB 3.43Å; L228-A239 WeakPolarHBondContact O-CB 3.45Å
240	F	93.8	Very high	84.2	Confident	61 Å²	61	93.4 Å²	93.4	27%	0.268	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	150.8	159.9	-72.3	-67.2	0	0	0	110	C187 T189 L228 R230	C187-F240 HydrophobicContact CB-CB 4.48Å; T189-F240 HydrophobicContact CG2-CD1 3.49Å; T189-F240 VanDerWaalsContact CG2-CD1 3.49Å; T189-F240 HydrophobicContact CG2-CE1 3.49Å; T189-F240 VanDerWaalsContact CG2-CE1 3.49Å; T189-F240 HydrophobicContact CG2-CG 4.43Å; T189-F240 HydrophobicContact CG2-CZ 4.44Å; L228-F240 HydrophobicContact CB-CB 4.31Å; L228-F240 PolarHBondContact N-O 2.94Å; L228-F240 PolarHBondContact O-N 3.46Å; R230-F240 HydrophobicContact CB-CD2 4.49Å; R230-F240 HydrophobicContact CG-CD2 3.66Å; R230-F240 HydrophobicContact CG-CE2 3.86Å; R230-F240 HydrophobicContact CG-CG 4.47Å
241	W	96.5	Very high	84.8	Confident	34 Å²	34	90.1 Å²	90.1	13%	0.129	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	137.1	172.4	-67.9	89.5	0	0	0	110	I180 C187 M188 L219 F225 K226 R227	I180-W241 HydrophobicContact CD1-CB 4.28Å; C187-W241 CarbonylContact C-O 3.47Å; C187-W241 VanDerWaalsContact CA-O 3.3Å; C187-W241 WeakPolarHBondContact CA-O 3.44Å; M188-W241 PolarHBondContact N-O 3.11Å; M188-W241 PolarHBondContact O-N 3.35Å; L219-W241 HydrophobicContact CB-CD2 4.28Å; L219-W241 HydrophobicContact CB-CE3 4.22Å; L219-W241 HydrophobicContact CB-CH2 3.96Å; L219-W241 HydrophobicContact CB-CZ2 4.04Å; L219-W241 HydrophobicContact CB-CZ3 4.07Å; L219-W241 HydrophobicContact CD1-CD2 4.39Å; L219-W241 HydrophobicContact CD1-CG 4.42Å; L219-W241 HydrophobicContact CD2-CB 4.19Å; L219-W241 HydrophobicContact CD2-CD2 3.87Å; L219-W241 HydrophobicContact CD2-CE3 4Å; L219-W241 HydrophobicContact CD2-CG 3.96Å; L219-W241 HydrophobicContact CG-CD2 4.42Å; L219-W241 WeakPolarHBondContact O-CH2 3.46Å; L219-W241 WeakPolarHBondContact O-CZ3 2.95Å; F225-W241 HydrophobicContact CB-CE3 4.08Å; F225-W241 HydrophobicContact CB-CZ3 4.42Å; K226-W241 WeakPolarHBondContact O-CA 3.5Å; R227-W241 HydrophobicContact CB-CD2 4.38Å; R227-W241 HydrophobicContact CB-CE3 4.08Å; R227-W241 HydrophobicContact CB-CH2 3.94Å; R227-W241 HydrophobicContact CB-CZ2 4.23Å; R227-W241 HydrophobicContact CB-CZ3 3.85Å; R227-W241 HydrophobicContact CG-CH2 4.4Å; R227-W241 HydrophobicContact CG-CZ2 4.2Å
242	T	95.9	Very high	85.5	Confident	22 Å²	22	86.8 Å²	86.8	14%	0.135	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	160.2	176.6	55.9	0	0	0	0	110.6	K186 C187 F225 K226 L228	K186-T242 WeakPolarHBondContact O-CG2 3.1Å; C187-T242 HydrophobicContact CB-CG2 3.44Å; C187-T242 VanDerWaalsContact CB-CG2 3.44Å; F225-T242 CarbonylContact C-O 3.55Å; F225-T242 WeakPolarHBondContact CA-O 3.27Å; K226-T242 PolarHBondContact N-O 2.84Å; K226-T242 PolarHBondContact O-N 3.28Å; K226-T242 PolarHBondContact O-OG1 3.09Å; L228-T242 HydrophobicContact CD1-CG2 3.44Å; L228-T242 VanDerWaalsContact CD1-CG2 3.44Å; L228-T242 HydrophobicContact CG-CG2 3.93Å
243	V	96.8	Very high	86.8	Confident	13 Å²	13	83.8 Å²	83.8	8%	0.079	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	136.6	169.8	-172.9	0	0	0	0	109.4	F177 I180 S224 F225 P245 R248 L251	F177-V243 HydrophobicContact CD2-CB 4.44Å; F177-V243 HydrophobicContact CD2-CG1 3.96Å; F177-V243 HydrophobicContact CD2-CG2 3.68Å; F177-V243 HydrophobicContact CE2-CB 4.45Å; F177-V243 HydrophobicContact CE2-CG1 3.96Å; F177-V243 HydrophobicContact CE2-CG2 3.99Å; I180-V243 HydrophobicContact CB-CG2 4.15Å; I180-V243 HydrophobicContact CD1-CG2 4.22Å; I180-V243 HydrophobicContact CG2-CG2 3.95Å; S224-V243 CarbonylContact O-C 3.5Å; S224-V243 VanDerWaalsContact O-CA 3.24Å; S224-V243 WeakPolarHBondContact O-CA 3.43Å; F225-V243 HydrophobicContact CD1-CG2 4.36Å; F225-V243 HydrophobicContact CE1-CG2 4.27Å; V243-P245 WeakPolarHBondContact O-CD 3.45Å; V243-R248 HydrophobicContact CG1-CB 4.01Å; V243-R248 HydrophobicContact CG1-CG 4.42Å; V243-L251 HydrophobicContact CG1-CD1 4.23Å
244	E	95.6	Very high	88.1	Confident	53 Å²	53	74.1 Å²	74.1	25%	0.248	42%	0.42	C	S	.	.			trans	-64.8	126.4	170.7	-173.6	174.1	173.4	0	0	109.3	S224 R246 E247 R248	S224-E244 PolarHBondContact O-N 3.02Å; E244-R246 HydrophobicContact CG-CB 4.28Å; E244-R246 HydrophobicContact CG-CG 4.47Å; E244-R246 PolarHBondContact O-N 3.25Å; E244-R246 WeakPolarHBondContact OE1-CD 3.34Å; E244-R246 IonicContact OE1-CZ 3.88Å; E244-R246 IonicContact OE1-NE 2.73Å; E244-R246 IonicContact OE1-NH1 3.75Å; E244-R246 PolarHBondContact OE1-NH1 3.33Å; E244-E247 PolarHBondContact O-N 3.19Å; E244-R248 PolarHBondContact O-N 3.08Å
245	P	92.7	Very high	89.2	Confident	109 Å²	109	72.5 Å²	72.5	71%	0.708	40%	0.4	S	S	*	.	H	α-helix	trans	-55	-25	-176.4	-30.1	36.5	0	0	0	115.1	V243	V243-P245 WeakPolarHBondContact O-CD 3.45Å
246	R	92.5	Very high	90.2	Very high	209 Å²	209	72.6 Å²	72.6	79%	0.789	39%	0.385	S	S	*	.	H	α-helix	trans	-69.9	-44.2	176.7	-63.8	-174.2	176.6	130.5	-11.2	113.1	E244	E244-R246 HydrophobicContact CG-CB 4.28Å; E244-R246 HydrophobicContact CG-CG 4.47Å; E244-R246 PolarHBondContact O-N 3.25Å; E244-R246 WeakPolarHBondContact OE1-CD 3.34Å; E244-R246 IonicContact OE1-CZ 3.88Å; E244-R246 IonicContact OE1-NE 2.73Å; E244-R246 IonicContact OE1-NH1 3.75Å; E244-R246 PolarHBondContact OE1-NH1 3.33Å
247	E	92.1	Very high	91.2	Very high	65 Å²	65	79.4 Å²	79.4	30%	0.304	40%	0.398	S	S	.	.	H	α-helix	trans	-87	-16.7	-179.1	-65.2	-166.6	-165.8	0	0	112.3	S224 E244 A249 S250 L251	S224-E247 VanDerWaalsContact CA-OE2 3.27Å; S224-E247 WeakPolarHBondContact CA-OE2 3.27Å; S224-E247 WeakPolarHBondContact CB-OE2 3.48Å; S224-E247 PolarHBondContact N-OE2 3.42Å; S224-E247 PolarHBondContact OG-OE2 3.03Å; E244-E247 PolarHBondContact O-N 3.19Å; E247-A249 VanDerWaalsContact C-N 3.29Å; E247-A249 PolarHBondContact O-N 2.83Å; E247-S250 WeakPolarHBondContact O-CB 3.21Å; E247-S250 PolarHBondContact O-N 3.08Å; E247-L251 PolarHBondContact O-N 3.13Å
248	R	94.2	Very high	91.7	Very high	92 Å²	92	68.6 Å²	68.6	35%	0.347	36%	0.359	S	S	.	.	H	α-helix	trans	-48.6	-45.4	175.8	-169.2	-174	-172.9	-140.5	-6.1	113.3	F177 E181 V243 E244 L251 L252	F177-R248 HydrophobicContact CE2-CG 4.04Å; F177-R248 HydrophobicContact CZ-CG 4.35Å; E181-R248 VanDerWaalsContact CD-NH2 3.34Å; E181-R248 IonicContact OE1-CZ 3.33Å; E181-R248 IonicContact OE1-NE 2.7Å; E181-R248 PolarHBondContact OE1-NE 3.44Å; E181-R248 IonicContact OE1-NH2 3.1Å; E181-R248 PolarHBondContact OE1-NH2 3.39Å; E181-R248 VanDerWaalsContact OE1-NH2 3.1Å; E181-R248 IonicContact OE2-CZ 3.74Å; E181-R248 IonicContact OE2-NE 3.85Å; E181-R248 IonicContact OE2-NH2 2.78Å; E181-R248 PolarHBondContact OE2-NH2 2.89Å; V243-R248 HydrophobicContact CG1-CB 4.01Å; V243-R248 HydrophobicContact CG1-CG 4.42Å; E244-R248 PolarHBondContact O-N 3.08Å; R248-L251 PolarHBondContact O-N 2.71Å; R248-L252 HydrophobicContact CG-CD1 4.42Å; R248-L252 VanDerWaalsContact O-CG 3.31Å; R248-L252 WeakPolarHBondContact O-CG 3.47Å; R248-L252 PolarHBondContact O-N 3.34Å
249	A	92.3	Very high	91.3	Very high	66 Å²	66	70.4 Å²	70.4	55%	0.545	36%	0.36	S	S	.	.	H	α-helix	trans	-66	-40.7	178.9	0	0	0	0	0	112.5	E247 L252 D253	E247-A249 VanDerWaalsContact C-N 3.29Å; E247-A249 PolarHBondContact O-N 2.83Å; A249-L252 PolarHBondContact O-N 3.17Å; A249-D253 WeakPolarHBondContact O-CB 3.46Å; A249-D253 PolarHBondContact O-N 3.21Å
250	S	93.1	Very high	90.5	Very high	79 Å²	79	75.8 Å²	75.8	55%	0.552	38%	0.375	S	S	*	.	H	α-helix	trans	-64.7	-42.9	177	-173.4	0	0	0	0	111.7	E247 D253 A254	E247-S250 WeakPolarHBondContact O-CB 3.21Å; E247-S250 PolarHBondContact O-N 3.08Å; S250-D253 PolarHBondContact O-N 2.94Å; S250-A254 VanDerWaalsContact O-CB 3.29Å; S250-A254 WeakPolarHBondContact O-CB 3.29Å; S250-A254 PolarHBondContact O-N 3.42Å
251	L	93	Very high	89.1	Confident	14 Å²	14	74.5 Å²	74.5	7%	0.073	37%	0.371	C	S	.	.	H	α-helix	trans	-69	-36.6	177.4	-70	176.8	0	0	0	112.9	T173 F177 F225 V243 E247 R248 D253 I255	T173-L251 HydrophobicContact CG2-CD2 3.89Å; F177-L251 HydrophobicContact CB-CD1 4.22Å; F177-L251 HydrophobicContact CD1-CB 4.37Å; F177-L251 HydrophobicContact CD2-CB 3.48Å; F177-L251 VanDerWaalsContact CD2-CB 3.48Å; F177-L251 HydrophobicContact CD2-CD1 3.5Å; F177-L251 VanDerWaalsContact CD2-CD1 3.5Å; F177-L251 HydrophobicContact CD2-CG 4.14Å; F177-L251 HydrophobicContact CE2-CB 3.73Å; F177-L251 HydrophobicContact CE2-CD1 4.29Å; F177-L251 HydrophobicContact CG-CB 3.84Å; F177-L251 HydrophobicContact CG-CD1 4.11Å; F177-L251 HydrophobicContact CZ-CB 4.28Å; F225-L251 HydrophobicContact CE1-CD1 4.43Å; V243-L251 HydrophobicContact CG1-CD1 4.23Å; E247-L251 PolarHBondContact O-N 3.13Å; R248-L251 PolarHBondContact O-N 2.71Å; L251-D253 VanDerWaalsContact C-N 3.34Å; L251-I255 WeakPolarHBondContact O-CB 3.4Å; L251-I255 WeakPolarHBondContact O-CD1 3.29Å; L251-I255 WeakPolarHBondContact O-CG1 3.22Å; L251-I255 PolarHBondContact O-N 3.38Å
252	L	92.3	Very high	86.9	Confident	69 Å²	69	80.3 Å²	80.3	36%	0.361	40%	0.398	S	S	.	.	H	α-helix	trans	-59.7	-45	170.9	-75.8	167.6	0	0	0	111.8	F177 R248 A249 I255 K256	F177-L252 HydrophobicContact CE1-CD2 3.69Å; F177-L252 HydrophobicContact CE1-CG 4.06Å; F177-L252 HydrophobicContact CZ-CD2 3.63Å; F177-L252 HydrophobicContact CZ-CG 3.59Å; R248-L252 HydrophobicContact CG-CD1 4.42Å; R248-L252 VanDerWaalsContact O-CG 3.31Å; R248-L252 WeakPolarHBondContact O-CG 3.47Å; R248-L252 PolarHBondContact O-N 3.34Å; A249-L252 PolarHBondContact O-N 3.17Å; L252-I255 PolarHBondContact O-N 2.97Å; L252-K256 WeakPolarHBondContact O-CB 3.22Å; L252-K256 VanDerWaalsContact O-CG 3.3Å; L252-K256 WeakPolarHBondContact O-CG 3.39Å; L252-K256 PolarHBondContact O-N 3.46Å
253	D	92	Very high	84.5	Confident	64 Å²	64	81.8 Å²	81.8	34%	0.342	41%	0.412	S	S	.	.	H	α-helix	trans	-70.5	-44.1	-179.3	-170.9	23.8	0	0	0	111.7	A249 S250 L251 I255 K256 R257	A249-D253 WeakPolarHBondContact O-CB 3.46Å; A249-D253 PolarHBondContact O-N 3.21Å; S250-D253 PolarHBondContact O-N 2.94Å; L251-D253 VanDerWaalsContact C-N 3.34Å; D253-I255 VanDerWaalsContact C-N 3.25Å; D253-I255 PolarHBondContact O-N 3.04Å; D253-K256 PolarHBondContact O-N 3.1Å; D253-K256 VanDerWaalsContact O-N 3.15Å; D253-R257 WeakPolarHBondContact O-CB 3.25Å; D253-R257 VanDerWaalsContact O-CG 3.27Å; D253-R257 WeakPolarHBondContact O-CG 3.35Å; D253-R257 PolarHBondContact O-N 3.24Å; D253-R257 IonicContact OD1-CZ 3.46Å; D253-R257 IonicContact OD1-NE 3.91Å; D253-R257 PolarHBondContact OD1-NE 2.87Å; D253-R257 IonicContact OD1-NH2 2.66Å; D253-R257 IonicContact OD2-CZ 2.68Å; D253-R257 IonicContact OD2-NE 3.7Å; D253-R257 PolarHBondContact OD2-NE 3.49Å; D253-R257 VanDerWaalsContact OD2-NE 3.11Å; D253-R257 IonicContact OD2-NH2 2.9Å; D253-R257 PolarHBondContact OD2-NH2 3.45Å
254	A	90.3	Very high	81.9	Confident	38 Å²	38	83.3 Å²	83.3	31%	0.314	42%	0.423	S	S	.	.	H	α-helix	trans	-58.5	-35.2	173.8	0	0	0	0	0	113	S250 N258	S250-A254 VanDerWaalsContact O-CB 3.29Å; S250-A254 WeakPolarHBondContact O-CB 3.29Å; S250-A254 PolarHBondContact O-N 3.42Å; A254-N258 PolarHBondContact O-N 2.62Å
255	I	89.9	Confident	79.2	Confident	16 Å²	16	85.7 Å²	85.7	8%	0.082	44%	0.441	C	S	.	.	H	α-helix	trans	-73.7	-47.3	172.5	-74	163.6	0	0	0	111	H174 F177 M178 L251 L252 D253 R257 N258 N261	H174-I255 HydrophobicContact CB-CD1 4.07Å; H174-I255 HydrophobicContact CB-CG1 3.95Å; F177-I255 HydrophobicContact CB-CD1 4.32Å; F177-I255 HydrophobicContact CD1-CD1 3.3Å; F177-I255 HydrophobicContact CE1-CD1 3.97Å; F177-I255 HydrophobicContact CG-CD1 4.09Å; M178-I255 HydrophobicContact CG-CD1 3.84Å; M178-I255 HydrophobicContact SD-CD1 4.47Å; M178-I255 HydrophobicContact SD-CG2 4.5Å; L251-I255 WeakPolarHBondContact O-CB 3.4Å; L251-I255 WeakPolarHBondContact O-CD1 3.29Å; L251-I255 WeakPolarHBondContact O-CG1 3.22Å; L251-I255 PolarHBondContact O-N 3.38Å; L252-I255 PolarHBondContact O-N 2.97Å; D253-I255 VanDerWaalsContact C-N 3.25Å; D253-I255 PolarHBondContact O-N 3.04Å; I255-R257 PolarHBondContact O-N 3.28Å; I255-N258 WeakPolarHBondContact O-CB 3.41Å; I255-N258 PolarHBondContact O-N 3.45Å; I255-N261 WeakPolarHBondContact CG2-ND2 3.41Å; I255-N261 PolarHBondContact O-ND2 3.03Å; I255-N261 PolarHBondContact O-OD1 3.18Å
256	K	88.9	Confident	76.4	Confident	150 Å²	150	85.1 Å²	85.1	65%	0.652	44%	0.436	S	S	*	.	H	α-helix	trans	-57.4	-36.3	176.9	-77.1	175.9	178.8	-172.7	0	113.1	L252 D253 N258	L252-K256 WeakPolarHBondContact O-CB 3.22Å; L252-K256 VanDerWaalsContact O-CG 3.3Å; L252-K256 WeakPolarHBondContact O-CG 3.39Å; L252-K256 PolarHBondContact O-N 3.46Å; D253-K256 PolarHBondContact O-N 3.1Å; D253-K256 VanDerWaalsContact O-N 3.15Å; K256-N258 VanDerWaalsContact C-N 3.3Å
257	R	87.7	Confident	73.8	Confident	184 Å²	184	78.4 Å²	78.4	69%	0.694	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-8.2	176.3	-66.3	177.5	-166.8	-152	7.1	113.8	D253 I255 P259	D253-R257 WeakPolarHBondContact O-CB 3.25Å; D253-R257 VanDerWaalsContact O-CG 3.27Å; D253-R257 WeakPolarHBondContact O-CG 3.35Å; D253-R257 PolarHBondContact O-N 3.24Å; D253-R257 IonicContact OD1-CZ 3.46Å; D253-R257 IonicContact OD1-NE 3.91Å; D253-R257 PolarHBondContact OD1-NE 2.87Å; D253-R257 IonicContact OD1-NH2 2.66Å; D253-R257 IonicContact OD2-CZ 2.68Å; D253-R257 IonicContact OD2-NE 3.7Å; D253-R257 PolarHBondContact OD2-NE 3.49Å; D253-R257 VanDerWaalsContact OD2-NE 3.11Å; D253-R257 IonicContact OD2-NH2 2.9Å; D253-R257 PolarHBondContact OD2-NH2 3.45Å; I255-R257 PolarHBondContact O-N 3.28Å; R257-P259 VanDerWaalsContact O-CD 3.27Å; R257-P259 WeakPolarHBondContact O-CD 3.48Å
258	N	82.9	Confident	71.1	Confident	20 Å²	20	82.4 Å²	82.4	11%	0.107	45%	0.446	C	S	.	.			trans	-68.5	117.6	177.8	-172.2	5.4	0	0	0	109.7	N169 Y170 A254 I255 K256 W260 N261	N169-N258 PolarHBondContact O-ND2 3.48Å; Y170-N258 VanDerWaalsContact CD1-ND2 3.29Å; Y170-N258 WeakPolarHBondContact CD1-ND2 3.09Å; Y170-N258 WeakPolarHBondContact CE1-ND2 3.46Å; A254-N258 PolarHBondContact O-N 2.62Å; I255-N258 WeakPolarHBondContact O-CB 3.41Å; I255-N258 PolarHBondContact O-N 3.45Å; K256-N258 VanDerWaalsContact C-N 3.3Å; N258-W260 PolarHBondContact O-N 3.45Å; N258-W260 VanDerWaalsContact OD1-CD1 3.26Å; N258-W260 PolarHBondContact OD1-N 3.11Å; N258-N261 WeakPolarHBondContact O-CB 3.41Å; N258-N261 PolarHBondContact O-N 2.98Å
259	P	76.3	Confident	67.9	Low	99 Å²	99	80.7 Å²	80.7	64%	0.643	46%	0.456	S	S	*	.	H	α-helix	trans	-58.4	-25.8	-178	-25.6	35.9	0	0	0	113.2	R257 N261	R257-P259 VanDerWaalsContact O-CD 3.27Å; R257-P259 WeakPolarHBondContact O-CD 3.48Å; P259-N261 VanDerWaalsContact C-N 3.29Å; P259-N261 PolarHBondContact O-N 3.05Å
260	W	71.9	Confident	64.7	Low	135 Å²	135	82.7 Å²	82.7	51%	0.511	47%	0.465	S	S	.	.	H	α-helix	trans	-73.9	-13.9	179.3	-57.5	102.4	0	0	0	113.9	N169 N258 S264	N169-W260 HydrophobicContact CB-CB 4.14Å; N169-W260 HydrophobicContact CB-CD2 3.77Å; N169-W260 HydrophobicContact CB-CG 3.49Å; N169-W260 VanDerWaalsContact CB-CG 3.49Å; N169-W260 VanDerWaalsContact ND2-CE2 3.25Å; N169-W260 WeakPolarHBondContact ND2-CZ2 2.96Å; N258-W260 PolarHBondContact O-N 3.45Å; N258-W260 VanDerWaalsContact OD1-CD1 3.26Å; N258-W260 PolarHBondContact OD1-N 3.11Å; W260-S264 VanDerWaalsContact O-CB 3.24Å; W260-S264 WeakPolarHBondContact O-CB 3.39Å; W260-S264 PolarHBondContact O-N 3.29Å
261	N	64.7	Low	61.5	Low	34 Å²	34	86.9 Å²	86.9	18%	0.182	48%	0.476	C	S	.	.	H	α-helix	trans	-60.5	-49.6	172.9	-85.2	36.7	0	0	0	111.3	Y170 I255 N258 P259 S264 V265	Y170-N261 WeakPolarHBondContact CE1-OD1 3.38Å; Y170-N261 PolarHBondContact OH-OD1 3.03Å; Y170-N261 VanDerWaalsContact OH-OD1 3.13Å; I255-N261 WeakPolarHBondContact CG2-ND2 3.41Å; I255-N261 PolarHBondContact O-ND2 3.03Å; I255-N261 PolarHBondContact O-OD1 3.18Å; N258-N261 WeakPolarHBondContact O-CB 3.41Å; N258-N261 PolarHBondContact O-N 2.98Å; P259-N261 VanDerWaalsContact C-N 3.29Å; P259-N261 PolarHBondContact O-N 3.05Å; N261-S264 PolarHBondContact O-N 2.93Å; N261-V265 WeakPolarHBondContact O-CG2 3.38Å; N261-V265 PolarHBondContact O-N 2.98Å
262	F	49.4	Very low	58.4	Low	156 Å²	156	94.5 Å²	94.5	68%	0.684	52%	0.516	S	S	*	.	H	α-helix	trans	-62.7	-46.4	-179.8	-70.8	-82.3	0	0	0	111.4	S264 V265 T266	F262-S264 VanDerWaalsContact C-N 3.3Å; F262-S264 PolarHBondContact O-N 3Å; F262-V265 PolarHBondContact O-N 3.32Å; F262-T266 PolarHBondContact O-N 2.53Å; F262-T266 PolarHBondContact O-OG1 3.18Å; F262-T266 VanDerWaalsContact O-OG1 3.11Å
263	A	47	Very low	55.2	Low	52 Å²	52	96.6 Å²	96.6	43%	0.43	54%	0.536	S	S	.	.	H	α-helix	trans	-59.3	-40.3	175.6	0	0	0	0	0	112.4	A267	A263-A267 VanDerWaalsContact O-CB 3.25Å; A263-A267 WeakPolarHBondContact O-CB 3.4Å; A263-A267 PolarHBondContact O-N 3.05Å
264	S	42.2	Very low	52.2	Low	45 Å²	45	101.7 Å²	101.7	32%	0.315	56%	0.563	S	S	.	*	H	α-helix	trans	-68.9	-36.9	177.4	-165.7	0	0	0	0	112.7	W260 N261 F262 M268	W260-S264 VanDerWaalsContact O-CB 3.24Å; W260-S264 WeakPolarHBondContact O-CB 3.39Å; W260-S264 PolarHBondContact O-N 3.29Å; N261-S264 PolarHBondContact O-N 2.93Å; F262-S264 VanDerWaalsContact C-N 3.3Å; F262-S264 PolarHBondContact O-N 3Å; S264-M268 WeakPolarHBondContact O-CB 3.45Å; S264-M268 WeakPolarHBondContact O-CG 3.44Å; S264-M268 PolarHBondContact O-N 3.07Å
265	V	38.1	Very low	49	Very low	104 Å²	104	102.7 Å²	102.7	63%	0.63	58%	0.577	S	S	*	*	H	α-helix	trans	-72.5	-42.6	176.9	172.3	0	0	0	0	110.9	N261 F262 A267 M268 G269	N261-V265 WeakPolarHBondContact O-CG2 3.38Å; N261-V265 PolarHBondContact O-N 2.98Å; F262-V265 PolarHBondContact O-N 3.32Å; V265-A267 VanDerWaalsContact C-N 3.32Å; V265-A267 PolarHBondContact O-N 3.12Å; V265-M268 CarbonylContact O-C 3.57Å; V265-M268 PolarHBondContact O-N 2.99Å; V265-M268 VanDerWaalsContact O-N 3.07Å; V265-G269 PolarHBondContact O-N 3.04Å
266	T	34	Very low	46	Very low	96 Å²	96	106.5 Å²	106.5	59%	0.589	61%	0.605	S	S	*	*	H	α-helix	trans	-61.3	-41.5	173.5	-54.4	0	0	0	0	111.3	F262 M268 G269 C270	F262-T266 PolarHBondContact O-N 2.53Å; F262-T266 PolarHBondContact O-OG1 3.18Å; F262-T266 VanDerWaalsContact O-OG1 3.11Å; T266-M268 PolarHBondContact O-N 3.4Å; T266-G269 PolarHBondContact O-N 2.8Å; T266-C270 PolarHBondContact O-SG 3.19Å
267	A	36.8	Very low	43.2	Very low	69 Å²	69	107.6 Å²	107.6	57%	0.57	61%	0.612	S	S	*	*	H	α-helix	trans	-66.1	-18.2	175.2	0	0	0	0	0	114.2	A263 V265	A263-A267 VanDerWaalsContact O-CB 3.25Å; A263-A267 WeakPolarHBondContact O-CB 3.4Å; A263-A267 PolarHBondContact O-N 3.05Å; V265-A267 VanDerWaalsContact C-N 3.32Å; V265-A267 PolarHBondContact O-N 3.12Å
268	M	36.7	Very low	40.2	Very low	149 Å²	149	106.8 Å²	106.8	73%	0.734	62%	0.622	S	S	*	*	H	α-helix	trans	-97.7	-14.9	175.5	-66.9	-92.3	-73.8	0	0	113.1	S264 V265 T266	S264-M268 WeakPolarHBondContact O-CB 3.45Å; S264-M268 WeakPolarHBondContact O-CG 3.44Å; S264-M268 PolarHBondContact O-N 3.07Å; V265-M268 CarbonylContact O-C 3.57Å; V265-M268 PolarHBondContact O-N 2.99Å; V265-M268 VanDerWaalsContact O-N 3.07Å; T266-M268 PolarHBondContact O-N 3.4Å
269	G	26.1	Very low	37.7	Very low	55 Å²	55	112.4 Å²	112.4	57%	0.567	66%	0.656	S	S	*	*	H	α-helix	trans	-91.1	-12.4	-171.9	0	0	0	0	0	115.6	V265 T266 H271	V265-G269 PolarHBondContact O-N 3.04Å; T266-G269 PolarHBondContact O-N 2.8Å; G269-H271 PolarHBondContact O-N 3.4Å
270	C	26.1	Very low	35.2	Very low	109 Å²	109	114 Å²	114	74%	0.736	67%	0.665	S	S	*	*			trans	-81.3	75.1	-175.8	-63.5	0	0	0	0	112.2	T266	T266-C270 PolarHBondContact O-SG 3.19Å
271	H	25.5	Very low	32.9	Very low	166 Å²	166	112.8 Å²	112.8	77%	0.769	68%	0.677	S	S	*	*			trans	-132	34.8	174.1	-148.2	-64.5	0	0	0	113.7	G269	G269-H271 PolarHBondContact O-N 3.4Å
272	L	26.6	Very low	30.9	Very low	175 Å²	175	115.7 Å²	115.7	92%	0.916	71%	0.705	S	S	*	*			trans	-83.2	111.6	158.9	-91.6	68.8	0	0	0	108.2
273	S	25.1	Very low	29.6	Very low	113 Å²	113	114.1 Å²	114.1	79%	0.79	71%	0.714	S	S	*	*			trans	-82.1	111.2	169.8	52.8	0	0	0	0	109.6
274	D	29.3	Very low	28.5	Very low	170 Å²	170	115.8 Å²	115.8	91%	0.909	73%	0.727	S	S	*	*			trans	-130.8	150.9	155.9	-155.5	-6.6	0	0	0	109
275	G	23.8	Very low	27.6	Very low	59 Å²	59	123.7 Å²	123.7	61%	0.608	75%	0.752	S	S	*	*			trans	-101.8	165.8	-165	0	0	0	0	0	114.3
276	S	27.1	Very low	27.2	Very low	96 Å²	96	124.2 Å²	124.2	67%	0.671	76%	0.758	S	S	*	*			trans	62.5	116.6	170.3	-177.6	0	0	0	0	116.4
277	H	30.4	Very low	26.8	Very low	174 Å²	174	125.2 Å²	125.2	81%	0.806	76%	0.763	S	S	*	*				178.8	119.8	108.1	-92.1	-62.7	0	0	0	110.2	V279	H277-V279 PolarHBondContact O-N 3.33Å
278	D	23.3	Very low	26.4	Very low	167 Å²	167	133 Å²	133	89%	0.893	78%	0.778	S	S	*	*			trans	-70	115.5	174.7	-70.6	-61.8	0	0	0	111.3
279	V	30.9	Very low	25.8	Very low	137 Å²	137	136.8 Å²	136.8	83%	0.83	78%	0.784	S	S	*	*			trans	-132	123.4	163	-176.3	0	0	0	0	109.9	H277	H277-V279 PolarHBondContact O-N 3.33Å
280	T	24.8	Very low	25.7	Very low	133 Å²	133	144.7 Å²	144.7	82%	0.816	80%	0.803	S	S	*	*			trans	-83.8	117	-169.8	-61.1	0	0	0	0	113.3
281	S	22.2	Very low	25.6	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	80%	0.8	S	S	*	*			trans	67.9	144.6	149.8	-156.8	0	0	0	0	120.5
282	A	23	Very low	25.6	Very low	95 Å²	95	143.1 Å²	143.1	79%	0.785	81%	0.807	S	S	*	*			trans	57.7	99	157.9	0	0	0	0	0	119.9
283	S	22.2	Very low	25.6	Very low	123 Å²	123	139.1 Å²	139.1	86%	0.86	80%	0.8	S	S	*	*				-164.1	164.3	117.2	-158.8	0	0	0	0	113.5
284	A	24.1	Very low	25.7	Very low	87 Å²	87	142.8 Å²	142.8	72%	0.719	80%	0.804	S	S	*	*			trans	47.4	85.5	156.1	0	0	0	0	0	119.5
285	Y	24.2	Very low	25.6	Very low	211 Å²	211	139.9 Å²	139.9	83%	0.827	80%	0.797	S	S	*	*			trans	-59.9	134.4	150.8	-72.4	-88.1	0	0	0	110.2	V287	Y285-V287 PolarHBondContact O-N 2.91Å
286	P	28.3	Very low	25.6	Very low	116 Å²	116	141.6 Å²	141.6	75%	0.753	81%	0.805	S	S	*	*			trans	-75.6	73.6	172.5	31.8	-35.2	0	0	0	110.7	R288	P286-R288 PolarHBondContact O-N 3.46Å
287	V	25.9	Very low	25.6	Very low	117 Å²	117	143 Å²	143	71%	0.709	81%	0.812	S	S	*	*			trans	-65.4	95	172	-179.9	0	0	0	0	108.3	Y285 R289	Y285-V287 PolarHBondContact O-N 2.91Å; V287-R289 PolarHBondContact O-N 2.92Å
288	R	27.8	Very low	25.5	Very low	232 Å²	232	137.9 Å²	137.9	88%	0.875	81%	0.807	S	S	*	*			trans	-67.9	77.2	173.3	-70.8	-171.1	176.6	-168.1	-1	110.3	P286 F290	P286-R288 PolarHBondContact O-N 3.46Å; R288-F290 PolarHBondContact O-N 3.34Å
289	R	24.1	Very low	25.6	Very low	229 Å²	229	138.9 Å²	138.9	86%	0.864	81%	0.806	S	S	*	*			trans	-60.6	125.8	170.3	-124	174.9	-179.9	161.7	-1.1	108	V287 G291	V287-R289 PolarHBondContact O-N 2.92Å; R289-G291 PolarHBondContact O-N 3.21Å; R289-G291 VanDerWaalsContact O-N 3.11Å
290	F	25.2	Very low	25.4	Very low	221 Å²	221	140.6 Å²	140.6	97%	0.969	81%	0.809	S	S	*	*			trans	-67.7	108.3	169.6	-78	-101.2	0	0	0	108.2	R288	R288-F290 PolarHBondContact O-N 3.34Å
291	G	23.8	Very low	25.5	Very low	65 Å²	65	142.9 Å²	142.9	67%	0.67	82%	0.816	S	S	*	*			trans	-153.6	134.9	178.4	0	0	0	0	0	109.4	R289 A293	R289-G291 PolarHBondContact O-N 3.21Å; R289-G291 VanDerWaalsContact O-N 3.11Å; G291-A293 PolarHBondContact O-N 3.42Å
292	L	25.7	Very low	25.8	Very low	176 Å²	176	147.8 Å²	147.8	92%	0.921	82%	0.817	S	S	*	*			trans	-78.5	113.7	-174.8	-70.9	159.2	0	0	0	109.9
293	A	25.7	Very low	26	Very low	92 Å²	92	148.6 Å²	148.6	76%	0.76	82%	0.824	S	S	*	*			trans	-130.4	35.5	174.9	0	0	0	0	0	111.7	G291 S295	G291-A293 PolarHBondContact O-N 3.42Å; A293-S295 VanDerWaalsContact C-N 3.26Å; A293-S295 PolarHBondContact O-N 3.16Å
294	H	28.5	Very low	26.3	Very low	190 Å²	190	150 Å²	150	88%	0.88	82%	0.817	S	S	*	*			trans	-90.6	52.2	172.8	-71.6	-54.8	0	0	0	111.7
295	S	26.6	Very low	26.4	Very low	108 Å²	108	149.6 Å²	149.6	76%	0.755	82%	0.821	S	S	*	*			trans	-148.9	88.3	166.4	-168.4	0	0	0	0	110.8	A293	A293-S295 VanDerWaalsContact C-N 3.26Å; A293-S295 PolarHBondContact O-N 3.16Å
296	A	24.2	Very low	26.6	Very low	95 Å²	95	147.8 Å²	147.8	79%	0.785	83%	0.825	S	S	*	*			trans	-165.7	60	154.5	0	0	0	0	0	111.2	G298	A296-G298 PolarHBondContact O-N 3.27Å
297	P	27.6	Very low	26.5	Very low	125 Å²	125	145.6 Å²	145.6	81%	0.812	82%	0.823	S	S	*	*			trans	-67.7	120.3	175.1	-13.6	30.3	0	0	0	110.8
298	G	26.7	Very low	26.6	Very low	67 Å²	67	152 Å²	152	69%	0.691	84%	0.835	S	S	*	*	S	Bend	trans	73.9	68	158.8	0	0	0	0	0	117.6	A296	A296-G298 PolarHBondContact O-N 3.27Å
299	H	26.6	Very low	26.9	Very low	188 Å²	188	148.1 Å²	148.1	87%	0.87	83%	0.831	S	S	*	*			trans	-143.2	33.8	157.7	-108.4	80.2	0	0	0	114.1
300	L	27.1	Very low	27.2	Very low	174 Å²	174	145.9 Å²	145.9	91%	0.911	83%	0.828	S	S	*	*			trans	-126.9	56	172.1	-73.5	177.8	0	0	0	112.3
301	L	26.4	Very low	27.3	Very low	181 Å²	181	143.5 Å²	143.5	95%	0.948	82%	0.824	S	S	*	*			trans	-121.9	67.2	161.7	-77.7	178.2	0	0	0	110
302	R	27.5	Very low	27.5	Very low	212 Å²	212	147.7 Å²	147.7	80%	0.8	83%	0.826	S	S	*	*			trans	-146	90.5	165.8	-147.5	-178.1	-162.7	121.5	8.8	109.6	E304	R302-E304 WeakPolarHBondContact CD-OE1 3.5Å; R302-E304 HydrophobicContact CG-CG 4.36Å; R302-E304 IonicContact NE-OE1 3.51Å; R302-E304 PolarHBondContact NE-OE1 3.17Å; R302-E304 PolarHBondContact O-N 3.47Å
303	A	27.5	Very low	27.7	Very low	111 Å²	111	144.8 Å²	144.8	92%	0.917	82%	0.821	S	S	*	*			trans	-82.9	97.9	172.9	0	0	0	0	0	108.8
304	E	29.6	Very low	27.8	Very low	154 Å²	154	145.9 Å²	145.9	72%	0.72	82%	0.818	S	S	*	*			trans	-96.2	129.4	166.9	-63.4	-168.3	-172.5	0	0	108.7	R302	R302-E304 WeakPolarHBondContact CD-OE1 3.5Å; R302-E304 HydrophobicContact CG-CG 4.36Å; R302-E304 IonicContact NE-OE1 3.51Å; R302-E304 PolarHBondContact NE-OE1 3.17Å; R302-E304 PolarHBondContact O-N 3.47Å
305	G	25.8	Very low	27.7	Very low	77 Å²	77	142.6 Å²	142.6	79%	0.794	81%	0.814	S	S	*	*			trans	-86.4	132.2	-157.9	0	0	0	0	0	114.7
306	L	28.8	Very low	27.9	Very low	174 Å²	174	145 Å²	145	91%	0.911	81%	0.813	S	S	*	*			trans	-135.2	148.8	163.3	-70.4	176.9	0	0	0	109.7
307	G	26.2	Very low	28.3	Very low	70 Å²	70	147 Å²	147	72%	0.722	81%	0.809	S	S	*	*			trans	72.4	94.7	164.9	0	0	0	0	0	116.4	D309	G307-D309 PolarHBondContact O-N 2.63Å
308	R	27.6	Very low	28.5	Very low	252 Å²	252	149.1 Å²	149.1	95%	0.951	80%	0.8	S	S	*	*			trans	-81.3	92.9	155.2	-76.4	-177.4	177.4	176.8	-1.3	108.7
309	D	32.7	Very low	28.9	Very low	149 Å²	149	150.4 Å²	150.4	80%	0.797	79%	0.791	S	S	*	*			trans	-127.9	150.3	166.7	-85.4	-60.2	0	0	0	112	G307 L311	G307-D309 PolarHBondContact O-N 2.63Å; D309-L311 PolarHBondContact O-N 3.18Å
310	K	32.1	Very low	29.6	Very low	183 Å²	183	146.3 Å²	146.3	80%	0.796	78%	0.775	S	S	*	*			trans	-86.1	90.5	-160.3	-57.7	175.4	-173.2	174.8	0	112	E312	K310-E312 HydrophobicContact CB-CG 4.46Å; K310-E312 PolarHBondContact O-N 2.93Å
311	L	26.6	Very low	30.5	Very low	170 Å²	170	146 Å²	146	89%	0.89	76%	0.763	S	S	*	*			trans	-81	100.3	158.9	-109.8	73.2	0	0	0	109.5	D309	D309-L311 PolarHBondContact O-N 3.18Å
312	E	29	Very low	31.7	Very low	154 Å²	154	139.9 Å²	139.9	72%	0.72	73%	0.733	S	S	*	*			trans	-79.6	124.2	177.3	-66.3	-179.7	167.7	0	0	110.6	K310	K310-E312 HydrophobicContact CB-CG 4.46Å; K310-E312 PolarHBondContact O-N 2.93Å
313	S	29.3	Very low	33.2	Very low	115 Å²	115	136.5 Å²	136.5	80%	0.804	74%	0.742	S	S	*	*			trans	41.5	81.3	164.1	57	0	0	0	0	118.3
314	T	27.3	Very low	35	Very low	114 Å²	114	135.8 Å²	135.8	70%	0.699	72%	0.723	S	S	*	*			trans	-80	141.3	142	50.4	0	0	0	0	109.4	Q316	T314-Q316 PolarHBondContact O-N 3.37Å; T314-Q316 VanDerWaalsContact O-N 3.1Å
315	P	27	Very low	35.6	Very low	122 Å²	122	131.3 Å²	131.3	79%	0.792	72%	0.718	S	S	*	*			trans	-70.8	109	-175.7	27	-33.8	0	0	0	111	I317	P315-I317 PolarHBondContact O-N 2.97Å
316	Q	31.3	Very low	36.3	Very low	159 Å²	159	133.9 Å²	133.9	74%	0.743	71%	0.707	S	S	*	*			trans	-75.8	116	175.7	-67.7	-173.2	-4.6	0	0	110.5	T314 R318	T314-Q316 PolarHBondContact O-N 3.37Å; T314-Q316 VanDerWaalsContact O-N 3.1Å; Q316-R318 PolarHBondContact O-N 2.93Å
317	I	31.2	Very low	36.8	Very low	135 Å²	135	129.3 Å²	129.3	69%	0.692	69%	0.687	S	S	*	*			trans	-64.8	103.3	169.1	-59.3	172	0	0	0	107.9	P315 L319 A329	P315-I317 PolarHBondContact O-N 2.97Å; I317-L319 HydrophobicContact CG2-CD2 4.42Å; I317-A329 HydrophobicContact CG2-CB 4.36Å
318	R	32.2	Very low	37.1	Very low	170 Å²	170	131 Å²	131	64%	0.642	68%	0.678	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.8	114.8	173.5	-95.5	-177	170.4	162.9	-1.5	110	Q316	Q316-R318 PolarHBondContact O-N 2.93Å
319	L	35.8	Very low	37.6	Very low	94 Å²	94	121.5 Å²	121.5	49%	0.492	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.4	108.4	165	-59.6	177.7	0	0	0	107.7	I317 V327 A329	I317-L319 HydrophobicContact CG2-CD2 4.42Å; L319-V327 HydrophobicContact CB-CG1 4Å; L319-V327 HydrophobicContact CD2-CG1 3.98Å; L319-V327 HydrophobicContact CG-CG1 4.43Å; L319-A329 HydrophobicContact CD2-CB 3.73Å
320	L	40.5	Very low	37.9	Very low	102 Å²	102	117.1 Å²	117.1	53%	0.534	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99	132.1	173	-68.7	176.3	0	0	0	109.5	L328	L320-L328 PolarHBondContact N-O 3.37Å; L320-L328 PolarHBondContact O-N 2.87Å
321	Y	46	Very low	38	Very low	169 Å²	169	118.8 Å²	118.8	66%	0.663	64%	0.636	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.6	121.1	175.3	-61.3	-96.7	0	0	0	108.1	K326 V327	Y321-K326 WeakPolarHBondContact CA-O 3.27Å; Y321-V327 HydrophobicContact CD1-CG2 3.78Å; Y321-V327 HydrophobicContact CE1-CG2 3.61Å
322	T	51.7	Low	38.3	Very low	51 Å²	51	117.4 Å²	117.4	31%	0.313	63%	0.629	S	S	.	*	P	Polyproline II helix	trans	-73.7	159.4	170	54.6	0	0	0	0	110.1	D324 G325 K326 L328	T322-D324 WeakPolarHBondContact CB-OD1 3.47Å; T322-D324 PolarHBondContact O-N 3.17Å; T322-D324 VanDerWaalsContact O-N 3.15Å; T322-D324 PolarHBondContact OG1-OD1 3.12Å; T322-G325 PolarHBondContact O-N 2.86Å; T322-K326 PolarHBondContact N-O 3.02Å; T322-K326 WeakPolarHBondContact OG1-CB 3.35Å; T322-K326 PolarHBondContact OG1-N 3.19Å; T322-K326 PolarHBondContact OG1-O 3.45Å; T322-K326 VanDerWaalsContact OG1-O 3.11Å; T322-L328 HydrophobicContact CG2-CD1 4.14Å
323	S	59	Low	38.2	Very low	141 Å²	141	115 Å²	115	99%	0.986	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-14.5	-177.9	47.7	0	0	0	0	114.3	G325	S323-G325 VanDerWaalsContact C-N 3.35Å
324	D	65.6	Low	38.4	Very low	96 Å²	96	114.2 Å²	114.2	51%	0.513	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.4	16.3	170.1	71.4	-32.7	0	0	0	113.3	T322 K326	T322-D324 WeakPolarHBondContact CB-OD1 3.47Å; T322-D324 PolarHBondContact O-N 3.17Å; T322-D324 VanDerWaalsContact O-N 3.15Å; T322-D324 PolarHBondContact OG1-OD1 3.12Å; D324-K326 PolarHBondContact O-N 3.49Å; D324-K326 IonicContact OD2-NZ 2.58Å; D324-K326 PolarHBondContact OD2-NZ 3.44Å
325	G	42.9	Very low	38.4	Very low	61 Å²	61	119.2 Å²	119.2	63%	0.629	64%	0.643	S	S	*	*	S	Bend	trans	78.8	7.8	170.2	0	0	0	0	0	115.9	T322 S323	T322-G325 PolarHBondContact O-N 2.86Å; S323-G325 VanDerWaalsContact C-N 3.35Å
326	K	40	Very low	38.6	Very low	130 Å²	130	118.8 Å²	118.8	57%	0.565	64%	0.638	S	S	*	*			trans	-84.1	148.6	176.7	-59	-174.7	178.8	67	0	110.8	Y321 T322 D324	Y321-K326 WeakPolarHBondContact CA-O 3.27Å; T322-K326 PolarHBondContact N-O 3.02Å; T322-K326 WeakPolarHBondContact OG1-CB 3.35Å; T322-K326 PolarHBondContact OG1-N 3.19Å; T322-K326 PolarHBondContact OG1-O 3.45Å; T322-K326 VanDerWaalsContact OG1-O 3.11Å; D324-K326 PolarHBondContact O-N 3.49Å; D324-K326 IonicContact OD2-NZ 2.58Å; D324-K326 PolarHBondContact OD2-NZ 3.44Å
327	V	38	Very low	38.6	Very low	79 Å²	79	115.6 Å²	115.6	48%	0.479	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.5	120	178.8	-174.9	0	0	0	0	109.4	L319 Y321	L319-V327 HydrophobicContact CB-CG1 4Å; L319-V327 HydrophobicContact CD2-CG1 3.98Å; L319-V327 HydrophobicContact CG-CG1 4.43Å; Y321-V327 HydrophobicContact CD1-CG2 3.78Å; Y321-V327 HydrophobicContact CE1-CG2 3.61Å
328	L	34.5	Very low	38.6	Very low	104 Å²	104	115.3 Å²	115.3	55%	0.545	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.3	129.8	172	-98.4	156.7	0	0	0	109.6	L320 T322	L320-L328 PolarHBondContact N-O 3.37Å; L320-L328 PolarHBondContact O-N 2.87Å; T322-L328 HydrophobicContact CG2-CD1 4.14Å
329	A	37.2	Very low	38.6	Very low	54 Å²	54	111.4 Å²	111.4	45%	0.446	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.4	114.4	175.6	0	0	0	0	0	108.8	I317 L319	I317-A329 HydrophobicContact CG2-CB 4.36Å; L319-A329 HydrophobicContact CD2-CB 3.73Å
330	T	38.7	Very low	38.3	Very low	57 Å²	57	115 Å²	115	35%	0.35	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.3	158.9	176.3	57.4	0	0	0	0	111.6
331	Y	33.5	Very low	37.8	Very low	217 Å²	217	119.4 Å²	119.4	85%	0.851	66%	0.658	S	S	*	*			trans	-126.3	85	-177.5	47.1	-87.7	0	0	0	109.3	A333	Y331-A333 PolarHBondContact O-N 3.19Å
332	D	33	Very low	36.9	Very low	142 Å²	142	118.9 Å²	118.9	76%	0.759	66%	0.662	S	S	*	*			trans	-84	111.6	-174.7	-68.3	-29.1	0	0	0	112.2
333	A	28.2	Very low	35.9	Very low	102 Å²	102	124.6 Å²	124.6	84%	0.843	68%	0.679	S	S	*	*			trans	-148.7	25.7	167	0	0	0	0	0	113	Y331	Y331-A333 PolarHBondContact O-N 3.19Å
334	S	33.3	Very low	34.4	Very low	100 Å²	100	125.4 Å²	125.4	70%	0.699	67%	0.672	S	S	*	*	S	Bend	trans	-152.1	131.8	168.5	50.8	0	0	0	0	112	V336	S334-V336 PolarHBondContact O-N 3.22Å
335	F	27.8	Very low	32.5	Very low	219 Å²	219	128.4 Å²	128.4	96%	0.961	69%	0.687	S	S	*	*			trans	-74.6	101.4	177.8	-129.4	-101.6	0	0	0	108.8
336	V	30.6	Very low	31.9	Very low	113 Å²	113	131 Å²	131	69%	0.685	69%	0.691	S	S	*	*			trans	-107.8	107.3	171.2	-177.3	0	0	0	0	107.8	S334 P338	S334-V336 PolarHBondContact O-N 3.22Å; V336-P338 VanDerWaalsContact O-CD 3.27Å; V336-P338 WeakPolarHBondContact O-CD 3.42Å
337	D	32	Very low	31.3	Very low	92 Å²	92	129.9 Å²	129.9	49%	0.492	71%	0.706	S	S	.	*			trans	-65.4	116.3	-175.7	-169.1	-32.5	0	0	0	111.1	S339	D337-S339 PolarHBondContact O-N 3.26Å; D337-S339 VanDerWaalsContact O-N 3.08Å; D337-S339 VanDerWaalsContact OD1-CB 3.28Å; D337-S339 WeakPolarHBondContact OD1-CB 3.49Å; D337-S339 PolarHBondContact OD1-N 3.37Å; D337-S339 PolarHBondContact OD1-OG 3.24Å
338	P	29.8	Very low	30.8	Very low	128 Å²	128	129.4 Å²	129.4	83%	0.831	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-65.8	-10	-177.1	-22.4	35	0	0	0	114.8	V336 K340	V336-P338 VanDerWaalsContact O-CD 3.27Å; V336-P338 WeakPolarHBondContact O-CD 3.42Å; P338-K340 PolarHBondContact O-N 3.08Å
339	S	32.5	Very low	30.4	Very low	89 Å²	89	134.3 Å²	134.3	62%	0.622	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-74	-0.8	-177.4	63.8	0	0	0	0	115.4	D337	D337-S339 PolarHBondContact O-N 3.26Å; D337-S339 VanDerWaalsContact O-N 3.08Å; D337-S339 VanDerWaalsContact OD1-CB 3.28Å; D337-S339 WeakPolarHBondContact OD1-CB 3.49Å; D337-S339 PolarHBondContact OD1-N 3.37Å; D337-S339 PolarHBondContact OD1-OG 3.24Å
340	K	29.6	Very low	30.1	Very low	168 Å²	168	139.7 Å²	139.7	73%	0.73	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-113.2	21.5	-169.4	-77.7	-169.6	172.5	-178.5	0	117.2	P338	P338-K340 PolarHBondContact O-N 3.08Å
341	F	29.9	Very low	29.5	Very low	195 Å²	195	144 Å²	144	86%	0.855	77%	0.771	S	S	*	*			trans	-125.7	75.7	165.6	-79.4	-79.3	0	0	0	111.4
342	E	27.9	Very low	29.1	Very low	159 Å²	159	139 Å²	139	74%	0.743	77%	0.774	S	S	*	*			trans	-71.8	156.5	161.1	-170.5	153.7	-139.7	0	0	110.4
343	Y	29.6	Very low	28.7	Very low	170 Å²	170	136.5 Å²	136.5	67%	0.667	77%	0.774	S	S	*	*			trans	-108.4	99.6	-157.4	38.8	-83.1	0	0	0	111.5	L345	Y343-L345 PolarHBondContact O-N 2.67Å
344	D	27.6	Very low	28.7	Very low	159 Å²	159	137.9 Å²	137.9	85%	0.85	77%	0.771	S	S	*	*			trans	-91	87.5	172.4	-116.5	-32.3	0	0	0	111.2	T346	D344-T346 PolarHBondContact O-N 2.99Å
345	L	26.4	Very low	28.3	Very low	158 Å²	158	140.8 Å²	140.8	83%	0.827	78%	0.778	S	S	*	*			trans	-93.7	50.3	-174.9	-87.3	168.3	0	0	0	113.3	Y343	Y343-L345 PolarHBondContact O-N 2.67Å
346	T	30	Very low	28.2	Very low	115 Å²	115	135.8 Å²	135.8	71%	0.706	77%	0.77	S	S	*	*			trans	-137.1	125.6	178.5	58.1	0	0	0	0	116.5	D344	D344-T346 PolarHBondContact O-N 2.99Å
347	A	27.1	Very low	28.2	Very low	108 Å²	108	135 Å²	135	89%	0.893	77%	0.77	S	S	*	*			trans	72.7	145.9	156.6	0	0	0	0	0	120.4
348	G	27.3	Very low	28	Very low	68 Å²	68	138 Å²	138	70%	0.701	79%	0.786	S	S	*	*			trans	72.2	93.6	172.8	0	0	0	0	0	115.1
349	K	26.9	Very low	28	Very low	208 Å²	208	137.6 Å²	137.6	90%	0.904	78%	0.781	S	S	*	*			cis	78.6	47.8	22	-147.4	-168.5	-176.4	-177.6	0	117.1
350	E	30	Very low	28	Very low	166 Å²	166	138.5 Å²	138.5	78%	0.776	79%	0.785	S	S	*	*			trans	-153.5	159.6	154.8	46.9	-153.1	131.3	0	0	114.1
351	N	27.7	Very low	28	Very low	148 Å²	148	137.5 Å²	137.5	79%	0.791	79%	0.786	S	S	*	*			trans	68.6	42.4	168.9	-55.7	-40.7	0	0	0	119.6	A353	N351-A353 PolarHBondContact O-N 3.22Å
352	A	23.6	Very low	27.9	Very low	112 Å²	112	133.1 Å²	133.1	93%	0.926	78%	0.78	S	S	*	*			trans	-79.4	100.6	159.2	0	0	0	0	0	111
353	A	24.1	Very low	28	Very low	90 Å²	90	130.9 Å²	130.9	74%	0.744	77%	0.773	S	S	*	*			trans	-150	53.1	-175.5	0	0	0	0	0	114.5	N351	N351-A353 PolarHBondContact O-N 3.22Å
354	V	28.7	Very low	27.9	Very low	131 Å²	131	128 Å²	128	79%	0.794	77%	0.768	S	S	*	*			trans	-129	100	175.7	-177.5	0	0	0	0	112
355	L	25.6	Very low	27.9	Very low	160 Å²	160	129.8 Å²	129.8	84%	0.838	76%	0.763	S	S	*	*			trans	38.3	83.3	144.4	-67.6	160.2	0	0	0	117.9
356	S	25.3	Very low	28.1	Very low	114 Å²	114	131.2 Å²	131.2	80%	0.797	76%	0.759	S	S	*	*			trans	-70.9	129.4	147.2	-55.8	0	0	0	0	109.4
357	S	30.7	Very low	27.9	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	77%	0.771	S	S	*	*			trans	-140.6	101.9	166.2	66.6	0	0	0	0	109.7	V359	S357-V359 PolarHBondContact O-N 2.93Å; S357-V359 VanDerWaalsContact O-N 3.14Å
358	D	28.4	Very low	28	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	77%	0.765	S	S	*	*			trans	-72.1	105.8	-175.4	-54.6	-79	0	0	0	111.3
359	V	29.6	Very low	27.9	Very low	119 Å²	119	142.8 Å²	142.8	72%	0.721	77%	0.77	S	S	*	*			trans	-129.1	101.9	168.8	-177.4	0	0	0	0	108.1	S357 L361	S357-V359 PolarHBondContact O-N 2.93Å; S357-V359 VanDerWaalsContact O-N 3.14Å; V359-L361 PolarHBondContact O-N 2.89Å
360	P	32.3	Very low	28.1	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	77%	0.765	S	S	*	*			trans	-69.3	114.5	179	26.8	-32.3	0	0	0	110.3	S362	P360-S362 PolarHBondContact O-N 3.28Å
361	L	28.4	Very low	28.1	Very low	147 Å²	147	136.4 Å²	136.4	77%	0.77	77%	0.767	S	S	*	*			trans	-82.3	58.4	-176.2	-164.9	72.7	0	0	0	112.3	V359 D363 I364	V359-L361 PolarHBondContact O-N 2.89Å; L361-D363 PolarHBondContact O-N 3.02Å; L361-I364 HydrophobicContact CD2-CD1 4.17Å
362	S	28.7	Very low	28.2	Very low	103 Å²	103	133 Å²	133	72%	0.72	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	79.9	-170	59.9	0	0	0	0	114.3	P360	P360-S362 PolarHBondContact O-N 3.28Å
363	D	29.2	Very low	28.4	Very low	111 Å²	111	134.5 Å²	134.5	59%	0.594	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.8	17.5	142.2	-141.3	-12.8	0	0	0	114.8	L361 R365	L361-D363 PolarHBondContact O-N 3.02Å; D363-R365 VanDerWaalsContact C-N 3.34Å; D363-R365 PolarHBondContact O-N 3.35Å; D363-R365 IonicContact OD1-CZ 3.38Å; D363-R365 IonicContact OD1-NE 2.79Å; D363-R365 PolarHBondContact OD1-NE 2.82Å; D363-R365 IonicContact OD1-NH2 3.05Å; D363-R365 PolarHBondContact OD1-NH2 2.84Å; D363-R365 IonicContact OD2-NH2 3.37Å; D363-R365 PolarHBondContact OD2-NH2 2.93Å
364	I	28	Very low	28.7	Very low	111 Å²	111	136.5 Å²	136.5	57%	0.569	76%	0.763	S	S	*	*			trans	-79.3	87.4	174.9	-52.9	-177.2	0	0	0	109.3	L361 Y366	L361-I364 HydrophobicContact CD2-CD1 4.17Å; I364-Y366 VanDerWaalsContact C-N 3.3Å; I364-Y366 HydrophobicContact CB-CE2 4.4Å; I364-Y366 HydrophobicContact CG2-CD2 3.78Å; I364-Y366 HydrophobicContact CG2-CE2 3.45Å; I364-Y366 VanDerWaalsContact CG2-CE2 3.45Å; I364-Y366 PolarHBondContact O-N 3.05Å
365	R	27.9	Very low	28.6	Very low	196 Å²	196	137.3 Å²	137.3	74%	0.74	77%	0.768	S	S	*	*			trans	-71.4	80.7	177.3	-58.5	-179.7	-160.6	-173.5	6.1	111.1	D363	D363-R365 VanDerWaalsContact C-N 3.34Å; D363-R365 PolarHBondContact O-N 3.35Å; D363-R365 IonicContact OD1-CZ 3.38Å; D363-R365 IonicContact OD1-NE 2.79Å; D363-R365 PolarHBondContact OD1-NE 2.82Å; D363-R365 IonicContact OD1-NH2 3.05Å; D363-R365 PolarHBondContact OD1-NH2 2.84Å; D363-R365 IonicContact OD2-NH2 3.37Å; D363-R365 PolarHBondContact OD2-NH2 2.93Å
366	Y	30	Very low	28.9	Very low	188 Å²	188	135.3 Å²	135.3	74%	0.737	77%	0.768	S	S	*	*			trans	-61.8	134.6	159.8	-77.5	-82	0	0	0	109.4	I364 T368	I364-Y366 VanDerWaalsContact C-N 3.3Å; I364-Y366 HydrophobicContact CB-CE2 4.4Å; I364-Y366 HydrophobicContact CG2-CD2 3.78Å; I364-Y366 HydrophobicContact CG2-CE2 3.45Å; I364-Y366 VanDerWaalsContact CG2-CE2 3.45Å; I364-Y366 PolarHBondContact O-N 3.05Å; Y366-T368 PolarHBondContact O-N 2.94Å
367	W	26.7	Very low	29.3	Very low	252 Å²	252	135.2 Å²	135.2	96%	0.955	76%	0.763	S	S	*	*			trans	-68.3	95.6	170.1	-73.5	84.7	0	0	0	108.8	L369	W367-L369 PolarHBondContact O-N 3.05Å
368	T	29	Very low	29.4	Very low	125 Å²	125	137.9 Å²	137.9	77%	0.767	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-68.6	122	172.1	24.1	0	0	0	0	109.7	Y366 P370	Y366-T368 PolarHBondContact O-N 2.94Å; T368-P370 WeakPolarHBondContact O-CD 3.44Å
369	L	25	Very low	29.4	Very low	157 Å²	157	134.3 Å²	134.3	82%	0.822	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-57.7	125.5	168.7	-104.7	63	0	0	0	109.1	W367 S371	W367-L369 PolarHBondContact O-N 3.05Å; L369-S371 PolarHBondContact O-N 3.16Å
370	P	31.8	Very low	29.6	Very low	122 Å²	122	133.1 Å²	133.1	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-64.3	129.5	172.8	-21.3	33.7	0	0	0	110.6	T368 G372	T368-P370 WeakPolarHBondContact O-CD 3.44Å; P370-G372 PolarHBondContact O-N 2.95Å
371	S	29	Very low	29.8	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	78%	0.779	S	S	*	*			trans	-68.5	94.8	171	-59.6	0	0	0	0	109.8	L369 D373	L369-S371 PolarHBondContact O-N 3.16Å; S371-D373 PolarHBondContact O-N 3.46Å; S371-D373 VanDerWaalsContact O-N 3.1Å
372	G	29.6	Very low	30.4	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	78%	0.781	S	S	*	*			trans	-78.4	82.5	175.8	0	0	0	0	0	111.9	P370	P370-G372 PolarHBondContact O-N 2.95Å
373	D	28.1	Very low	31.2	Very low	142 Å²	142	136.3 Å²	136.3	76%	0.759	79%	0.786	S	S	*	*			trans	-67.1	161.2	163.6	-81.8	-46.8	0	0	0	111.4	S371	S371-D373 PolarHBondContact O-N 3.46Å; S371-D373 VanDerWaalsContact O-N 3.1Å
374	T	29.6	Very low	32.4	Very low	133 Å²	133	137.2 Å²	137.2	82%	0.816	80%	0.795	S	S	*	*	S	Bend	trans	68	102.8	174.8	63.2	0	0	0	0	117.4	S376	T374-S376 PolarHBondContact O-N 3Å
375	T	27.7	Very low	33.8	Very low	147 Å²	147	140.4 Å²	140.4	90%	0.902	81%	0.807	S	S	*	*			trans	-32.9	119.5	154.2	50.1	0	0	0	0	115.5
376	S	31.6	Very low	34.6	Very low	119 Å²	119	138.9 Å²	138.9	83%	0.832	80%	0.802	S	S	*	*			trans	-155.8	163.1	147.4	-160.7	0	0	0	0	110.7	T374	T374-S376 PolarHBondContact O-N 3Å
377	T	33.2	Very low	36.9	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	79%	0.788	S	S	*	*	S	Bend	trans	-82.2	158.6	-171.9	51.2	0	0	0	0	114.2	G379	T377-G379 PolarHBondContact O-N 3.32Å
378	D	34.6	Very low	39.2	Very low	152 Å²	152	124.9 Å²	124.9	81%	0.813	77%	0.773	S	S	*	*			trans	63	41.7	154.4	-49.5	-31.2	0	0	0	118.5	A380	D378-A380 PolarHBondContact O-N 2.96Å; D378-A380 VanDerWaalsContact O-N 3.13Å
379	G	28.2	Very low	41.5	Very low	81 Å²	81	126.9 Å²	126.9	84%	0.835	77%	0.774	S	S	*	*			trans	-69.8	96.5	155.5	0	0	0	0	0	111	T377	T377-G379 PolarHBondContact O-N 3.32Å
380	A	33.3	Very low	44	Very low	94 Å²	94	124.4 Å²	124.4	78%	0.777	76%	0.758	S	S	*	*			trans	-57	137.4	-178.3	0	0	0	0	0	112.5	D378 A382	D378-A380 PolarHBondContact O-N 2.96Å; D378-A380 VanDerWaalsContact O-N 3.13Å; A380-A382 PolarHBondContact O-N 3.21Å
381	T	36.7	Very low	46.5	Very low	139 Å²	139	123.7 Å²	123.7	85%	0.853	74%	0.744	S	S	*	*			trans	-59.1	110.1	172.4	40.9	0	0	0	0	109.9	K383	T381-K383 VanDerWaalsContact C-N 3.28Å; T381-K383 PolarHBondContact O-N 3.39Å
382	A	39.6	Very low	49.2	Very low	97 Å²	97	124.3 Å²	124.3	80%	0.802	73%	0.734	S	S	*	*			trans	-63.9	88.8	173.3	0	0	0	0	0	109.6	A380 V384	A380-A382 PolarHBondContact O-N 3.21Å; A382-V384 PolarHBondContact O-N 3.01Å
383	K	46.4	Very low	51.8	Low	190 Å²	190	127.6 Å²	127.6	83%	0.826	73%	0.726	S	S	*	*			trans	-61.2	121	174.8	-163	-176.6	-176.9	-166.1	0	106.9	T381 E385	T381-K383 VanDerWaalsContact C-N 3.28Å; T381-K383 PolarHBondContact O-N 3.39Å; K383-E385 VanDerWaalsContact C-N 3.34Å; K383-E385 PolarHBondContact O-N 3.37Å
384	V	54.3	Low	54.6	Low	130 Å²	130	127.8 Å²	127.8	79%	0.788	72%	0.717	S	S	*	*			trans	-67.9	98	179.2	178.5	0	0	0	0	107.8	A382 W386	A382-V384 PolarHBondContact O-N 3.01Å; V384-W386 PolarHBondContact O-N 3.06Å
385	E	57.2	Low	57.4	Low	177 Å²	177	125.5 Å²	125.5	83%	0.827	70%	0.699	S	S	*	*			trans	-81.4	114.9	-173.7	-165.5	154.7	-122.4	0	0	108.9	K383	K383-E385 VanDerWaalsContact C-N 3.34Å; K383-E385 PolarHBondContact O-N 3.37Å
386	W	44.9	Very low	60.3	Low	164 Å²	164	121.6 Å²	121.6	62%	0.621	67%	0.673	S	S	*	*			trans	-73.3	135.9	176	-89	64.9	0	0	0	109.5	V384 A388 E390	V384-W386 PolarHBondContact O-N 3.06Å; W386-A388 PolarHBondContact O-N 3.31Å; W386-E390 HydrophobicContact CE3-CB 4Å; W386-E390 HydrophobicContact CZ3-CB 4.16Å
387	P	78.7	Confident	62.7	Low	71 Å²	71	119.5 Å²	119.5	46%	0.461	66%	0.655	S	S	.	*			trans	-60	131.5	171.1	-21	32.8	0	0	0	110	E389 E390 E391	P387-E389 PolarHBondContact O-N 2.79Å; P387-E389 VanDerWaalsContact O-N 3.12Å; P387-E390 HydrophobicContact CB-CG 4.38Å; P387-E390 HydrophobicContact CG-CG 4.5Å; P387-E390 PolarHBondContact O-N 3.29Å; P387-E391 PolarHBondContact O-N 3.4Å; P387-E391 VanDerWaalsContact O-N 3.12Å
388	A	74.3	Confident	64.7	Low	76 Å²	76	117.3 Å²	117.3	63%	0.628	64%	0.639	S	S	*	*	H	α-helix	trans	-56.2	-32.6	-178.1	0	0	0	0	0	112.7	W386 E390 E391 E392	W386-A388 PolarHBondContact O-N 3.31Å; A388-E390 VanDerWaalsContact C-N 3.34Å; A388-E390 PolarHBondContact O-N 3.04Å; A388-E391 PolarHBondContact O-N 3.2Å; A388-E392 WeakPolarHBondContact O-CB 3.35Å; A388-E392 PolarHBondContact O-N 3.38Å
389	E	78.6	Confident	67	Low	167 Å²	167	115.6 Å²	115.6	78%	0.78	62%	0.621	S	S	*	*	H	α-helix	trans	-63.8	-34.2	174.6	-61.8	-179.5	-173.3	0	0	113.3	P387 K393	P387-E389 PolarHBondContact O-N 2.79Å; P387-E389 VanDerWaalsContact O-N 3.12Å; E389-K393 WeakPolarHBondContact O-CB 3.49Å; E389-K393 PolarHBondContact O-N 3.42Å; E389-K393 VanDerWaalsContact O-N 3.09Å
390	E	75.9	Confident	69.1	Low	104 Å²	104	117 Å²	117	49%	0.486	61%	0.609	S	S	.	*	H	α-helix	trans	-80.8	-35.9	177.8	-66	-160.9	121.9	0	0	111.8	W386 P387 A388 Y394	W386-E390 HydrophobicContact CE3-CB 4Å; W386-E390 HydrophobicContact CZ3-CB 4.16Å; P387-E390 HydrophobicContact CB-CG 4.38Å; P387-E390 HydrophobicContact CG-CG 4.5Å; P387-E390 PolarHBondContact O-N 3.29Å; A388-E390 VanDerWaalsContact C-N 3.34Å; A388-E390 PolarHBondContact O-N 3.04Å; E390-Y394 WeakPolarHBondContact O-CB 3.45Å; E390-Y394 PolarHBondContact O-N 2.79Å
391	E	84.2	Confident	70.3	Confident	107 Å²	107	117.9 Å²	117.9	50%	0.5	60%	0.6	S	S	.	*	H	α-helix	trans	-66.7	-45.2	171.8	-174.6	169.2	-162	0	0	111.3	P387 A388 K393 Y394 L395	P387-E391 PolarHBondContact O-N 3.4Å; P387-E391 VanDerWaalsContact O-N 3.12Å; A388-E391 PolarHBondContact O-N 3.2Å; E391-K393 PolarHBondContact O-N 3.46Å; E391-Y394 WeakPolarHBondContact O-CB 3.49Å; E391-Y394 PolarHBondContact O-N 2.89Å; E391-L395 HydrophobicContact CG-CD1 4.06Å; E391-L395 HydrophobicContact CG-CG 4.47Å; E391-L395 WeakPolarHBondContact O-CB 3.29Å; E391-L395 VanDerWaalsContact O-CG 3.29Å; E391-L395 WeakPolarHBondContact O-CG 3.38Å; E391-L395 PolarHBondContact O-N 3.22Å
392	E	86.6	Confident	71.8	Confident	131 Å²	131	116.3 Å²	116.3	61%	0.612	59%	0.586	S	S	*	*	H	α-helix	trans	-63.5	-40.3	176.7	-174.8	165.8	-126.5	0	0	111.7	A388 Y394 L395 D396	A388-E392 WeakPolarHBondContact O-CB 3.35Å; A388-E392 PolarHBondContact O-N 3.38Å; E392-Y394 PolarHBondContact O-N 2.97Å; E392-L395 PolarHBondContact O-N 2.85Å; E392-D396 WeakPolarHBondContact O-CB 3.34Å; E392-D396 PolarHBondContact O-N 2.95Å
393	K	85.3	Confident	72.8	Confident	147 Å²	147	117.5 Å²	117.5	64%	0.639	58%	0.575	S	S	*	*	H	α-helix	trans	-64.8	-35.5	173.4	-178.7	179.5	-178.4	-179.5	0	113.1	E389 E391 T397	E389-K393 WeakPolarHBondContact O-CB 3.49Å; E389-K393 PolarHBondContact O-N 3.42Å; E389-K393 VanDerWaalsContact O-N 3.09Å; E391-K393 PolarHBondContact O-N 3.46Å; K393-T397 WeakPolarHBondContact O-CB 3.38Å; K393-T397 PolarHBondContact O-N 3.06Å; K393-T397 PolarHBondContact O-OG1 3.4Å
394	Y	86.2	Confident	72.7	Confident	146 Å²	146	111.1 Å²	111.1	57%	0.573	56%	0.564	S	S	*	*	H	α-helix	trans	-69	-43.9	173	179.9	-104.7	0	0	0	111.4	E390 E391 E392 T397 L398	E390-Y394 WeakPolarHBondContact O-CB 3.45Å; E390-Y394 PolarHBondContact O-N 2.79Å; E391-Y394 WeakPolarHBondContact O-CB 3.49Å; E391-Y394 PolarHBondContact O-N 2.89Å; E392-Y394 PolarHBondContact O-N 2.97Å; Y394-T397 WeakPolarHBondContact O-CB 3.5Å; Y394-T397 PolarHBondContact O-N 3.36Å; Y394-L398 HydrophobicContact CD1-CD1 4.04Å; Y394-L398 HydrophobicContact CE1-CD1 3.54Å; Y394-L398 HydrophobicContact CE1-CG 4.31Å; Y394-L398 WeakPolarHBondContact O-CG 3.36Å; Y394-L398 PolarHBondContact O-N 3.28Å
395	L	88.7	Confident	72.1	Confident	84 Å²	84	113 Å²	113	44%	0.44	56%	0.564	S	S	.	*	H	α-helix	trans	-64.1	-37.9	175.4	-71.1	170.3	0	0	0	112.4	E391 E392 L398 R399	E391-L395 HydrophobicContact CG-CD1 4.06Å; E391-L395 HydrophobicContact CG-CG 4.47Å; E391-L395 WeakPolarHBondContact O-CB 3.29Å; E391-L395 VanDerWaalsContact O-CG 3.29Å; E391-L395 WeakPolarHBondContact O-CG 3.38Å; E391-L395 PolarHBondContact O-N 3.22Å; E392-L395 PolarHBondContact O-N 2.85Å; L395-L398 PolarHBondContact O-N 2.98Å; L395-R399 WeakPolarHBondContact O-CB 3.38Å; L395-R399 PolarHBondContact O-N 3.22Å
396	D	88.4	Confident	71.4	Confident	66 Å²	66	112.3 Å²	112.3	35%	0.353	56%	0.56	S	S	.	*	H	α-helix	trans	-69.6	-37.6	174.8	-164.5	61.9	0	0	0	111.7	E392 L398 R399 L400	E392-D396 WeakPolarHBondContact O-CB 3.34Å; E392-D396 PolarHBondContact O-N 2.95Å; D396-L398 VanDerWaalsContact C-N 3.29Å; D396-L398 PolarHBondContact O-N 3.04Å; D396-R399 WeakPolarHBondContact O-CB 3.43Å; D396-R399 PolarHBondContact O-N 3.14Å; D396-R399 VanDerWaalsContact O-N 3.14Å; D396-R399 IonicContact OD1-CZ 3.58Å; D396-R399 IonicContact OD1-NH1 3.11Å; D396-R399 PolarHBondContact OD1-NH1 3.08Å; D396-L400 WeakPolarHBondContact O-CB 3.49Å; D396-L400 WeakPolarHBondContact O-CG 3.22Å; D396-L400 PolarHBondContact O-N 2.7Å
397	T	81.6	Confident	70.8	Confident	75 Å²	75	114.1 Å²	114.1	46%	0.46	57%	0.572	S	S	.	*	H	α-helix	trans	-59.5	-39.7	170.3	-56.5	0	0	0	0	111.5	K393 Y394 L401	K393-T397 WeakPolarHBondContact O-CB 3.38Å; K393-T397 PolarHBondContact O-N 3.06Å; K393-T397 PolarHBondContact O-OG1 3.4Å; Y394-T397 WeakPolarHBondContact O-CB 3.5Å; Y394-T397 PolarHBondContact O-N 3.36Å; T397-L401 WeakPolarHBondContact O-CD1 3.43Å; T397-L401 VanDerWaalsContact O-CG 3.3Å; T397-L401 WeakPolarHBondContact O-CG 3.23Å; T397-L401 PolarHBondContact O-N 3.36Å
398	L	74.9	Confident	68.4	Low	66 Å²	66	116.8 Å²	116.8	35%	0.346	59%	0.587	S	S	.	*	H	α-helix	trans	-70.4	-37.1	173.3	-70.7	175	0	0	0	112.7	Y394 L395 D396 L401 N402	Y394-L398 HydrophobicContact CD1-CD1 4.04Å; Y394-L398 HydrophobicContact CE1-CD1 3.54Å; Y394-L398 HydrophobicContact CE1-CG 4.31Å; Y394-L398 WeakPolarHBondContact O-CG 3.36Å; Y394-L398 PolarHBondContact O-N 3.28Å; L395-L398 PolarHBondContact O-N 2.98Å; D396-L398 VanDerWaalsContact C-N 3.29Å; D396-L398 PolarHBondContact O-N 3.04Å; L398-L401 HydrophobicContact CD2-CD1 4.46Å; L398-L401 WeakPolarHBondContact O-CB 3.35Å; L398-L401 PolarHBondContact O-N 3.29Å; L398-N402 PolarHBondContact O-N 3.47Å
399	R	83.4	Confident	66.3	Low	116 Å²	116	119.6 Å²	119.6	44%	0.438	60%	0.597	S	S	.	*	H	α-helix	trans	-63.6	-47.2	177.6	-163.6	-174.3	-65	128.8	-5.3	111	L395 D396 L401 N402 E403	L395-R399 WeakPolarHBondContact O-CB 3.38Å; L395-R399 PolarHBondContact O-N 3.22Å; D396-R399 WeakPolarHBondContact O-CB 3.43Å; D396-R399 PolarHBondContact O-N 3.14Å; D396-R399 VanDerWaalsContact O-N 3.14Å; D396-R399 IonicContact OD1-CZ 3.58Å; D396-R399 IonicContact OD1-NH1 3.11Å; D396-R399 PolarHBondContact OD1-NH1 3.08Å; R399-L401 VanDerWaalsContact C-N 3.26Å; R399-L401 PolarHBondContact O-N 3.42Å; R399-N402 PolarHBondContact O-N 3.05Å; R399-N402 VanDerWaalsContact O-N 3.16Å; R399-E403 HydrophobicContact CG-CG 4.48Å; R399-E403 WeakPolarHBondContact CG-OE1 3.44Å; R399-E403 WeakPolarHBondContact O-CB 3.36Å; R399-E403 WeakPolarHBondContact O-CG 3.5Å; R399-E403 PolarHBondContact O-N 2.82Å
400	L	72	Confident	63.8	Low	111 Å²	111	121.7 Å²	121.7	58%	0.581	60%	0.603	S	S	*	*	H	α-helix	trans	-61.2	-29.4	173.8	-71.6	168.3	0	0	0	113.5	D396	D396-L400 WeakPolarHBondContact O-CB 3.49Å; D396-L400 WeakPolarHBondContact O-CG 3.22Å; D396-L400 PolarHBondContact O-N 2.7Å
401	L	59.3	Low	61.7	Low	111 Å²	111	122.6 Å²	122.6	58%	0.581	62%	0.621	S	S	*	*	H	α-helix	trans	-72.1	-43.5	173.2	-75.7	164.9	0	0	0	111.7	T397 L398 R399	T397-L401 WeakPolarHBondContact O-CD1 3.43Å; T397-L401 VanDerWaalsContact O-CG 3.3Å; T397-L401 WeakPolarHBondContact O-CG 3.23Å; T397-L401 PolarHBondContact O-N 3.36Å; L398-L401 HydrophobicContact CD2-CD1 4.46Å; L398-L401 WeakPolarHBondContact O-CB 3.35Å; L398-L401 PolarHBondContact O-N 3.29Å; R399-L401 VanDerWaalsContact C-N 3.26Å; R399-L401 PolarHBondContact O-N 3.42Å
402	N	67	Low	58.9	Low	107 Å²	107	127 Å²	127	57%	0.572	64%	0.642	S	S	*	*	H	α-helix	trans	-75.9	-36.6	-179.6	-74.9	12	0	0	0	113.5	L398 R399 G404 E405 E406	L398-N402 PolarHBondContact O-N 3.47Å; R399-N402 PolarHBondContact O-N 3.05Å; R399-N402 VanDerWaalsContact O-N 3.16Å; N402-G404 PolarHBondContact O-N 3.47Å; N402-G404 VanDerWaalsContact O-N 3.1Å; N402-E405 PolarHBondContact O-N 2.74Å; N402-E406 PolarHBondContact O-N 3.12Å
403	E	60.5	Low	56.1	Low	122 Å²	122	125.7 Å²	125.7	57%	0.57	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-16.4	175.5	-75.5	-177.3	-159.1	0	0	112.7	R399 E405	R399-E403 HydrophobicContact CG-CG 4.48Å; R399-E403 WeakPolarHBondContact CG-OE1 3.44Å; R399-E403 WeakPolarHBondContact O-CB 3.36Å; R399-E403 WeakPolarHBondContact O-CG 3.5Å; R399-E403 PolarHBondContact O-N 2.82Å; E403-E405 PolarHBondContact O-N 3.47Å
404	G	44.9	Very low	53.4	Low	56 Å²	56	124.7 Å²	124.7	58%	0.577	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-11.5	169.2	0	0	0	0	0	115.2	N402	N402-G404 PolarHBondContact O-N 3.47Å; N402-G404 VanDerWaalsContact O-N 3.1Å
405	E	42.5	Very low	50.4	Low	169 Å²	169	125.3 Å²	125.3	79%	0.79	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	-30.5	-173.8	-56.6	-159	151.2	0	0	114.6	N402 E403 K407	N402-E405 PolarHBondContact O-N 2.74Å; E403-E405 PolarHBondContact O-N 3.47Å; E405-K407 VanDerWaalsContact C-N 3.27Å; E405-K407 PolarHBondContact O-N 2.89Å; E405-K407 VanDerWaalsContact O-N 3.1Å
406	E	40.6	Very low	47.6	Very low	162 Å²	162	127.4 Å²	127.4	76%	0.757	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	0.6	-171.5	-66.8	-156.1	148.8	0	0	116.6	N402 V408	N402-E406 PolarHBondContact O-N 3.12Å; E406-V408 VanDerWaalsContact C-N 3.25Å; E406-V408 PolarHBondContact O-N 3.46Å; E406-V408 VanDerWaalsContact O-N 3.08Å
407	K	32.5	Very low	44.6	Very low	202 Å²	202	132.2 Å²	132.2	88%	0.878	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	13	-172.4	-97.8	-179.2	-179.6	171.8	0	117	E405	E405-K407 VanDerWaalsContact C-N 3.27Å; E405-K407 PolarHBondContact O-N 2.89Å; E405-K407 VanDerWaalsContact O-N 3.1Å
408	V	30.1	Very low	42.3	Very low	128 Å²	128	134.1 Å²	134.1	78%	0.776	72%	0.716	S	S	*	*	S	Bend	trans	-141.6	83.7	175.8	-169.1	0	0	0	0	112.6	E406	E406-V408 VanDerWaalsContact C-N 3.25Å; E406-V408 PolarHBondContact O-N 3.46Å; E406-V408 VanDerWaalsContact O-N 3.08Å
409	T	28.4	Very low	40.2	Very low	134 Å²	134	136.5 Å²	136.5	82%	0.822	74%	0.738	S	S	*	*			trans	-172.6	83.4	155.9	16.1	0	0	0	0	113
410	K	27	Very low	37.4	Very low	211 Å²	211	138.2 Å²	138.2	92%	0.917	76%	0.756	S	S	*	*			trans	-167.5	94.9	157.9	-121.5	168.6	-173.7	169.7	0	115.9
411	S	31.1	Very low	35.7	Very low	123 Å²	123	141.8 Å²	141.8	86%	0.86	77%	0.769	S	S	*	*			trans	-168.4	120	146.5	41.2	0	0	0	0	110
412	Q	25.2	Very low	34.1	Very low	199 Å²	199	143.3 Å²	143.3	93%	0.93	78%	0.778	S	S	*	*			trans	-140.9	109.9	178.8	-178.2	-178.6	5.9	0	0	108.4
413	S	29.5	Very low	32.3	Very low	104 Å²	104	143.1 Å²	143.1	73%	0.727	79%	0.785	S	S	*	*			trans	-155	101.6	173.5	54.4	0	0	0	0	108.5
414	T	27.8	Very low	30.6	Very low	126 Å²	126	145.5 Å²	145.5	77%	0.773	80%	0.799	S	S	*	*				94.3	117.1	89	-61	0	0	0	0	110.1
415	I	23.3	Very low	29.9	Very low	159 Å²	159	147.9 Å²	147.9	82%	0.815	81%	0.806	S	S	*	*			trans	-98	134.5	-176.3	-62.3	164.8	0	0	0	108.9
416	T	30.2	Very low	29.1	Very low	129 Å²	129	150 Å²	150	79%	0.791	81%	0.812	S	S	*	*			trans	-143.7	113.3	169.3	-47.6	0	0	0	0	110.7
417	E	25.2	Very low	28.6	Very low	167 Å²	167	147 Å²	147	78%	0.78	82%	0.816	S	S	*	*			trans	-100.4	-176.8	162.3	-62.3	-174.9	162.4	0	0	108.9
418	P	32.5	Very low	28.4	Very low	115 Å²	115	147.3 Å²	147.3	75%	0.747	82%	0.817	S	S	*	*			cis	-125.3	172.4	-40.9	30.2	-13.9	0	0	0	112
419	S	31.2	Very low	28.1	Very low	116 Å²	116	146.2 Å²	146.2	81%	0.811	82%	0.815	S	S	*	*			trans	-166.2	128.1	149.8	58.1	0	0	0	0	112
420	D	25.1	Very low	28.1	Very low	152 Å²	152	149.4 Å²	149.4	81%	0.813	82%	0.821	S	S	*	*			trans	-67.3	156.8	167.9	-49.4	-97.7	0	0	0	112.3
421	E	36.1	Very low	28.1	Very low	186 Å²	186	144.2 Å²	144.2	87%	0.869	82%	0.817	S	S	*	*			trans	-170.9	94.1	139.9	-90.1	-107.3	-170.6	0	0	110.9
422	N	25.3	Very low	27.9	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	82%	0.815	S	S	*	*			trans	9.3	119.1	142.5	-168.6	18.5	0	0	0	120.1
423	S	29.9	Very low	28.1	Very low	104 Å²	104	146 Å²	146	73%	0.727	82%	0.816	S	S	*	*				169.1	136.4	117.2	51.6	0	0	0	0	117.3
424	M	25.5	Very low	27.9	Very low	172 Å²	172	145.7 Å²	145.7	85%	0.847	81%	0.814	S	S	*	*			trans	42.5	131.5	145.8	-76.9	167.6	49	0	0	124.7
425	S	29.2	Very low	27.8	Very low	105 Å²	105	149.5 Å²	149.5	73%	0.734	82%	0.82	S	S	*	*			trans	92.6	76.9	136.6	70.1	0	0	0	0	122.4
426	K	25.3	Very low	28.2	Very low	213 Å²	213	149 Å²	149	93%	0.926	82%	0.818	S	S	*	*				57.3	75.8	112	-164.3	-172.8	-177.7	179.8	0	117.8
427	A	30.3	Very low	28	Very low	101 Å²	101	146.5 Å²	146.5	84%	0.835	82%	0.818	S	S	*	*			trans	-122.6	161	150.3	0	0	0	0	0	110.1
428	K	27.9	Very low	28.2	Very low	208 Å²	208	144 Å²	144	90%	0.904	81%	0.814	S	S	*	*			trans	-68.8	138.6	-170.7	-77.2	-176.5	173.9	-174.8	0	113.4
429	S	23.7	Very low	28	Very low	105 Å²	105	146.2 Å²	146.2	73%	0.734	81%	0.814	S	S	*	*			trans	-58.4	134.7	155.2	50.1	0	0	0	0	112.3
430	E	29.3	Very low	28	Very low	201 Å²	201	148.4 Å²	148.4	94%	0.939	82%	0.815	S	S	*	*			trans	-173.7	70.7	140.1	-105.9	159.2	-152.1	0	0	110.4
431	A	27.7	Very low	28.3	Very low	102 Å²	102	146.7 Å²	146.7	84%	0.843	81%	0.805	S	S	*	*			trans	-156.5	65.3	173.5	0	0	0	0	0	110.6
432	L	25.7	Very low	28.1	Very low	156 Å²	156	144.3 Å²	144.3	82%	0.817	80%	0.799	S	S	*	*			trans	-140.7	64.1	175.5	-167.6	69	0	0	0	112.4
433	E	29.1	Very low	28.4	Very low	202 Å²	202	144.7 Å²	144.7	94%	0.944	80%	0.801	S	S	*	*			trans	-132.4	87.6	138.4	-79.7	-153	144.7	0	0	108.2
434	S	25.3	Very low	28.6	Very low	98 Å²	98	143.8 Å²	143.8	69%	0.685	80%	0.8	S	S	*	*			trans	-96.9	110.6	157.2	50	0	0	0	0	107.9
435	F	26.7	Very low	28.8	Very low	206 Å²	206	145 Å²	145	90%	0.904	80%	0.8	S	S	*	*			trans	-169.3	170	144.5	-125.3	-108.8	0	0	0	109.4
436	I	30.1	Very low	29	Very low	148 Å²	148	146.2 Å²	146.2	76%	0.759	80%	0.798	S	S	*	*			trans	60.2	47.1	-175.2	-34.2	178.7	0	0	0	112.9	T438	I436-T438 HydrophobicContact CG2-CG2 4.32Å; I436-T438 PolarHBondContact O-N 2.97Å; I436-T438 VanDerWaalsContact O-N 3.14Å
437	G	26.3	Very low	29.5	Very low	78 Å²	78	141.9 Å²	141.9	80%	0.804	79%	0.789	S	S	*	*			trans	-62.2	110.2	151.1	0	0	0	0	0	108.2	H439	G437-H439 PolarHBondContact O-N 3.12Å
438	T	29.8	Very low	29.9	Very low	113 Å²	113	143.6 Å²	143.6	69%	0.693	79%	0.789	S	S	*	*			trans	-69.6	119.4	-172.9	35.7	0	0	0	0	111.3	I436 I440	I436-T438 HydrophobicContact CG2-CG2 4.32Å; I436-T438 PolarHBondContact O-N 2.97Å; I436-T438 VanDerWaalsContact O-N 3.14Å; T438-I440 PolarHBondContact O-N 3.29Å; T438-I440 VanDerWaalsContact O-N 3.09Å
439	H	28.8	Very low	30.1	Very low	163 Å²	163	142.1 Å²	142.1	76%	0.755	78%	0.783	S	S	*	*			trans	-74.7	97.3	-178.7	-172.9	-89	0	0	0	110.6	G437 L441	G437-H439 PolarHBondContact O-N 3.12Å; H439-L441 PolarHBondContact O-N 3.37Å; H439-L441 VanDerWaalsContact O-N 3.08Å
440	I	30.1	Very low	30.5	Very low	161 Å²	161	144.8 Å²	144.8	83%	0.826	78%	0.784	S	S	*	*			trans	-76.5	91	-178.4	-54	176.3	0	0	0	109.9	T438	T438-I440 PolarHBondContact O-N 3.29Å; T438-I440 VanDerWaalsContact O-N 3.09Å
441	L	31.9	Very low	30.7	Very low	116 Å²	116	145.2 Å²	145.2	61%	0.607	78%	0.783	S	S	*	*			trans	-137.7	117.4	167.7	-112.4	87.6	0	0	0	112.1	H439	H439-L441 PolarHBondContact O-N 3.37Å; H439-L441 VanDerWaalsContact O-N 3.08Å
442	D	32.7	Very low	30.8	Very low	137 Å²	137	150.5 Å²	150.5	73%	0.733	78%	0.781	S	S	*	*			trans	58.9	51.6	138	-56	-17.8	0	0	0	122.1	A444	D442-A444 PolarHBondContact O-N 3.11Å
443	D	31.8	Very low	31.1	Very low	149 Å²	149	153.2 Å²	153.2	80%	0.797	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-66.7	5.6	163.3	-106.8	-30.5	0	0	0	114.7	K445	D443-K445 VanDerWaalsContact C-N 3.28Å; D443-K445 PolarHBondContact O-N 2.76Å; D443-K445 VanDerWaalsContact O-N 3.15Å
444	A	33	Very low	31.1	Very low	86 Å²	86	147.9 Å²	147.9	71%	0.711	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-69.7	-11.4	-168.5	0	0	0	0	0	115.8	D442	D442-A444 PolarHBondContact O-N 3.11Å
445	K	31	Very low	31.4	Very low	196 Å²	196	154.5 Å²	154.5	85%	0.852	78%	0.781	S	S	*	*	G	3₁₀ helix	trans	-111.9	18.1	-168.3	-73.7	-174.7	177.6	176.2	0	116.6	D443	D443-K445 VanDerWaalsContact C-N 3.28Å; D443-K445 PolarHBondContact O-N 2.76Å; D443-K445 VanDerWaalsContact O-N 3.15Å
446	L	32.2	Very low	31.7	Very low	132 Å²	132	152.1 Å²	152.1	69%	0.691	78%	0.777	S	S	*	*	S	Bend	trans	-125	-2.6	177.5	-81.8	175.5	0	0	0	117.7	T448	L446-T448 PolarHBondContact O-N 2.83Å
447	V	36.8	Very low	31.8	Very low	121 Å²	121	151.9 Å²	151.9	73%	0.733	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-28.6	-165.5	-176.5	0	0	0	0	115.2	K449	V447-K449 PolarHBondContact O-N 3.41Å
448	T	37.6	Very low	32.2	Very low	138 Å²	138	153.9 Å²	153.9	85%	0.847	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-7	-161.8	55.3	0	0	0	0	117.2	L446	L446-T448 PolarHBondContact O-N 2.83Å
449	K	33.6	Very low	32.4	Very low	176 Å²	176	153 Å²	153	77%	0.765	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.8	-12.3	-172.9	-82.6	178.8	179.4	168.8	0	117.9	V447	V447-K449 PolarHBondContact O-N 3.41Å
450	Q	31.7	Very low	32.9	Very low	161 Å²	161	157.3 Å²	157.3	75%	0.752	78%	0.779	S	S	*	*			trans	-108.9	-3.3	-166.8	-145.5	164.4	-0.1	0	0	116.7	R452	Q450-R452 PolarHBondContact O-N 2.89Å
451	K	33.4	Very low	33.3	Very low	211 Å²	211	155.8 Å²	155.8	92%	0.917	77%	0.771	S	S	*	*			trans	-76.4	40.6	174.9	-151	172.9	-173.1	177	0	113.6
452	R	29.7	Very low	33.6	Very low	213 Å²	213	158.8 Å²	158.8	80%	0.804	78%	0.775	S	S	*	*	S	Bend	trans	-114.8	107.8	-179.2	-78.7	-179.7	171	163.2	-1.7	111.4	Q450 S454	Q450-R452 PolarHBondContact O-N 2.89Å; R452-S454 VanDerWaalsContact C-N 3.3Å; R452-S454 PolarHBondContact O-N 3.27Å; R452-S454 VanDerWaalsContact O-N 3.11Å
453	K	31.8	Very low	34	Very low	213 Å²	213	158 Å²	158	93%	0.926	76%	0.764	S	S	*	*			trans	52.4	34.7	160.2	-60.8	-170.9	173.7	-173.1	0	116.4	R455	K453-R455 PolarHBondContact O-N 2.96Å
454	S	29.1	Very low	34.6	Very low	90 Å²	90	151.6 Å²	151.6	63%	0.629	73%	0.731	S	S	*	*			trans	-57.7	136.5	151.1	44.7	0	0	0	0	108.2	R452 L456	R452-S454 VanDerWaalsContact C-N 3.3Å; R452-S454 PolarHBondContact O-N 3.27Å; R452-S454 VanDerWaalsContact O-N 3.11Å; S454-L456 PolarHBondContact O-N 3.36Å; S454-L456 VanDerWaalsContact O-N 3.15Å
455	R	32.3	Very low	35.5	Very low	237 Å²	237	153.7 Å²	153.7	89%	0.894	73%	0.731	S	S	*	*			trans	-56.7	121.3	172.7	-75.1	172.3	168.3	164	-7	107.7	K453 L457	K453-R455 PolarHBondContact O-N 2.96Å; R455-L457 PolarHBondContact O-N 3.1Å
456	L	31.7	Very low	36.2	Very low	155 Å²	155	150.6 Å²	150.6	81%	0.812	72%	0.719	S	S	*	*			trans	-72.8	76.8	171.3	-66.8	176.4	0	0	0	109.1	S454	S454-L456 PolarHBondContact O-N 3.36Å; S454-L456 VanDerWaalsContact O-N 3.15Å
457	L	33.4	Very low	37	Very low	144 Å²	144	146.8 Å²	146.8	75%	0.754	70%	0.703	S	S	*	*			trans	-55.3	125.4	150.3	-72.2	169.7	0	0	0	106.1	R455 T459	R455-L457 PolarHBondContact O-N 3.1Å; L457-T459 PolarHBondContact O-N 2.81Å
458	P	32.9	Very low	37.6	Very low	120 Å²	120	147.9 Å²	147.9	78%	0.779	70%	0.698	S	S	*	*			trans	-56.9	107.6	-173.9	-28.3	35.9	0	0	0	111.4	R460	P458-R460 PolarHBondContact O-N 3.42Å
459	T	35.2	Very low	37.9	Very low	93 Å²	93	144.9 Å²	144.9	57%	0.571	67%	0.674	S	S	*	*			trans	-62.5	112.3	173.1	40.6	0	0	0	0	107.2	L457 I461	L457-T459 PolarHBondContact O-N 2.81Å; T459-I461 PolarHBondContact O-N 2.96Å
460	R	38.3	Very low	38.3	Very low	255 Å²	255	142.3 Å²	142.3	96%	0.962	67%	0.669	S	S	*	*			trans	-72	28.4	-168	-133.2	177.9	-169.6	-176.7	2.5	113.7	P458	P458-R460 PolarHBondContact O-N 3.42Å
461	I	39	Very low	39.1	Very low	128 Å²	128	140.4 Å²	140.4	66%	0.656	67%	0.668	S	S	*	*	S	Bend	trans	-132.6	75.1	-159.8	-49.6	-179.2	0	0	0	109.1	T459	T459-I461 PolarHBondContact O-N 2.96Å
462	R	38.5	Very low	39.6	Very low	180 Å²	180	136.3 Å²	136.3	68%	0.679	67%	0.666	S	S	*	*			trans	53.9	128.7	149.2	-70.7	-173.6	177.6	-156.3	-0.6	118.5	C467 K468 E469	R462-C467 HydrophobicContact CB-CB 3.84Å; R462-C467 WeakPolarHBondContact CB-O 3.11Å; R462-C467 HydrophobicContact CG-CB 4.49Å; R462-K468 CarbonylContact O-C 3.58Å; R462-K468 WeakPolarHBondContact O-CA 3.42Å; R462-K468 PolarHBondContact O-N 2.89Å; R462-E469 PolarHBondContact O-N 3Å
463	K	41.7	Very low	40.4	Very low	119 Å²	119	129 Å²	129	52%	0.517	66%	0.658	S	S	.	*			cis	-164	-42	-47.1	-141.1	-165.2	-176.1	-172.1	0	111.7	C467 E469	K463-C467 HydrophobicContact CB-CB 3.52Å; K463-C467 VanDerWaalsContact N-CB 3.25Å; K463-E469 WeakPolarHBondContact CA-OE1 3.48Å; K463-E469 PolarHBondContact N-OE1 2.9Å; K463-E469 CarbonylContact O-C 3.56Å
464	C	43	Very low	41.6	Very low	16 Å²	16	119.3 Å²	119.3	11%	0.108	62%	0.616	C	S	.	*	S	Bend	trans	-173	173.3	-178.9	63.4	0	0	0	0	108.1	E466 C467 K468 C474	C464-E466 CarbonylContact O-C 3.53Å; C464-E466 PolarHBondContact O-N 2.81Å; C464-C467 WeakPolarHBondContact O-CA 3.44Å; C464-C467 VanDerWaalsContact O-CB 3.25Å; C464-C467 WeakPolarHBondContact O-CB 3.5Å; C464-C467 PolarHBondContact O-N 2.77Å; C464-K468 WeakPolarHBondContact O-CA 3.43Å; C464-C474 HydrophobicContact CB-CB 3.89Å; C464-C474 WeakPolarHBondContact CB-SG 3.29Å; C464-C474 PolarHBondContact SG-SG 2.95Å
465	N	51.9	Low	43.1	Very low	130 Å²	130	122.2 Å²	122.2	70%	0.695	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-16	-173.3	-93.6	-13.4	0	0	0	117.2	C467 K468	N465-C467 PolarHBondContact O-N 3.3Å; N465-K468 WeakPolarHBondContact O-CD 3.48Å; N465-K468 WeakPolarHBondContact O-CE 3.28Å; N465-K468 WeakPolarHBondContact O-CG 3.27Å; N465-K468 WeakPolarHBondContact OD1-CD 3.47Å
466	E	47.2	Very low	44.5	Very low	131 Å²	131	113.1 Å²	113.1	61%	0.612	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-5.7	156	42.6	64.5	159.3	0	0	116.4	C464 K480	C464-E466 CarbonylContact O-C 3.53Å; C464-E466 PolarHBondContact O-N 2.81Å; E466-K480 IonicContact OE1-NZ 3.11Å; E466-K480 PolarHBondContact OE1-NZ 3.36Å
467	C	49.1	Very low	46	Very low	51 Å²	51	108.6 Å²	108.6	35%	0.345	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-147.3	-64.3	-154.3	-81	0	0	0	0	122.2	R462 K463 C464 N465	R462-C467 HydrophobicContact CB-CB 3.84Å; R462-C467 WeakPolarHBondContact CB-O 3.11Å; R462-C467 HydrophobicContact CG-CB 4.49Å; K463-C467 HydrophobicContact CB-CB 3.52Å; K463-C467 VanDerWaalsContact N-CB 3.25Å; C464-C467 WeakPolarHBondContact O-CA 3.44Å; C464-C467 VanDerWaalsContact O-CB 3.25Å; C464-C467 WeakPolarHBondContact O-CB 3.5Å; C464-C467 PolarHBondContact O-N 2.77Å; N465-C467 PolarHBondContact O-N 3.3Å
468	K	49.4	Very low	47.4	Very low	144 Å²	144	105.7 Å²	105.7	63%	0.626	56%	0.558	S	S	*	*			cis	-145.8	139.4	17	-36.6	-177.2	178.9	-175.4	0	115.1	R462 C464 N465	R462-K468 CarbonylContact O-C 3.58Å; R462-K468 WeakPolarHBondContact O-CA 3.42Å; R462-K468 PolarHBondContact O-N 2.89Å; C464-K468 WeakPolarHBondContact O-CA 3.43Å; N465-K468 WeakPolarHBondContact O-CD 3.48Å; N465-K468 WeakPolarHBondContact O-CE 3.28Å; N465-K468 WeakPolarHBondContact O-CG 3.27Å; N465-K468 WeakPolarHBondContact OD1-CD 3.47Å
469	E	42.8	Very low	49	Very low	76 Å²	76	102.5 Å²	102.5	36%	0.355	54%	0.542	S	S	.	.			trans	-177	-174.8	-145.1	113.7	52.9	-103.2	0	0	113.5	R462 K463	R462-E469 PolarHBondContact O-N 3Å; K463-E469 WeakPolarHBondContact CA-OE1 3.48Å; K463-E469 PolarHBondContact N-OE1 2.9Å; K463-E469 CarbonylContact O-C 3.56Å
470	N	41.9	Very low	50.2	Low	122 Å²	122	102.9 Å²	102.9	65%	0.652	54%	0.535	S	S	*	.			trans	-117.4	172	-163	-89.6	-24.1	0	0	0	115.3
471	T	47.9	Very low	51.5	Low	120 Å²	120	99 Å²	99	74%	0.736	52%	0.521	S	S	*	.			trans	87.1	128.9	174	-31.6	0	0	0	0	115.1	G473	T471-G473 PolarHBondContact O-N 2.66Å
472	S	45	Very low	52.7	Low	126 Å²	126	99.4 Å²	99.4	88%	0.881	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	7.6	-170.5	40.7	0	0	0	0	117.4
473	G	46.5	Very low	54.2	Low	60 Å²	60	97.3 Å²	97.3	62%	0.619	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	24.4	-174.7	0	0	0	0	0	114.7	T471 E475	T471-G473 PolarHBondContact O-N 2.66Å; G473-E475 PolarHBondContact O-N 3.11Å
474	C	57.2	Low	55.5	Low	8 Å²	8	96.1 Å²	96.1	5%	0.054	52%	0.515	C	S	.	.			trans	-67.1	127	175.7	127.8	0	0	0	0	110.2	C464 S476 C477 L478	C464-C474 HydrophobicContact CB-CB 3.89Å; C464-C474 WeakPolarHBondContact CB-SG 3.29Å; C464-C474 PolarHBondContact SG-SG 2.95Å; C474-S476 PolarHBondContact O-N 3.47Å; C474-S476 PolarHBondContact SG-OG 3.41Å; C474-S476 VanDerWaalsContact SG-OG 3.38Å; C474-C477 HydrophobicContact CB-CB 3.87Å; C474-C477 WeakPolarHBondContact CB-SG 3.39Å; C474-C477 CarbonylContact O-C 3.59Å; C474-C477 WeakPolarHBondContact O-CA 3.39Å; C474-C477 WeakPolarHBondContact O-CB 3.39Å; C474-C477 PolarHBondContact O-N 3.14Å; C474-C477 WeakPolarHBondContact SG-CB 3.46Å; C474-C477 PolarHBondContact SG-N 3Å; C474-C477 CovalentContact SG-SG 2.05Å; C474-C477 PolarHBondContact SG-SG 3.27Å; C474-L478 WeakPolarHBondContact O-CB 3.46Å; C474-L478 PolarHBondContact O-N 3.09Å
475	E	61.2	Low	56.5	Low	151 Å²	151	98.9 Å²	98.9	71%	0.706	53%	0.529	S	S	*	.	H	α-helix	trans	-59.5	-40.4	-172.2	-170.2	177.2	-179.3	0	0	113.3	G473 C477 L478 A479	G473-E475 PolarHBondContact O-N 3.11Å; E475-C477 VanDerWaalsContact C-N 3.3Å; E475-C477 PolarHBondContact O-N 3.29Å; E475-L478 PolarHBondContact O-N 3.04Å; E475-A479 VanDerWaalsContact O-CB 3.25Å; E475-A479 WeakPolarHBondContact O-CB 3.37Å; E475-A479 PolarHBondContact O-N 3.43Å
476	S	61.8	Low	57	Low	47 Å²	47	96.5 Å²	96.5	33%	0.329	52%	0.516	S	S	.	.	H	α-helix	trans	-70.3	-25.2	173.8	60.4	0	0	0	0	113.4	C474 K480	C474-S476 PolarHBondContact O-N 3.47Å; C474-S476 PolarHBondContact SG-OG 3.41Å; C474-S476 VanDerWaalsContact SG-OG 3.38Å; S476-K480 WeakPolarHBondContact O-CB 3.49Å; S476-K480 WeakPolarHBondContact O-CD 3.34Å; S476-K480 WeakPolarHBondContact O-CG 3.44Å; S476-K480 PolarHBondContact O-N 3.46Å; S476-K480 VanDerWaalsContact O-N 3.12Å
477	C	61.5	Low	58.1	Low	59 Å²	59	92.4 Å²	92.4	40%	0.399	50%	0.502	S	S	.	.	H	α-helix	trans	-75	-42.5	174.5	-50.3	0	0	0	0	110.5	C474 E475 R481	C474-C477 HydrophobicContact CB-CB 3.87Å; C474-C477 WeakPolarHBondContact CB-SG 3.39Å; C474-C477 CarbonylContact O-C 3.59Å; C474-C477 WeakPolarHBondContact O-CA 3.39Å; C474-C477 WeakPolarHBondContact O-CB 3.39Å; C474-C477 PolarHBondContact O-N 3.14Å; C474-C477 WeakPolarHBondContact SG-CB 3.46Å; C474-C477 PolarHBondContact SG-N 3Å; C474-C477 CovalentContact SG-SG 2.05Å; C474-C477 PolarHBondContact SG-SG 3.27Å; E475-C477 VanDerWaalsContact C-N 3.3Å; E475-C477 PolarHBondContact O-N 3.29Å; C477-R481 PolarHBondContact O-N 2.99Å
478	L	64.3	Low	59	Low	84 Å²	84	96.4 Å²	96.4	44%	0.44	52%	0.52	S	S	.	.	H	α-helix	trans	-67.2	-44.5	175.7	175.5	141.9	0	0	0	110.9	C474 E475 R481 Y482	C474-L478 WeakPolarHBondContact O-CB 3.46Å; C474-L478 PolarHBondContact O-N 3.09Å; E475-L478 PolarHBondContact O-N 3.04Å; L478-R481 WeakPolarHBondContact O-CB 3.44Å; L478-R481 PolarHBondContact O-N 2.95Å; L478-R481 VanDerWaalsContact O-N 3.12Å; L478-Y482 HydrophobicContact CD1-CE2 4.29Å; L478-Y482 HydrophobicContact CD2-CD2 3.7Å; L478-Y482 HydrophobicContact CD2-CE2 3.67Å; L478-Y482 HydrophobicContact CG-CD2 3.9Å; L478-Y482 HydrophobicContact CG-CE2 3.74Å; L478-Y482 VanDerWaalsContact O-CD2 3.29Å; L478-Y482 WeakPolarHBondContact O-CD2 3.48Å; L478-Y482 PolarHBondContact O-N 3.49Å
479	A	65	Low	59.8	Low	53 Å²	53	96.8 Å²	96.8	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-59	-48.7	173.6	0	0	0	0	0	111.7	E475 R481 Y482 E483	E475-A479 VanDerWaalsContact O-CB 3.25Å; E475-A479 WeakPolarHBondContact O-CB 3.37Å; E475-A479 PolarHBondContact O-N 3.43Å; A479-R481 VanDerWaalsContact C-N 3.25Å; A479-R481 PolarHBondContact O-N 2.95Å; A479-Y482 CarbonylContact O-C 3.46Å; A479-Y482 PolarHBondContact O-N 3.21Å; A479-Y482 VanDerWaalsContact O-N 3.13Å; A479-E483 WeakPolarHBondContact O-CB 3.48Å; A479-E483 PolarHBondContact O-N 3.44Å
480	K	62	Low	60.7	Low	100 Å²	100	94.7 Å²	94.7	44%	0.435	51%	0.511	S	S	.	.	H	α-helix	trans	-59.9	-33.3	174.3	-73.5	168.9	-173.3	172.5	0	112.4	E466 S476 V484	E466-K480 IonicContact OE1-NZ 3.11Å; E466-K480 PolarHBondContact OE1-NZ 3.36Å; S476-K480 WeakPolarHBondContact O-CB 3.49Å; S476-K480 WeakPolarHBondContact O-CD 3.34Å; S476-K480 WeakPolarHBondContact O-CG 3.44Å; S476-K480 PolarHBondContact O-N 3.46Å; S476-K480 VanDerWaalsContact O-N 3.12Å; K480-V484 WeakPolarHBondContact O-CG2 3.49Å; K480-V484 PolarHBondContact O-N 3.49Å
481	R	65.5	Low	61.7	Low	173 Å²	173	95.4 Å²	95.4	65%	0.653	50%	0.504	S	S	*	.	H	α-helix	trans	-69.2	-42.4	173.9	-163.9	175.8	-173.3	176.5	0.5	112	C477 L478 A479 L485	C477-R481 PolarHBondContact O-N 2.99Å; L478-R481 WeakPolarHBondContact O-CB 3.44Å; L478-R481 PolarHBondContact O-N 2.95Å; L478-R481 VanDerWaalsContact O-N 3.12Å; A479-R481 VanDerWaalsContact C-N 3.25Å; A479-R481 PolarHBondContact O-N 2.95Å; R481-L485 HydrophobicContact CG-CD1 4.43Å; R481-L485 WeakPolarHBondContact O-CB 3.3Å; R481-L485 VanDerWaalsContact O-CG 3.29Å; R481-L485 WeakPolarHBondContact O-CG 3.45Å; R481-L485 PolarHBondContact O-N 3.23Å
482	Y	64.5	Low	62	Low	138 Å²	138	93.4 Å²	93.4	54%	0.541	50%	0.495	S	S	.	.	H	α-helix	trans	-67.6	-33.2	173	-82.3	-69.7	0	0	0	113	L478 A479 L485 N486	L478-Y482 HydrophobicContact CD1-CE2 4.29Å; L478-Y482 HydrophobicContact CD2-CD2 3.7Å; L478-Y482 HydrophobicContact CD2-CE2 3.67Å; L478-Y482 HydrophobicContact CG-CD2 3.9Å; L478-Y482 HydrophobicContact CG-CE2 3.74Å; L478-Y482 VanDerWaalsContact O-CD2 3.29Å; L478-Y482 WeakPolarHBondContact O-CD2 3.48Å; L478-Y482 PolarHBondContact O-N 3.49Å; A479-Y482 CarbonylContact O-C 3.46Å; A479-Y482 PolarHBondContact O-N 3.21Å; A479-Y482 VanDerWaalsContact O-N 3.13Å; Y482-L485 PolarHBondContact O-N 3.09Å; Y482-N486 WeakPolarHBondContact O-CB 3.48Å; Y482-N486 PolarHBondContact O-N 3.19Å; Y482-N486 PolarHBondContact O-ND2 2.96Å
483	E	68.8	Low	62.4	Low	136 Å²	136	89.2 Å²	89.2	64%	0.636	47%	0.469	S	S	*	.	H	α-helix	trans	-65.7	-44.5	175.3	-174.4	174.7	-150.9	0	0	111.1	A479 N486 S487	A479-E483 WeakPolarHBondContact O-CB 3.48Å; A479-E483 PolarHBondContact O-N 3.44Å; E483-N486 PolarHBondContact O-N 3.43Å; E483-S487 PolarHBondContact O-N 3.37Å
484	V	68.7	Low	62.6	Low	93 Å²	93	88.4 Å²	88.4	56%	0.564	45%	0.45	S	S	*	.	H	α-helix	trans	-62.1	-46.3	171.8	170.5	0	0	0	0	111.4	K480 N486 S487 V490	K480-V484 WeakPolarHBondContact O-CG2 3.49Å; K480-V484 PolarHBondContact O-N 3.49Å; V484-N486 VanDerWaalsContact C-N 3.35Å; V484-N486 PolarHBondContact O-N 3.15Å; V484-S487 WeakPolarHBondContact O-CB 3.37Å; V484-S487 PolarHBondContact O-N 3.06Å; V484-S487 PolarHBondContact O-OG 3.45Å; V484-V490 WeakPolarHBondContact O-CG2 3.32Å
485	L	63.7	Low	62.6	Low	74 Å²	74	96.8 Å²	96.8	39%	0.387	49%	0.485	S	S	.	.	H	α-helix	trans	-66	-34	178.6	-71.8	168.5	0	0	0	113.2	R481 Y482 V490	R481-L485 HydrophobicContact CG-CD1 4.43Å; R481-L485 WeakPolarHBondContact O-CB 3.3Å; R481-L485 VanDerWaalsContact O-CG 3.29Å; R481-L485 WeakPolarHBondContact O-CG 3.45Å; R481-L485 PolarHBondContact O-N 3.23Å; Y482-L485 PolarHBondContact O-N 3.09Å; L485-V490 HydrophobicContact CD2-CG1 4.44Å
486	N	62.9	Low	62.3	Low	81 Å²	81	94 Å²	94	43%	0.433	47%	0.472	S	S	.	.	H	α-helix	trans	-81.6	-14.2	176.8	-81.8	-44.4	0	0	0	113.7	Y482 E483 V484 R491	Y482-N486 WeakPolarHBondContact O-CB 3.48Å; Y482-N486 PolarHBondContact O-N 3.19Å; Y482-N486 PolarHBondContact O-ND2 2.96Å; E483-N486 PolarHBondContact O-N 3.43Å; V484-N486 VanDerWaalsContact C-N 3.35Å; V484-N486 PolarHBondContact O-N 3.15Å; N486-R491 PolarHBondContact O-NH1 2.81Å; N486-R491 PolarHBondContact OD1-NH1 3.37Å; N486-R491 PolarHBondContact OD1-NH2 3.03Å
487	S	71.4	Confident	61.9	Low	45 Å²	45	98.1 Å²	98.1	32%	0.315	48%	0.481	S	S	.	.	S	Bend	trans	-55.5	140.5	-178.5	73	0	0	0	0	111.5	E483 V484 Y489 V490 R491	E483-S487 PolarHBondContact O-N 3.37Å; V484-S487 WeakPolarHBondContact O-CB 3.37Å; V484-S487 PolarHBondContact O-N 3.06Å; V484-S487 PolarHBondContact O-OG 3.45Å; S487-Y489 PolarHBondContact O-N 3.48Å; S487-V490 PolarHBondContact O-N 3.19Å; S487-R491 WeakPolarHBondContact O-CB 3.29Å; S487-R491 PolarHBondContact O-N 2.73Å
488	N	66.2	Low	61.5	Low	134 Å²	134	102.8 Å²	102.8	72%	0.717	50%	0.502	S	S	*	.	H	α-helix	trans	-54.6	-35.1	-172.9	-67	-8.3	0	0	0	112.9	R491 S492	N488-R491 PolarHBondContact O-N 3.32Å; N488-S492 WeakPolarHBondContact O-CB 3.33Å; N488-S492 PolarHBondContact O-N 2.74Å; N488-S492 PolarHBondContact O-OG 2.79Å
489	Y	67.1	Low	60.6	Low	152 Å²	152	103.1 Å²	103.1	60%	0.596	50%	0.504	S	S	*	.	H	α-helix	trans	-61.2	-51.3	175.5	-179.5	-100.5	0	0	0	112.7	S487 R491 S492 A493	S487-Y489 PolarHBondContact O-N 3.48Å; Y489-R491 VanDerWaalsContact C-N 3.33Å; Y489-S492 PolarHBondContact O-N 3.31Å; Y489-A493 WeakPolarHBondContact O-CB 3.29Å; Y489-A493 PolarHBondContact O-N 3.46Å
490	V	62.4	Low	59.7	Low	33 Å²	33	105.3 Å²	105.3	20%	0.2	51%	0.509	C	S	.	.	H	α-helix	trans	-68.5	-36.1	178.2	178	0	0	0	0	110.8	V484 L485 S487 A493 L494	V484-V490 WeakPolarHBondContact O-CG2 3.32Å; L485-V490 HydrophobicContact CD2-CG1 4.44Å; S487-V490 PolarHBondContact O-N 3.19Å; V490-A493 PolarHBondContact O-N 2.84Å; V490-L494 HydrophobicContact CG1-CD1 3.81Å; V490-L494 HydrophobicContact CG1-CG 4.24Å; V490-L494 WeakPolarHBondContact O-CB 3.49Å; V490-L494 WeakPolarHBondContact O-CG 3.21Å; V490-L494 PolarHBondContact O-N 3.09Å
491	R	61.4	Low	58.9	Low	136 Å²	136	105 Å²	105	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-66	-40.9	177.9	-148.1	-175.2	-152.6	87	10.5	112.5	N486 S487 N488 Y489 K495	N486-R491 PolarHBondContact O-NH1 2.81Å; N486-R491 PolarHBondContact OD1-NH1 3.37Å; N486-R491 PolarHBondContact OD1-NH2 3.03Å; S487-R491 WeakPolarHBondContact O-CB 3.29Å; S487-R491 PolarHBondContact O-N 2.73Å; N488-R491 PolarHBondContact O-N 3.32Å; Y489-R491 VanDerWaalsContact C-N 3.33Å; R491-K495 VanDerWaalsContact O-CB 3.32Å; R491-K495 WeakPolarHBondContact O-CB 3.42Å; R491-K495 PolarHBondContact O-N 3.02Å; R491-K495 VanDerWaalsContact O-N 3.13Å
492	S	56	Low	57.8	Low	78 Å²	78	98.7 Å²	98.7	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-64.7	-50.4	172.3	-73.5	0	0	0	0	111.2	N488 Y489 L494 K495 E496	N488-S492 WeakPolarHBondContact O-CB 3.33Å; N488-S492 PolarHBondContact O-N 2.74Å; N488-S492 PolarHBondContact O-OG 2.79Å; Y489-S492 PolarHBondContact O-N 3.31Å; S492-L494 VanDerWaalsContact C-N 3.34Å; S492-L494 PolarHBondContact O-N 3.29Å; S492-K495 PolarHBondContact O-N 3.15Å; S492-K495 VanDerWaalsContact O-N 3.13Å; S492-E496 WeakPolarHBondContact O-CB 3.49Å; S492-E496 PolarHBondContact O-N 2.95Å
493	A	52.1	Low	56.8	Low	39 Å²	39	97.4 Å²	97.4	32%	0.322	50%	0.502	S	S	.	.	H	α-helix	trans	-60.1	-40.2	-179.6	0	0	0	0	0	112.9	Y489 V490 Y497	Y489-A493 WeakPolarHBondContact O-CB 3.29Å; Y489-A493 PolarHBondContact O-N 3.46Å; V490-A493 PolarHBondContact O-N 2.84Å; A493-Y497 VanDerWaalsContact O-CD2 3.27Å; A493-Y497 WeakPolarHBondContact O-CD2 3.43Å
494	L	50.2	Low	55.7	Low	42 Å²	42	96.2 Å²	96.2	22%	0.22	50%	0.498	C	S	.	.	H	α-helix	trans	-68.4	-37.8	175.6	-73.3	171.6	0	0	0	112.5	V490 S492 D498 L499 I501	V490-L494 HydrophobicContact CG1-CD1 3.81Å; V490-L494 HydrophobicContact CG1-CG 4.24Å; V490-L494 WeakPolarHBondContact O-CB 3.49Å; V490-L494 WeakPolarHBondContact O-CG 3.21Å; V490-L494 PolarHBondContact O-N 3.09Å; S492-L494 VanDerWaalsContact C-N 3.34Å; S492-L494 PolarHBondContact O-N 3.29Å; L494-D498 PolarHBondContact O-N 2.98Å; L494-L499 HydrophobicContact CD2-CB 4.19Å; L494-L499 PolarHBondContact O-N 3.19Å; L494-I501 HydrophobicContact CD1-CD1 4.23Å
495	K	58	Low	54.1	Low	185 Å²	185	97.1 Å²	97.1	80%	0.804	50%	0.498	S	S	*	.	H	α-helix	trans	-73.9	-25.1	179.5	-163.5	-178.2	-179.2	-168.8	0	113	R491 S492 Y497	R491-K495 VanDerWaalsContact O-CB 3.32Å; R491-K495 WeakPolarHBondContact O-CB 3.42Å; R491-K495 PolarHBondContact O-N 3.02Å; R491-K495 VanDerWaalsContact O-N 3.13Å; S492-K495 PolarHBondContact O-N 3.15Å; S492-K495 VanDerWaalsContact O-N 3.13Å; K495-Y497 VanDerWaalsContact C-N 3.35Å
496	E	55.1	Low	52.9	Low	92 Å²	92	99.8 Å²	99.8	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-76.3	-20.1	177.7	-167.8	166.6	-143.5	0	0	113.2	S492	S492-E496 WeakPolarHBondContact O-CB 3.49Å; S492-E496 PolarHBondContact O-N 2.95Å
497	Y	53.7	Low	51.5	Low	133 Å²	133	100.8 Å²	100.8	52%	0.522	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	3.9	179.6	-64.6	-66.2	0	0	0	115.2	A493 K495 L499	A493-Y497 VanDerWaalsContact O-CD2 3.27Å; A493-Y497 WeakPolarHBondContact O-CD2 3.43Å; K495-Y497 VanDerWaalsContact C-N 3.35Å; Y497-L499 PolarHBondContact O-N 2.93Å; Y497-L499 VanDerWaalsContact O-N 3.14Å
498	D	52.5	Low	49.8	Very low	157 Å²	157	105.4 Å²	105.4	84%	0.84	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	37.1	-178.9	-148.5	24.5	0	0	0	113.7	L494 D500	L494-D498 PolarHBondContact O-N 2.98Å; D498-D500 PolarHBondContact O-N 2.97Å
499	L	45.9	Very low	48.3	Very low	91 Å²	91	107 Å²	107	48%	0.476	55%	0.55	S	S	.	.			trans	-81.1	108.6	-167.8	-126.9	81	0	0	0	111.8	L494 Y497 I501	L494-L499 HydrophobicContact CD2-CB 4.19Å; L494-L499 PolarHBondContact O-N 3.19Å; Y497-L499 PolarHBondContact O-N 2.93Å; Y497-L499 VanDerWaalsContact O-N 3.14Å; L499-I501 PolarHBondContact O-N 3.36Å; L499-I501 VanDerWaalsContact O-N 3.14Å
500	D	46.4	Very low	46.7	Very low	100 Å²	100	108 Å²	108	54%	0.535	56%	0.56	S	S	.	*			trans	-60	115.2	171.3	172.1	25.4	0	0	0	111.4	D498 G502 N503	D498-D500 PolarHBondContact O-N 2.97Å; D500-G502 PolarHBondContact O-N 3.24Å; D500-G502 PolarHBondContact OD1-N 3.35Å; D500-N503 PolarHBondContact O-N 3.13Å; D500-N503 PolarHBondContact OD2-ND2 3.08Å
501	I	43.6	Very low	45.4	Very low	94 Å²	94	111.8 Å²	111.8	48%	0.482	59%	0.585	S	S	.	*	H	α-helix	trans	-63.1	-27.1	-178	-59.4	175.4	0	0	0	111.6	L494 L499	L494-I501 HydrophobicContact CD1-CD1 4.23Å; L499-I501 PolarHBondContact O-N 3.36Å; L499-I501 VanDerWaalsContact O-N 3.14Å
502	G	44.2	Very low	44	Very low	39 Å²	39	108.4 Å²	108.4	40%	0.402	59%	0.592	S	S	.	*	H	α-helix	trans	-59.8	-54.5	179.4	0	0	0	0	0	112.3	D500 M504 L505 D506	D500-G502 PolarHBondContact O-N 3.24Å; D500-G502 PolarHBondContact OD1-N 3.35Å; G502-M504 VanDerWaalsContact C-N 3.26Å; G502-M504 PolarHBondContact O-N 3.05Å; G502-L505 PolarHBondContact O-N 2.9Å; G502-L505 VanDerWaalsContact O-N 3.09Å; G502-D506 PolarHBondContact O-N 3.36Å
503	N	43.2	Very low	43.1	Very low	112 Å²	112	110.4 Å²	110.4	60%	0.599	60%	0.603	S	S	*	*	H	α-helix	trans	-64.2	-26.1	-176.7	-77.1	-66.6	0	0	0	114	D500 L505 C507	D500-N503 PolarHBondContact O-N 3.13Å; D500-N503 PolarHBondContact OD2-ND2 3.08Å; N503-L505 VanDerWaalsContact C-N 3.32Å; N503-C507 PolarHBondContact O-SG 3.16Å; N503-C507 VanDerWaalsContact O-SG 3.33Å
504	M	44.3	Very low	42.3	Very low	111 Å²	111	114.2 Å²	114.2	55%	0.547	64%	0.635	S	S	.	*	H	α-helix	trans	-76.2	-18.7	177.3	-162.4	176.1	67	0	0	113.1	G502	G502-M504 VanDerWaalsContact C-N 3.26Å; G502-M504 PolarHBondContact O-N 3.05Å
505	L	36.6	Very low	41.5	Very low	111 Å²	111	114.9 Å²	114.9	58%	0.581	65%	0.652	S	S	*	*	H	α-helix	trans	-88.5	-28.5	173.5	-66.8	175.4	0	0	0	112.7	G502 N503 C507	G502-L505 PolarHBondContact O-N 2.9Å; G502-L505 VanDerWaalsContact O-N 3.09Å; N503-L505 VanDerWaalsContact C-N 3.32Å; L505-C507 PolarHBondContact O-N 3.47Å
506	D	37.3	Very low	40.1	Very low	131 Å²	131	109.4 Å²	109.4	70%	0.701	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	2.5	175.8	-86.2	-10.1	0	0	0	114.2	G502 D508	G502-D506 PolarHBondContact O-N 3.36Å; D506-D508 PolarHBondContact O-N 3.03Å
507	C	34.4	Very low	39	Very low	102 Å²	102	110.9 Å²	110.9	69%	0.689	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-5.6	172.3	-74.1	0	0	0	0	114.2	N503 L505 Q509	N503-C507 PolarHBondContact O-SG 3.16Å; N503-C507 VanDerWaalsContact O-SG 3.33Å; L505-C507 PolarHBondContact O-N 3.47Å; C507-Q509 PolarHBondContact O-N 3.42Å; C507-Q509 VanDerWaalsContact O-N 3.16Å
508	D	35.3	Very low	38.1	Very low	142 Å²	142	112.6 Å²	112.6	76%	0.759	68%	0.683	S	S	*	*	S	Bend	trans	-78	29.1	172.5	-100.5	-8.6	0	0	0	113.7	D506	D506-D508 PolarHBondContact O-N 3.03Å
509	Q	35	Very low	37	Very low	167 Å²	167	111 Å²	111	78%	0.78	68%	0.679	S	S	*	*			trans	-162.6	106.3	167	-105.8	138.7	112	0	0	114.5	C507	C507-Q509 PolarHBondContact O-N 3.42Å; C507-Q509 VanDerWaalsContact O-N 3.16Å
510	E	33.4	Very low	36.2	Very low	172 Å²	172	114.2 Å²	114.2	80%	0.804	69%	0.689	S	S	*	*			trans	-167.4	120.4	131.2	-105.1	-49.6	142.5	0	0	110.1	G512	E510-G512 PolarHBondContact O-N 3.35Å
511	P	35.2	Very low	35.4	Very low	114 Å²	114	115.6 Å²	115.6	74%	0.74	70%	0.701	S	S	*	*			trans	-69	94.3	176.5	-20.8	34.5	0	0	0	112.3
512	G	30.9	Very low	34.6	Very low	64 Å²	64	118 Å²	118	66%	0.66	71%	0.714	S	S	*	*			trans	-45	132.3	177.4	0	0	0	0	0	112.6	E510 A514	E510-G512 PolarHBondContact O-N 3.35Å; G512-A514 PolarHBondContact O-N 2.95Å
513	P	36.9	Very low	33.9	Very low	120 Å²	120	121.4 Å²	121.4	78%	0.779	73%	0.727	S	S	*	*			trans	-59.4	128.9	-162.7	20.6	-32.9	0	0	0	112.3	G515	P513-G515 PolarHBondContact O-N 3.42Å
514	A	35.4	Very low	33	Very low	120 Å²	120	122 Å²	122	99%	0.992	73%	0.734	S	S	*	*	S	Bend	trans	-72.5	32	-170.2	0	0	0	0	0	115.5	G512	G512-A514 PolarHBondContact O-N 2.95Å
515	G	33.3	Very low	32.3	Very low	56 Å²	56	127.4 Å²	127.4	58%	0.577	75%	0.749	S	S	*	*	S	Bend	trans	-147.7	118.3	172.1	0	0	0	0	0	109.9	P513	P513-G515 PolarHBondContact O-N 3.42Å
516	G	29.8	Very low	31.8	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	76%	0.76	S	S	*	*			trans	-60.1	159.8	171.5	0	0	0	0	0	112.1
517	P	32.2	Very low	31.4	Very low	123 Å²	123	128.7 Å²	128.7	80%	0.799	76%	0.763	S	S	*	*			trans	-57.9	140.2	-168.9	21.2	-32.9	0	0	0	113.7	V519	P517-V519 PolarHBondContact O-N 2.9Å
518	L	34.1	Very low	31.2	Very low	170 Å²	170	133.3 Å²	133.3	89%	0.89	77%	0.772	S	S	*	*			trans	-74.9	93.6	-175.9	-177.1	69.7	0	0	0	111.5	K520	L518-K520 PolarHBondContact O-N 3.16Å
519	V	29.6	Very low	30.8	Very low	124 Å²	124	132.5 Å²	132.5	75%	0.752	78%	0.777	S	S	*	*			trans	-67.8	109.7	178.2	-176.8	0	0	0	0	111	P517 T521	P517-V519 PolarHBondContact O-N 2.9Å; V519-T521 PolarHBondContact O-N 3.05Å
520	K	29	Very low	30.5	Very low	157 Å²	157	129.4 Å²	129.4	68%	0.683	78%	0.78	S	S	*	*			trans	-71.6	118.1	168	-73.3	-175	177.9	-178.6	0	109.2	L518 I522 I1011	L518-K520 PolarHBondContact O-N 3.16Å; K520-I522 PolarHBondContact O-N 3.36Å; K520-I1011 PolarHBondContact NZ-O 3.44Å; K520-I1011 VanDerWaalsContact NZ-O 3.12Å
521	T	28.9	Very low	30.1	Very low	130 Å²	130	127 Å²	127	80%	0.798	78%	0.782	S	S	*	*			trans	-74.2	103.1	177.5	-42.7	0	0	0	0	111.7	V519	V519-T521 PolarHBondContact O-N 3.05Å
522	I	27.9	Very low	29.8	Very low	145 Å²	145	126.6 Å²	126.6	74%	0.744	78%	0.779	S	S	*	*			trans	-90.3	118.4	176.3	-59.7	178.5	0	0	0	109.5	K520 T524	K520-I522 PolarHBondContact O-N 3.36Å; I522-T524 HydrophobicContact CG2-CG2 4.39Å
523	T	29.2	Very low	29.5	Very low	110 Å²	110	130.4 Å²	130.4	68%	0.675	79%	0.789	S	S	*	*			trans	-101.9	90.9	178.2	-52.1	0	0	0	0	110.7	R525	T523-R525 PolarHBondContact O-N 2.97Å; T523-R525 VanDerWaalsContact O-N 3.13Å
524	T	24.9	Very low	29.1	Very low	124 Å²	124	128.3 Å²	128.3	76%	0.761	78%	0.782	S	S	*	*			trans	-71.8	99.5	177.4	30.7	0	0	0	0	111.8	I522 I526	I522-T524 HydrophobicContact CG2-CG2 4.39Å; T524-I526 PolarHBondContact O-N 3.14Å
525	R	28.3	Very low	29	Very low	224 Å²	224	130.5 Å²	130.5	85%	0.845	77%	0.772	S	S	*	*			trans	-85.2	107.3	171.2	-69.6	-177	176.4	179.6	-1.3	110.4	T523 S527	T523-R525 PolarHBondContact O-N 2.97Å; T523-R525 VanDerWaalsContact O-N 3.13Å; R525-S527 PolarHBondContact O-N 3.45Å; R525-S527 VanDerWaalsContact O-N 3.17Å
526	I	27.2	Very low	28.6	Very low	160 Å²	160	136.2 Å²	136.2	82%	0.821	78%	0.783	S	S	*	*			trans	-77.2	99.2	171.2	-58.5	176.5	0	0	0	108.7	T524 K528	T524-I526 PolarHBondContact O-N 3.14Å; I526-K528 PolarHBondContact O-N 3.02Å
527	S	29.1	Very low	28.9	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	79%	0.793	S	S	*	*			trans	-79.7	102.5	174.7	52	0	0	0	0	110.9	R525	R525-S527 PolarHBondContact O-N 3.45Å; R525-S527 VanDerWaalsContact O-N 3.17Å
528	K	29.7	Very low	28.7	Very low	199 Å²	199	144 Å²	144	87%	0.865	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-67.3	134.5	161.7	-80.1	-173.8	172.4	-177.6	0	109.4	I526	I526-K528 PolarHBondContact O-N 3.02Å
529	S	27.4	Very low	28.8	Very low	125 Å²	125	141.6 Å²	141.6	87%	0.874	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-69.2	144.2	174.8	36.9	0	0	0	0	111.3
530	A	28.2	Very low	28.7	Very low	101 Å²	101	143.1 Å²	143.1	84%	0.835	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-99.7	139.9	174.2	0	0	0	0	0	110.5
531	S	25.6	Very low	29.4	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-95.3	139.1	170.6	-164.1	0	0	0	0	109.8
532	P	28.5	Very low	29.4	Very low	106 Å²	106	143.3 Å²	143.3	69%	0.688	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-99.8	153.1	-172.7	37.3	-34.7	0	0	0	114.8
533	V	25.2	Very low	29.7	Very low	144 Å²	144	141.6 Å²	141.6	87%	0.873	81%	0.807	S	S	*	*			trans	58.9	118	146	176.9	0	0	0	0	119.6
534	A	28.2	Very low	29.6	Very low	76 Å²	76	141.5 Å²	141.5	63%	0.628	81%	0.81	S	S	*	*				-167.6	155.7	125.3	0	0	0	0	0	111
535	E	31.8	Very low	29.9	Very low	167 Å²	167	143.2 Å²	143.2	78%	0.78	81%	0.814	S	S	*	*			trans	27.4	119.9	161.3	-68.7	122.3	-114.1	0	0	120.6
536	E	26.6	Very low	30.1	Very low	175 Å²	175	141.6 Å²	141.6	82%	0.818	82%	0.816	S	S	*	*				71.4	113.3	63.7	-68.5	-178	-162.1	0	0	114.8
537	N	35.7	Very low	30.4	Very low	172 Å²	172	143.9 Å²	143.9	92%	0.92	82%	0.82	S	S	*	*			trans	-173.7	155.1	135	-103	-71.5	0	0	0	110.9
538	E	28.4	Very low	30.5	Very low	183 Å²	183	144.3 Å²	144.3	86%	0.855	82%	0.82	S	S	*	*			trans	-103.6	149.8	-176.9	-55.8	174.6	128.2	0	0	111.9
539	S	35.7	Very low	30.6	Very low	120 Å²	120	139.5 Å²	139.5	84%	0.839	82%	0.818	S	S	*	*			trans	167.8	154.6	137.1	39.4	0	0	0	0	112.5
540	D	27.7	Very low	30.8	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	81%	0.811	S	S	*	*			trans	-79.6	156.8	-178.5	-46.6	-97.1	0	0	0	113.9
541	V	42.5	Very low	31.2	Very low	139 Å²	139	140.3 Å²	140.3	84%	0.842	80%	0.804	S	S	*	*				-172.2	143.4	123.4	143.1	0	0	0	0	109.5
542	D	30	Very low	31.7	Very low	152 Å²	152	143.2 Å²	143.2	81%	0.813	80%	0.804	S	S	*	*			trans	-90.4	122.7	178.4	177.5	28	0	0	0	111.8
543	S	34.6	Very low	32.1	Very low	108 Å²	108	144 Å²	144	76%	0.755	81%	0.808	S	S	*	*			trans	-158.4	150.6	161.2	62.2	0	0	0	0	111.4
544	C	26.8	Very low	32.4	Very low	109 Å²	109	143.9 Å²	143.9	74%	0.736	80%	0.801	S	S	*	*			trans	-94.3	175.6	-176.5	-72.8	0	0	0	0	113.6
545	D	31.5	Very low	32.8	Very low	159 Å²	159	147.4 Å²	147.4	85%	0.85	81%	0.808	S	S	*	*			trans	86.3	159.1	165.4	-62.2	-47.2	0	0	0	119.9
546	E	32.8	Very low	33	Very low	190 Å²	190	148.7 Å²	148.7	89%	0.888	81%	0.807	S	S	*	*			trans	53.5	82	-179.9	-55.4	-137.9	137.1	0	0	117.8	P548	E546-P548 WeakPolarHBondContact O-CD 3.34Å
547	K	31.6	Very low	33.7	Very low	208 Å²	208	144.6 Å²	144.6	90%	0.904	80%	0.798	S	S	*	*			trans	-81.9	113.1	167.1	-166	173.6	-168.3	169.3	0	110.2
548	P	32.9	Very low	33.7	Very low	119 Å²	119	140.8 Å²	140.8	77%	0.773	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-68.2	153	-172.7	26.9	-35.1	0	0	0	113.1	E546 N550	E546-P548 WeakPolarHBondContact O-CD 3.34Å; P548-N550 PolarHBondContact O-N 3.37Å
549	A	30.9	Very low	34	Very low	99 Å²	99	138.3 Å²	138.3	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-63.4	125.8	-177.8	0	0	0	0	0	112
550	N	31.8	Very low	33.9	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-69	122.3	172.2	175.9	58.8	0	0	0	109.4	P548 E552	P548-N550 PolarHBondContact O-N 3.37Å; N550-E552 PolarHBondContact O-N 3.03Å
551	P	37.4	Very low	34.5	Very low	106 Å²	106	137.8 Å²	137.8	69%	0.688	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-62	131.9	-177.7	24.8	-33.9	0	0	0	110.9	T553	P551-T553 PolarHBondContact O-N 2.9Å; P551-T553 VanDerWaalsContact O-N 3.08Å
552	E	35.7	Very low	34.2	Very low	181 Å²	181	140.4 Å²	140.4	85%	0.846	76%	0.761	S	S	*	*			trans	-64.7	111	-175.5	-63	-172.7	127.8	0	0	110.7	N550 L554	N550-E552 PolarHBondContact O-N 3.03Å; E552-L554 VanDerWaalsContact C-N 3.29Å; E552-L554 PolarHBondContact O-N 2.96Å
553	T	35.6	Very low	34.6	Very low	124 Å²	124	139 Å²	139	76%	0.761	76%	0.757	S	S	*	*			trans	-70.2	92.1	168.3	32.5	0	0	0	0	108.6	P551 I555	P551-T553 PolarHBondContact O-N 2.9Å; P551-T553 VanDerWaalsContact O-N 3.08Å; T553-I555 VanDerWaalsContact C-N 3.32Å; T553-I555 PolarHBondContact O-N 3.48Å
554	L	32.1	Very low	35	Very low	141 Å²	141	139.1 Å²	139.1	74%	0.738	75%	0.754	S	S	*	*			trans	-68.3	85	-174.3	-142.6	163.5	0	0	0	110.3	E552 Y556	E552-L554 VanDerWaalsContact C-N 3.29Å; E552-L554 PolarHBondContact O-N 2.96Å; L554-Y556 HydrophobicContact CD2-CD2 4.16Å; L554-Y556 PolarHBondContact O-N 2.93Å
555	I	36.7	Very low	35.3	Very low	149 Å²	149	138.7 Å²	138.7	76%	0.764	75%	0.75	S	S	*	*			trans	-67.8	96.3	177.5	-61	175.1	0	0	0	108	T553 S557	T553-I555 VanDerWaalsContact C-N 3.32Å; T553-I555 PolarHBondContact O-N 3.48Å; I555-S557 VanDerWaalsContact C-N 3.29Å; I555-S557 PolarHBondContact O-N 3.29Å
556	Y	37	Very low	35.5	Very low	195 Å²	195	135.8 Å²	135.8	77%	0.765	74%	0.739	S	S	*	*			trans	-71.1	86.2	175.5	-140.5	-89.9	0	0	0	109.6	L554 S558	L554-Y556 HydrophobicContact CD2-CD2 4.16Å; L554-Y556 PolarHBondContact O-N 2.93Å; Y556-S558 PolarHBondContact O-N 2.73Å
557	S	39.7	Very low	36	Very low	89 Å²	89	131.8 Å²	131.8	62%	0.622	73%	0.73	S	S	*	*			trans	-70.5	93.4	172.9	-179.1	0	0	0	0	109	I555 D559	I555-S557 VanDerWaalsContact C-N 3.29Å; I555-S557 PolarHBondContact O-N 3.29Å; S557-D559 PolarHBondContact O-N 2.82Å
558	S	35.6	Very low	36.8	Very low	92 Å²	92	131.8 Å²	131.8	64%	0.643	73%	0.726	S	S	*	*			trans	-61.6	102.3	169.7	-63.3	0	0	0	0	109.7	Y556 E560	Y556-S558 PolarHBondContact O-N 2.73Å; S558-E560 VanDerWaalsContact C-N 3.28Å; S558-E560 PolarHBondContact O-N 3.06Å
559	D	35	Very low	37.9	Very low	130 Å²	130	130.1 Å²	130.1	70%	0.695	71%	0.71	S	S	*	*			trans	-67.2	84.4	173.9	-91.8	4	0	0	0	109.6	S557 V561	S557-D559 PolarHBondContact O-N 2.82Å; D559-V561 PolarHBondContact O-N 3.14Å
560	E	35	Very low	39.1	Very low	141 Å²	141	128.7 Å²	128.7	66%	0.659	69%	0.688	S	S	*	*			trans	-62.6	102.7	173.5	-72.1	-166.8	154.6	0	0	110.1	S558 Y562	S558-E560 VanDerWaalsContact C-N 3.28Å; S558-E560 PolarHBondContact O-N 3.06Å; E560-Y562 HydrophobicContact CB-CE2 4.49Å; E560-Y562 WeakPolarHBondContact O-CD2 3.37Å; E560-Y562 PolarHBondContact O-N 3.25Å; E560-Y562 PolarHBondContact OE2-OH 3.38Å
561	V	39.5	Very low	40.4	Very low	126 Å²	126	128.9 Å²	128.9	76%	0.764	68%	0.684	S	S	*	*			trans	-73.6	91.7	177.6	-177.2	0	0	0	0	109	D559 V563	D559-V561 PolarHBondContact O-N 3.14Å; V561-V563 VanDerWaalsContact C-N 3.3Å; V561-V563 HydrophobicContact CG1-CG2 4.43Å; V561-V563 PolarHBondContact O-N 2.86Å
562	Y	35.5	Very low	41.6	Very low	193 Å²	193	130 Å²	130	76%	0.757	68%	0.68	S	S	*	*			trans	-61.7	88.5	170.5	-69.1	-74.9	0	0	0	111.2	E560 T564	E560-Y562 HydrophobicContact CB-CE2 4.49Å; E560-Y562 WeakPolarHBondContact O-CD2 3.37Å; E560-Y562 PolarHBondContact O-N 3.25Å; E560-Y562 PolarHBondContact OE2-OH 3.38Å; Y562-T564 VanDerWaalsContact C-N 3.33Å; Y562-T564 PolarHBondContact O-N 3.27Å
563	V	39.1	Very low	43.3	Very low	123 Å²	123	127.6 Å²	127.6	75%	0.745	66%	0.664	S	S	*	*			trans	-66.7	97.2	162.8	-177.7	0	0	0	0	106.9	V561	V561-V563 VanDerWaalsContact C-N 3.3Å; V561-V563 HydrophobicContact CG1-CG2 4.43Å; V561-V563 PolarHBondContact O-N 2.86Å
564	T	43.1	Very low	44.8	Very low	110 Å²	110	124.6 Å²	124.6	68%	0.675	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-61.7	126.1	166.4	-53.9	0	0	0	0	106.5	Y562	Y562-T564 VanDerWaalsContact C-N 3.33Å; Y562-T564 PolarHBondContact O-N 3.27Å
565	P	33.6	Very low	46.7	Very low	101 Å²	101	123.3 Å²	123.3	66%	0.656	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-55.6	143.4	176.3	23.8	-33.3	0	0	0	109
566	P	34.2	Very low	47.7	Very low	97 Å²	97	119.2 Å²	119.2	63%	0.63	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-54.6	133.5	-179.5	23.6	-33.2	0	0	0	108.8	Y568	P566-Y568 PolarHBondContact O-N 3.11Å
567	P	44.6	Very low	49.5	Very low	107 Å²	107	112.5 Å²	112.5	70%	0.695	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-56.6	131.7	177.8	25.4	-33.7	0	0	0	107.9	I569	P567-I569 PolarHBondContact O-N 2.61Å
568	Y	47.4	Very low	51.1	Low	208 Å²	208	109.9 Å²	109.9	82%	0.816	58%	0.581	S	S	*	*			trans	-47.4	110.3	179.5	-179.9	-88.9	0	0	0	108.6	P566 D570	P566-Y568 PolarHBondContact O-N 3.11Å; Y568-D570 PolarHBondContact O-N 3.47Å
569	I	55.4	Low	53	Low	84 Å²	84	112.1 Å²	112.1	43%	0.431	58%	0.582	S	S	.	*			trans	-72.8	103.9	-176.9	-77.8	179	0	0	0	106.2	P567 H571 Y573	P567-I569 PolarHBondContact O-N 2.61Å; I569-H571 PolarHBondContact O-N 2.8Å; I569-Y573 HydrophobicContact CG2-CD1 4.33Å
570	D	56.9	Low	55.1	Low	69 Å²	69	113.3 Å²	113.3	37%	0.369	59%	0.587	S	S	.	*			trans	-50	135.5	172.6	-164.3	-31.9	0	0	0	109.5	Y568 E572 Y573 S574	Y568-D570 PolarHBondContact O-N 3.47Å; D570-E572 PolarHBondContact O-N 2.98Å; D570-E572 WeakPolarHBondContact OD1-CB 3.48Å; D570-E572 PolarHBondContact OD1-N 3.22Å; D570-Y573 WeakPolarHBondContact O-CA 3.41Å; D570-Y573 WeakPolarHBondContact O-CB 3.42Å; D570-Y573 PolarHBondContact O-N 2.9Å; D570-S574 PolarHBondContact O-N 3.14Å
571	H	58.8	Low	57.4	Low	140 Å²	140	109 Å²	109	65%	0.648	57%	0.565	S	S	*	*	H	α-helix	trans	-61.4	-32.1	175.7	57.4	-91.9	0	0	0	110.5	I569 H575	I569-H571 PolarHBondContact O-N 2.8Å; H571-H575 VanDerWaalsContact O-CB 3.23Å; H571-H575 WeakPolarHBondContact O-CB 3.46Å; H571-H575 PolarHBondContact O-N 3.04Å
572	E	62.3	Low	59.6	Low	131 Å²	131	110.8 Å²	110.8	61%	0.612	56%	0.558	S	S	*	*	H	α-helix	trans	-60.2	-45.9	168.7	-66.5	-159.6	169.2	0	0	111.5	D570 H575 C576	D570-E572 PolarHBondContact O-N 2.98Å; D570-E572 WeakPolarHBondContact OD1-CB 3.48Å; D570-E572 PolarHBondContact OD1-N 3.22Å; E572-H575 PolarHBondContact O-N 2.89Å; E572-C576 WeakPolarHBondContact O-CB 3.34Å; E572-C576 PolarHBondContact O-N 3.43Å; E572-C576 PolarHBondContact O-SG 3.16Å; E572-C576 VanDerWaalsContact O-SG 3.34Å
573	Y	71.7	Confident	62.1	Low	130 Å²	130	106 Å²	106	51%	0.51	55%	0.551	S	S	.	*	H	α-helix	trans	-66.5	-43.6	-179.6	-176.6	-91.7	0	0	0	112.1	I569 D570 H575 C576 Q577	I569-Y573 HydrophobicContact CG2-CD1 4.33Å; D570-Y573 WeakPolarHBondContact O-CA 3.41Å; D570-Y573 WeakPolarHBondContact O-CB 3.42Å; D570-Y573 PolarHBondContact O-N 2.9Å; Y573-H575 VanDerWaalsContact C-N 3.33Å; Y573-H575 PolarHBondContact O-N 2.97Å; Y573-C576 PolarHBondContact O-N 3.23Å; Y573-Q577 HydrophobicContact CE1-CB 4.36Å; Y573-Q577 WeakPolarHBondContact O-CB 3.34Å; Y573-Q577 PolarHBondContact O-N 2.7Å
574	S	66.9	Low	64.3	Low	60 Å²	60	106.1 Å²	106.1	42%	0.42	54%	0.543	S	S	.	.	H	α-helix	trans	-59.7	-45.3	175.8	-170.1	0	0	0	0	111.3	D570 Q577 A578	D570-S574 PolarHBondContact O-N 3.14Å; S574-Q577 PolarHBondContact O-N 2.65Å; S574-A578 PolarHBondContact O-N 2.92Å
575	H	73.2	Confident	66.5	Low	115 Å²	115	104.7 Å²	104.7	53%	0.532	53%	0.529	S	S	.	.	H	α-helix	trans	-63.8	-45.8	177.2	-171.2	76.6	0	0	0	112.3	H571 E572 Y573 A578 Q579	H571-H575 VanDerWaalsContact O-CB 3.23Å; H571-H575 WeakPolarHBondContact O-CB 3.46Å; H571-H575 PolarHBondContact O-N 3.04Å; E572-H575 PolarHBondContact O-N 2.89Å; Y573-H575 VanDerWaalsContact C-N 3.33Å; Y573-H575 PolarHBondContact O-N 2.97Å; H575-A578 WeakPolarHBondContact O-CB 3.4Å; H575-A578 PolarHBondContact O-N 3.48Å; H575-Q579 PolarHBondContact CD2-NE2 3.48Å; H575-Q579 VanDerWaalsContact CD2-NE2 3.31Å; H575-Q579 PolarHBondContact NE2-NE2 3.04Å; H575-Q579 PolarHBondContact O-N 3.49Å
576	C	58	Low	68.9	Low	63 Å²	63	101.3 Å²	101.3	43%	0.426	51%	0.505	S	S	.	.	H	α-helix	trans	-61.9	-42.1	173.8	-73.9	0	0	0	0	112.3	E572 Y573 A578 Q579 L580	E572-C576 WeakPolarHBondContact O-CB 3.34Å; E572-C576 PolarHBondContact O-N 3.43Å; E572-C576 PolarHBondContact O-SG 3.16Å; E572-C576 VanDerWaalsContact O-SG 3.34Å; Y573-C576 PolarHBondContact O-N 3.23Å; C576-A578 VanDerWaalsContact C-N 3.27Å; C576-A578 PolarHBondContact O-N 3.27Å; C576-Q579 PolarHBondContact O-N 3.04Å; C576-L580 WeakPolarHBondContact O-CG 3.38Å; C576-L580 PolarHBondContact O-N 2.96Å
577	Q	74.2	Confident	71.4	Confident	53 Å²	53	103.2 Å²	103.2	25%	0.248	51%	0.506	C	S	.	.	H	α-helix	trans	-67.2	-27.8	177.9	-163.8	-178.6	10.8	0	0	111.9	Y573 S574 R581 R731	Y573-Q577 HydrophobicContact CE1-CB 4.36Å; Y573-Q577 WeakPolarHBondContact O-CB 3.34Å; Y573-Q577 PolarHBondContact O-N 2.7Å; S574-Q577 PolarHBondContact O-N 2.65Å; Q577-R581 PolarHBondContact O-NE 3.33Å; Q577-R731 VanDerWaalsContact OE1-CZ 3.31Å
578	A	72.7	Confident	73.5	Confident	34 Å²	34	103.6 Å²	103.6	28%	0.281	50%	0.501	S	S	.	.	H	α-helix	trans	-69.8	-44.5	169.2	0	0	0	0	0	112.1	S574 H575 C576 L580 R581 N586	S574-A578 PolarHBondContact O-N 2.92Å; H575-A578 WeakPolarHBondContact O-CB 3.4Å; H575-A578 PolarHBondContact O-N 3.48Å; C576-A578 VanDerWaalsContact C-N 3.27Å; C576-A578 PolarHBondContact O-N 3.27Å; A578-L580 PolarHBondContact O-N 3.15Å; A578-R581 PolarHBondContact O-N 3.36Å; A578-N586 PolarHBondContact O-ND2 3.49Å; A578-N586 PolarHBondContact O-OD1 2.88Å
579	Q	76.3	Confident	75.2	Confident	140 Å²	140	94.4 Å²	94.4	65%	0.654	47%	0.467	S	S	*	.	H	α-helix	trans	-64.3	-24.5	177.1	-68.4	-171.3	20.6	0	0	114.2	H575 C576	H575-Q579 PolarHBondContact CD2-NE2 3.48Å; H575-Q579 VanDerWaalsContact CD2-NE2 3.31Å; H575-Q579 PolarHBondContact NE2-NE2 3.04Å; H575-Q579 PolarHBondContact O-N 3.49Å; C576-Q579 PolarHBondContact O-N 3.04Å
580	L	79	Confident	76.6	Confident	154 Å²	154	94.5 Å²	94.5	81%	0.806	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-14.2	179.1	-70	171	0	0	0	114.3	C576 A578	C576-L580 WeakPolarHBondContact O-CG 3.38Å; C576-L580 PolarHBondContact O-N 2.96Å; A578-L580 PolarHBondContact O-N 3.15Å
581	R	82.5	Confident	78.3	Confident	51 Å²	51	97.8 Å²	97.8	19%	0.192	48%	0.479	C	S	.	.	S	Bend	trans	-85.6	152.9	178.4	-86.3	176.4	-76.9	158.5	-3.2	111.8	Q577 A578 E585 N586	Q577-R581 PolarHBondContact O-NE 3.33Å; A578-R581 PolarHBondContact O-N 3.36Å; R581-E585 VanDerWaalsContact CA-OE2 3.3Å; R581-E585 WeakPolarHBondContact CA-OE2 3.1Å; R581-E585 HydrophobicContact CB-CB 4.13Å; R581-E585 WeakPolarHBondContact CB-OE2 3.28Å; R581-E585 HydrophobicContact CG-CB 4.32Å; R581-E585 WeakPolarHBondContact CG-OE2 3.5Å; R581-N586 WeakPolarHBondContact CB-ND2 3.42Å; R581-N586 VanDerWaalsContact CZ-OD1 3.3Å; R581-N586 PolarHBondContact NE-OD1 3.18Å; R581-N586 PolarHBondContact NH1-OD1 3.42Å; R581-N586 PolarHBondContact O-ND2 2.92Å
582	R	87.1	Confident	79.7	Confident	163 Å²	163	94.1 Å²	94.1	62%	0.615	46%	0.461	S	S	*	.			trans	-63.5	156.8	172	-61.9	-178.6	-172.8	-166	1.6	110.8	E584 E585 N586	R582-E584 VanDerWaalsContact C-N 3.28Å; R582-E584 PolarHBondContact O-N 3.43Å; R582-E585 HydrophobicContact CB-CB 4.37Å; R582-E585 HydrophobicContact CB-CG 3.99Å; R582-E585 WeakPolarHBondContact CD-OE1 3.36Å; R582-E585 WeakPolarHBondContact CG-OE1 3.23Å; R582-E585 PolarHBondContact N-OE2 3.32Å; R582-E585 IonicContact NE-OE1 2.66Å; R582-E585 PolarHBondContact O-N 3.36Å; R582-N586 PolarHBondContact O-N 2.89Å; R582-N586 PolarHBondContact O-ND2 3.1Å
583	P	86.3	Confident	80.9	Confident	94 Å²	94	90.1 Å²	90.1	61%	0.61	44%	0.444	S	S	*	.	H	α-helix	trans	-56.2	-41.2	175.9	-26.4	36.1	0	0	0	113	N586 Q587	P583-N586 PolarHBondContact O-N 3.48Å; P583-Q587 WeakPolarHBondContact O-CG 3.14Å; P583-Q587 PolarHBondContact O-N 2.89Å
584	E	87	Confident	81.7	Confident	125 Å²	125	88.6 Å²	88.6	58%	0.584	45%	0.445	S	S	*	.	H	α-helix	trans	-62.2	-47.7	176.8	-66	137	-134.3	0	0	112.5	R582 N586 Q587 L588	R582-E584 VanDerWaalsContact C-N 3.28Å; R582-E584 PolarHBondContact O-N 3.43Å; E584-N586 VanDerWaalsContact C-N 3.29Å; E584-N586 PolarHBondContact O-N 2.86Å; E584-Q587 WeakPolarHBondContact O-CB 3.23Å; E584-Q587 PolarHBondContact O-N 3.35Å; E584-Q587 VanDerWaalsContact O-N 3.13Å; E584-L588 PolarHBondContact O-N 2.83Å
585	E	87.6	Confident	82.9	Confident	79 Å²	79	90.4 Å²	90.4	37%	0.369	45%	0.45	S	S	.	.	H	α-helix	trans	-60.2	-38.8	176.8	-65.9	160.3	-162.8	0	0	111.7	R581 R582 V589	R581-E585 VanDerWaalsContact CA-OE2 3.3Å; R581-E585 WeakPolarHBondContact CA-OE2 3.1Å; R581-E585 HydrophobicContact CB-CB 4.13Å; R581-E585 WeakPolarHBondContact CB-OE2 3.28Å; R581-E585 HydrophobicContact CG-CB 4.32Å; R581-E585 WeakPolarHBondContact CG-OE2 3.5Å; R582-E585 HydrophobicContact CB-CB 4.37Å; R582-E585 HydrophobicContact CB-CG 3.99Å; R582-E585 WeakPolarHBondContact CD-OE1 3.36Å; R582-E585 WeakPolarHBondContact CG-OE1 3.23Å; R582-E585 PolarHBondContact N-OE2 3.32Å; R582-E585 IonicContact NE-OE1 2.66Å; R582-E585 PolarHBondContact O-N 3.36Å; E585-V589 WeakPolarHBondContact O-CG2 3.17Å; E585-V589 PolarHBondContact O-N 2.93Å; E585-V589 VanDerWaalsContact O-N 3.08Å
586	N	83.9	Confident	83.6	Confident	30 Å²	30	91.2 Å²	91.2	16%	0.16	45%	0.449	C	S	.	.	H	α-helix	trans	-70.6	-35.8	175.3	-77.5	-50.6	0	0	0	112.3	A578 R581 R582 P583 E584 V589 N590	A578-N586 PolarHBondContact O-ND2 3.49Å; A578-N586 PolarHBondContact O-OD1 2.88Å; R581-N586 WeakPolarHBondContact CB-ND2 3.42Å; R581-N586 VanDerWaalsContact CZ-OD1 3.3Å; R581-N586 PolarHBondContact NE-OD1 3.18Å; R581-N586 PolarHBondContact NH1-OD1 3.42Å; R581-N586 PolarHBondContact O-ND2 2.92Å; R582-N586 PolarHBondContact O-N 2.89Å; R582-N586 PolarHBondContact O-ND2 3.1Å; P583-N586 PolarHBondContact O-N 3.48Å; E584-N586 VanDerWaalsContact C-N 3.29Å; E584-N586 PolarHBondContact O-N 2.86Å; N586-V589 PolarHBondContact O-N 2.85Å; N586-N590 VanDerWaalsContact O-CB 3.31Å; N586-N590 WeakPolarHBondContact O-CB 3.43Å; N586-N590 PolarHBondContact O-N 3.16Å; N586-N590 PolarHBondContact O-ND2 3.28Å; N586-N590 PolarHBondContact O-OD1 3.31Å
587	Q	87.3	Confident	84.9	Confident	138 Å²	138	95.5 Å²	95.5	65%	0.645	46%	0.457	S	S	*	.	H	α-helix	trans	-63.1	-42.6	172.5	-73	174.2	20.7	0	0	111.7	P583 E584 N590 K591	P583-Q587 WeakPolarHBondContact O-CG 3.14Å; P583-Q587 PolarHBondContact O-N 2.89Å; E584-Q587 WeakPolarHBondContact O-CB 3.23Å; E584-Q587 PolarHBondContact O-N 3.35Å; E584-Q587 VanDerWaalsContact O-N 3.13Å; Q587-N590 PolarHBondContact O-N 3.2Å; Q587-K591 VanDerWaalsContact O-CB 3.31Å; Q587-K591 WeakPolarHBondContact O-CB 3.49Å; Q587-K591 PolarHBondContact O-N 3.38Å
588	L	88.6	Confident	85.6	Confident	115 Å²	115	97.2 Å²	97.2	60%	0.602	47%	0.472	S	S	*	.	H	α-helix	trans	-61.6	-47.5	176.1	-72.4	170.7	0	0	0	112.1	E584 K591 F592	E584-L588 PolarHBondContact O-N 2.83Å; L588-K591 PolarHBondContact O-N 3.05Å; L588-F592 WeakPolarHBondContact O-CB 3.3Å; L588-F592 PolarHBondContact O-N 3.38Å
589	V	83.1	Confident	86.4	Confident	14 Å²	14	98.8 Å²	98.8	9%	0.085	48%	0.481	C	S	.	.	H	α-helix	trans	-68.9	-36.5	179.3	173.5	0	0	0	0	112.1	E585 N586 F592 N593 Y733	E585-V589 WeakPolarHBondContact O-CG2 3.17Å; E585-V589 PolarHBondContact O-N 2.93Å; E585-V589 VanDerWaalsContact O-N 3.08Å; N586-V589 PolarHBondContact O-N 2.85Å; V589-F592 PolarHBondContact O-N 2.87Å; V589-N593 PolarHBondContact O-N 2.85Å; V589-N593 PolarHBondContact O-ND2 2.82Å; V589-N593 PolarHBondContact O-OD1 2.82Å; V589-Y733 HydrophobicContact CG1-CD1 4.23Å; V589-Y733 HydrophobicContact CG1-CE1 3.84Å; V589-Y733 HydrophobicContact CG2-CD1 4.24Å; V589-Y733 HydrophobicContact CG2-CD2 3.86Å; V589-Y733 HydrophobicContact CG2-CE1 4.44Å; V589-Y733 HydrophobicContact CG2-CE2 4.07Å; V589-Y733 HydrophobicContact CG2-CG 3.93Å
590	N	85.1	Confident	86.9	Confident	87 Å²	87	98.1 Å²	98.1	47%	0.465	47%	0.472	S	S	.	.	H	α-helix	trans	-64.2	-49.1	173.9	-70.6	-6.1	0	0	0	110.9	N586 Q587 F592 N593 D594	N586-N590 VanDerWaalsContact O-CB 3.31Å; N586-N590 WeakPolarHBondContact O-CB 3.43Å; N586-N590 PolarHBondContact O-N 3.16Å; N586-N590 PolarHBondContact O-ND2 3.28Å; N586-N590 PolarHBondContact O-OD1 3.31Å; Q587-N590 PolarHBondContact O-N 3.2Å; N590-F592 VanDerWaalsContact C-N 3.26Å; N590-F592 PolarHBondContact O-N 3.36Å; N590-N593 WeakPolarHBondContact O-CA 3.19Å; N590-N593 WeakPolarHBondContact O-CB 3.41Å; N590-N593 PolarHBondContact O-N 2.97Å; N590-D594 PolarHBondContact O-N 3.15Å
591	K	91.9	Very high	87.4	Confident	138 Å²	138	95.3 Å²	95.3	60%	0.6	46%	0.458	S	S	*	.	H	α-helix	trans	-57.8	-37.6	175.6	-175.1	179	180	-178.4	0	112.5	Q587 L588 N595	Q587-K591 VanDerWaalsContact O-CB 3.31Å; Q587-K591 WeakPolarHBondContact O-CB 3.49Å; Q587-K591 PolarHBondContact O-N 3.38Å; L588-K591 PolarHBondContact O-N 3.05Å; K591-N595 WeakPolarHBondContact O-CB 3.38Å; K591-N595 VanDerWaalsContact O-CG 3.22Å; K591-N595 PolarHBondContact O-N 3.28Å; K591-N595 PolarHBondContact O-OD1 3.19Å
592	F	89.1	Confident	87.7	Confident	62 Å²	62	96 Å²	96	27%	0.272	47%	0.47	S	S	.	.	H	α-helix	trans	-63.9	-46.6	173	-179.6	-86.8	0	0	0	111.8	L588 V589 N590 N595 Y596 P732 Y733	L588-F592 WeakPolarHBondContact O-CB 3.3Å; L588-F592 PolarHBondContact O-N 3.38Å; V589-F592 PolarHBondContact O-N 2.87Å; N590-F592 VanDerWaalsContact C-N 3.26Å; N590-F592 PolarHBondContact O-N 3.36Å; F592-N595 PolarHBondContact O-N 3.47Å; F592-Y596 WeakPolarHBondContact O-CB 3.27Å; F592-Y596 PolarHBondContact O-N 3.34Å; F592-P732 HydrophobicContact CE1-CB 4.21Å; F592-P732 HydrophobicContact CE2-CB 3.99Å; F592-P732 HydrophobicContact CZ-CB 3.52Å; F592-P732 HydrophobicContact CZ-CG 4.11Å; F592-Y733 AromaticContact CD1-CD1 3.87Å; F592-Y733 HydrophobicContact CD1-CD1 3.87Å; F592-Y733 HydrophobicContact CE1-CD1 4.33Å; F592-Y733 HydrophobicContact CG-CD1 4.29Å
593	N	86.8	Confident	87.8	Confident	48 Å²	48	92.4 Å²	92.4	26%	0.257	46%	0.46	S	S	.	.	H	α-helix	trans	-62.6	-44.4	178.1	-65	-21.9	0	0	0	111.4	V589 N590 N595 Y596 Y597	V589-N593 PolarHBondContact O-N 2.85Å; V589-N593 PolarHBondContact O-ND2 2.82Å; V589-N593 PolarHBondContact O-OD1 2.82Å; N590-N593 WeakPolarHBondContact O-CA 3.19Å; N590-N593 WeakPolarHBondContact O-CB 3.41Å; N590-N593 PolarHBondContact O-N 2.97Å; N593-N595 PolarHBondContact O-N 3.25Å; N593-Y596 WeakPolarHBondContact O-CB 3.29Å; N593-Y596 PolarHBondContact O-N 2.85Å; N593-Y596 VanDerWaalsContact O-N 3.17Å; N593-Y597 HydrophobicContact CB-CD2 4.32Å; N593-Y597 HydrophobicContact CB-CE2 4.03Å; N593-Y597 WeakPolarHBondContact O-CD2 3.41Å; N593-Y597 PolarHBondContact O-N 3.34Å
594	D	88.4	Confident	87.7	Confident	98 Å²	98	92.4 Å²	92.4	52%	0.524	46%	0.455	S	S	.	.	H	α-helix	trans	-61.2	-44.6	178.5	-62.2	-29.4	0	0	0	111.2	N590 T598	N590-D594 PolarHBondContact O-N 3.15Å; D594-T598 WeakPolarHBondContact O-CB 3.48Å; D594-T598 WeakPolarHBondContact O-CG2 3.44Å; D594-T598 PolarHBondContact O-N 3.47Å; D594-T598 PolarHBondContact O-OG1 2.93Å
595	N	91.9	Very high	87.7	Confident	97 Å²	97	90.8 Å²	90.8	52%	0.519	45%	0.448	S	S	.	.	H	α-helix	trans	-62.5	-41	173.1	-75.3	4	0	0	0	112.3	K591 F592 N593 T598 S599	K591-N595 WeakPolarHBondContact O-CB 3.38Å; K591-N595 VanDerWaalsContact O-CG 3.22Å; K591-N595 PolarHBondContact O-N 3.28Å; K591-N595 PolarHBondContact O-OD1 3.19Å; F592-N595 PolarHBondContact O-N 3.47Å; N593-N595 PolarHBondContact O-N 3.25Å; N595-T598 WeakPolarHBondContact CA-OG1 3.47Å; N595-T598 PolarHBondContact O-OG1 3.04Å; N595-T598 VanDerWaalsContact O-OG1 3.13Å; N595-S599 VanDerWaalsContact O-CB 3.28Å; N595-S599 WeakPolarHBondContact O-CB 3.12Å; N595-S599 PolarHBondContact O-N 3.39Å
596	Y	88	Confident	87.8	Confident	132 Å²	132	92.7 Å²	92.7	52%	0.518	46%	0.461	S	S	.	.	H	α-helix	trans	-65.4	-46.8	178	175.9	-95.7	0	0	0	111.8	F592 N593 R600	F592-Y596 WeakPolarHBondContact O-CB 3.27Å; F592-Y596 PolarHBondContact O-N 3.34Å; N593-Y596 WeakPolarHBondContact O-CB 3.29Å; N593-Y596 PolarHBondContact O-N 2.85Å; N593-Y596 VanDerWaalsContact O-N 3.17Å; Y596-R600 VanDerWaalsContact O-CB 3.29Å; Y596-R600 WeakPolarHBondContact O-CB 3.45Å; Y596-R600 PolarHBondContact O-N 3Å
597	Y	86.3	Confident	88	Confident	153 Å²	153	95.8 Å²	95.8	60%	0.6	48%	0.477	S	S	*	.	H	α-helix	trans	-66.1	-42.3	178.6	-69.2	-54	0	0	0	112.1	N593 R600 L601	N593-Y597 HydrophobicContact CB-CD2 4.32Å; N593-Y597 HydrophobicContact CB-CE2 4.03Å; N593-Y597 WeakPolarHBondContact O-CD2 3.41Å; N593-Y597 PolarHBondContact O-N 3.34Å; Y597-R600 PolarHBondContact O-N 3.33Å; Y597-L601 WeakPolarHBondContact O-CB 3.32Å; Y597-L601 PolarHBondContact O-N 3.4Å
598	T	88	Confident	88.1	Confident	90 Å²	90	94 Å²	94	55%	0.552	47%	0.465	S	S	*	.	H	α-helix	trans	-66.1	-43.2	177	48.1	0	0	0	0	112.3	D594 N595 L601 S602	D594-T598 WeakPolarHBondContact O-CB 3.48Å; D594-T598 WeakPolarHBondContact O-CG2 3.44Å; D594-T598 PolarHBondContact O-N 3.47Å; D594-T598 PolarHBondContact O-OG1 2.93Å; N595-T598 WeakPolarHBondContact CA-OG1 3.47Å; N595-T598 PolarHBondContact O-OG1 3.04Å; N595-T598 VanDerWaalsContact O-OG1 3.13Å; T598-L601 PolarHBondContact O-N 3.4Å; T598-S602 PolarHBondContact O-N 2.85Å
599	S	89.7	Confident	88.1	Confident	67 Å²	67	92.4 Å²	92.4	47%	0.469	46%	0.462	S	S	.	.	H	α-helix	trans	-61.7	-47.6	174.4	-165.9	0	0	0	0	111.5	N595 L601 S602 E603	N595-S599 VanDerWaalsContact O-CB 3.28Å; N595-S599 WeakPolarHBondContact O-CB 3.12Å; N595-S599 PolarHBondContact O-N 3.39Å; S599-L601 VanDerWaalsContact C-N 3.34Å; S599-L601 PolarHBondContact O-N 2.91Å; S599-S602 WeakPolarHBondContact O-CB 3.42Å; S599-S602 PolarHBondContact O-N 3.39Å; S599-S602 VanDerWaalsContact O-N 3.13Å; S599-E603 PolarHBondContact O-N 2.95Å
600	R	88.1	Confident	88.2	Confident	125 Å²	125	97.5 Å²	97.5	47%	0.472	49%	0.488	S	S	.	.	H	α-helix	trans	-69	-31.9	-178.3	-171.9	54.7	173.6	-174.1	2	112.8	Y596 Y597 E603 L604	Y596-R600 VanDerWaalsContact O-CB 3.29Å; Y596-R600 WeakPolarHBondContact O-CB 3.45Å; Y596-R600 PolarHBondContact O-N 3Å; Y597-R600 PolarHBondContact O-N 3.33Å; R600-E603 WeakPolarHBondContact CD-OE2 3.46Å; R600-E603 IonicContact CZ-OE2 3.15Å; R600-E603 IonicContact NE-OE2 2.82Å; R600-E603 IonicContact NH1-OE2 2.69Å; R600-E603 PolarHBondContact NH1-OE2 3.45Å; R600-L604 WeakPolarHBondContact O-CG 3.24Å; R600-L604 PolarHBondContact O-N 3.4Å; R600-L604 VanDerWaalsContact O-N 3.09Å
601	L	87.7	Confident	87.9	Confident	96 Å²	96	97.8 Å²	97.8	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-66.1	-41.9	170.3	-178.1	60.8	0	0	0	111	Y597 T598 S599 E603 L604 M605	Y597-L601 WeakPolarHBondContact O-CB 3.32Å; Y597-L601 PolarHBondContact O-N 3.4Å; T598-L601 PolarHBondContact O-N 3.4Å; S599-L601 VanDerWaalsContact C-N 3.34Å; S599-L601 PolarHBondContact O-N 2.91Å; L601-E603 VanDerWaalsContact C-N 3.34Å; L601-E603 PolarHBondContact O-N 3.45Å; L601-L604 PolarHBondContact O-N 3.42Å; L601-M605 HydrophobicContact CD1-CG 4.32Å; L601-M605 HydrophobicContact CG-CG 4.44Å; L601-M605 VanDerWaalsContact O-CG 3.3Å; L601-M605 WeakPolarHBondContact O-CG 3.48Å; L601-M605 PolarHBondContact O-N 2.86Å
602	S	90.1	Very high	87.6	Confident	65 Å²	65	94.9 Å²	94.9	46%	0.455	48%	0.476	S	S	.	.	H	α-helix	trans	-63.2	-38.8	175.4	-168.2	0	0	0	0	112.5	T598 S599 M605 N606	T598-S602 PolarHBondContact O-N 2.85Å; S599-S602 WeakPolarHBondContact O-CB 3.42Å; S599-S602 PolarHBondContact O-N 3.39Å; S599-S602 VanDerWaalsContact O-N 3.13Å; S602-M605 PolarHBondContact O-N 2.61Å; S602-N606 WeakPolarHBondContact O-CB 3.29Å; S602-N606 PolarHBondContact O-N 3.05Å; S602-N606 PolarHBondContact O-ND2 3.34Å
603	E	89.3	Confident	87.4	Confident	87 Å²	87	94.6 Å²	94.6	41%	0.407	49%	0.485	S	S	.	.	H	α-helix	trans	-60.7	-45.2	172.7	-70.8	173.7	173.6	0	0	111.8	S599 R600 L601 N606 L607	S599-E603 PolarHBondContact O-N 2.95Å; R600-E603 WeakPolarHBondContact CD-OE2 3.46Å; R600-E603 IonicContact CZ-OE2 3.15Å; R600-E603 IonicContact NE-OE2 2.82Å; R600-E603 IonicContact NH1-OE2 2.69Å; R600-E603 PolarHBondContact NH1-OE2 3.45Å; L601-E603 VanDerWaalsContact C-N 3.34Å; L601-E603 PolarHBondContact O-N 3.45Å; E603-N606 PolarHBondContact O-N 3.22Å; E603-L607 WeakPolarHBondContact O-CG 3.31Å; E603-L607 PolarHBondContact O-N 3.33Å
604	L	84.4	Confident	87.4	Confident	94 Å²	94	98.8 Å²	98.8	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-41.2	177.6	-73.3	167.8	0	0	0	112.3	R600 L601 N606 L607 Y608	R600-L604 WeakPolarHBondContact O-CG 3.24Å; R600-L604 PolarHBondContact O-N 3.4Å; R600-L604 VanDerWaalsContact O-N 3.09Å; L601-L604 PolarHBondContact O-N 3.42Å; L604-N606 VanDerWaalsContact C-N 3.31Å; L604-N606 PolarHBondContact O-N 2.96Å; L604-L607 PolarHBondContact O-N 3.35Å; L604-L607 VanDerWaalsContact O-N 3.17Å; L604-Y608 PolarHBondContact O-N 2.96Å
605	M	85.7	Confident	86.9	Confident	92 Å²	92	96.8 Å²	96.8	45%	0.453	49%	0.493	S	S	.	.	H	α-helix	trans	-65.9	-32.9	175.8	-68.4	-61.9	-67.1	0	0	112.4	L601 S602 L607 P609	L601-M605 HydrophobicContact CD1-CG 4.32Å; L601-M605 HydrophobicContact CG-CG 4.44Å; L601-M605 VanDerWaalsContact O-CG 3.3Å; L601-M605 WeakPolarHBondContact O-CG 3.48Å; L601-M605 PolarHBondContact O-N 2.86Å; S602-M605 PolarHBondContact O-N 2.61Å; M605-L607 VanDerWaalsContact C-N 3.35Å; M605-P609 WeakPolarHBondContact O-CD 3.38Å
606	N	89.4	Confident	86.4	Confident	119 Å²	119	95.3 Å²	95.3	64%	0.636	49%	0.485	S	S	*	.	H	α-helix	trans	-71.5	-28.3	173.1	-69.7	-17.8	0	0	0	112.7	S602 E603 L604	S602-N606 WeakPolarHBondContact O-CB 3.29Å; S602-N606 PolarHBondContact O-N 3.05Å; S602-N606 PolarHBondContact O-ND2 3.34Å; E603-N606 PolarHBondContact O-N 3.22Å; L604-N606 VanDerWaalsContact C-N 3.31Å; L604-N606 PolarHBondContact O-N 2.96Å
607	L	88.9	Confident	85.9	Confident	95 Å²	95	91.9 Å²	91.9	50%	0.497	48%	0.48	S	S	.	.	H	α-helix	trans	-84.5	-23.6	175.8	-70	171.3	0	0	0	113.3	E603 L604 M605 L610 L611	E603-L607 WeakPolarHBondContact O-CG 3.31Å; E603-L607 PolarHBondContact O-N 3.33Å; L604-L607 PolarHBondContact O-N 3.35Å; L604-L607 VanDerWaalsContact O-N 3.17Å; M605-L607 VanDerWaalsContact C-N 3.35Å; L607-L610 HydrophobicContact CD2-CD1 4.43Å; L607-L610 WeakPolarHBondContact O-CB 3.31Å; L607-L610 PolarHBondContact O-N 3.32Å; L607-L611 PolarHBondContact O-N 2.87Å
608	Y	88.8	Confident	85.2	Confident	101 Å²	101	88.6 Å²	88.6	40%	0.396	47%	0.472	S	S	.	.	H	α-helix	trans	-53	-42.2	-176.3	-179.7	-98.8	0	0	0	114.6	L604 L610 L611 K612	L604-Y608 PolarHBondContact O-N 2.96Å; Y608-L610 VanDerWaalsContact C-N 3.31Å; Y608-L610 PolarHBondContact O-N 3.18Å; Y608-L611 PolarHBondContact O-N 3.46Å; Y608-K612 WeakPolarHBondContact O-CB 3.48Å; Y608-K612 PolarHBondContact O-N 2.89Å
609	P	89	Confident	84.5	Confident	81 Å²	81	87.9 Å²	87.9	53%	0.526	47%	0.468	S	S	.	.	H	α-helix	trans	-62.6	-35.3	176.1	-23.2	34.8	0	0	0	113.6	M605 A613	M605-P609 WeakPolarHBondContact O-CD 3.38Å; P609-A613 VanDerWaalsContact O-CB 3.29Å; P609-A613 WeakPolarHBondContact O-CB 3.45Å; P609-A613 PolarHBondContact O-N 3.15Å
610	L	85.8	Confident	82.9	Confident	121 Å²	121	90.6 Å²	90.6	63%	0.634	48%	0.476	S	S	*	.	H	α-helix	trans	-73.4	-39.7	176.4	-62.2	175.5	0	0	0	111.2	L607 Y608 A613 F614	L607-L610 HydrophobicContact CD2-CD1 4.43Å; L607-L610 WeakPolarHBondContact O-CB 3.31Å; L607-L610 PolarHBondContact O-N 3.32Å; Y608-L610 VanDerWaalsContact C-N 3.31Å; Y608-L610 PolarHBondContact O-N 3.18Å; L610-A613 PolarHBondContact O-N 3.09Å; L610-F614 WeakPolarHBondContact O-CB 3.03Å; L610-F614 PolarHBondContact O-N 3.37Å
611	L	78.4	Confident	81.3	Confident	92 Å²	92	91.4 Å²	91.4	48%	0.482	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-44.2	176.3	-161.5	78.7	0	0	0	110.9	L607 Y608 F614 V615	L607-L611 PolarHBondContact O-N 2.87Å; Y608-L611 PolarHBondContact O-N 3.46Å; L611-F614 PolarHBondContact O-N 2.74Å; L611-V615 WeakPolarHBondContact O-CG2 3.5Å; L611-V615 PolarHBondContact O-N 3.38Å; L611-V615 VanDerWaalsContact O-N 3.08Å
612	K	86	Confident	79.6	Confident	77 Å²	77	91 Å²	91	34%	0.335	49%	0.487	S	S	.	.	H	α-helix	trans	-65.2	-46.7	175.6	-162	-163.8	-177.8	-59.4	0	111.7	Y608 F614 V615 D616	Y608-K612 WeakPolarHBondContact O-CB 3.48Å; Y608-K612 PolarHBondContact O-N 2.89Å; K612-F614 PolarHBondContact O-N 3.27Å; K612-V615 PolarHBondContact O-N 2.83Å; K612-D616 IonicContact NZ-OD1 2.73Å; K612-D616 PolarHBondContact NZ-OD1 3.08Å; K612-D616 IonicContact NZ-OD2 3.84Å; K612-D616 PolarHBondContact NZ-OD2 3.01Å; K612-D616 WeakPolarHBondContact O-CB 3.36Å; K612-D616 PolarHBondContact O-N 3.1Å
613	A	85.5	Confident	77.6	Confident	57 Å²	57	93.2 Å²	93.2	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-60.1	-32.8	177.6	0	0	0	0	0	112.8	P609 L610 S617	P609-A613 VanDerWaalsContact O-CB 3.29Å; P609-A613 WeakPolarHBondContact O-CB 3.45Å; P609-A613 PolarHBondContact O-N 3.15Å; L610-A613 PolarHBondContact O-N 3.09Å; A613-S617 WeakPolarHBondContact O-CB 3.5Å; A613-S617 PolarHBondContact O-N 3.04Å
614	F	85.1	Confident	75.7	Confident	136 Å²	136	93 Å²	93	60%	0.596	51%	0.507	S	S	*	.	H	α-helix	trans	-68.2	-42.4	172.7	178	-106.1	0	0	0	112.4	L610 L611 K612 S617 I618	L610-F614 WeakPolarHBondContact O-CB 3.03Å; L610-F614 PolarHBondContact O-N 3.37Å; L611-F614 PolarHBondContact O-N 2.74Å; K612-F614 PolarHBondContact O-N 3.27Å; F614-S617 PolarHBondContact O-N 2.89Å; F614-I618 HydrophobicContact CD1-CD1 4.04Å; F614-I618 HydrophobicContact CE1-CD1 3.61Å; F614-I618 HydrophobicContact CE2-CD1 4.38Å; F614-I618 HydrophobicContact CZ-CD1 3.8Å; F614-I618 WeakPolarHBondContact O-CG1 3.5Å; F614-I618 PolarHBondContact O-N 2.93Å
615	V	78.3	Confident	73.7	Confident	56 Å²	56	94.9 Å²	94.9	34%	0.339	52%	0.517	S	S	.	.	H	α-helix	trans	-65.8	-45.8	174.3	173	0	0	0	0	111.5	L611 K612 S617 I618 V619	L611-V615 WeakPolarHBondContact O-CG2 3.5Å; L611-V615 PolarHBondContact O-N 3.38Å; L611-V615 VanDerWaalsContact O-N 3.08Å; K612-V615 PolarHBondContact O-N 2.83Å; V615-S617 PolarHBondContact O-N 3.37Å; V615-I618 WeakPolarHBondContact O-CB 3.45Å; V615-I618 PolarHBondContact O-N 3.28Å; V615-V619 PolarHBondContact O-N 3.19Å; V615-V619 VanDerWaalsContact O-N 3.11Å
616	D	82.5	Confident	71.6	Confident	65 Å²	65	100.2 Å²	100.2	35%	0.348	53%	0.534	S	S	.	.	H	α-helix	trans	-57.9	-37.4	176.6	-66.2	-14.7	0	0	0	111.3	K612 V619 L620	K612-D616 IonicContact NZ-OD1 2.73Å; K612-D616 PolarHBondContact NZ-OD1 3.08Å; K612-D616 IonicContact NZ-OD2 3.84Å; K612-D616 PolarHBondContact NZ-OD2 3.01Å; K612-D616 WeakPolarHBondContact O-CB 3.36Å; K612-D616 PolarHBondContact O-N 3.1Å; D616-V619 PolarHBondContact O-N 3.22Å; D616-L620 WeakPolarHBondContact O-CG 3.29Å; D616-L620 PolarHBondContact O-N 2.87Å; D616-L620 VanDerWaalsContact O-N 3.12Å
617	S	78	Confident	69.4	Low	61 Å²	61	103.7 Å²	103.7	43%	0.427	55%	0.546	S	S	.	.	H	α-helix	trans	-67.7	-32.7	175	-166.8	0	0	0	0	113.4	A613 F614 V615 E621	A613-S617 WeakPolarHBondContact O-CB 3.5Å; A613-S617 PolarHBondContact O-N 3.04Å; F614-S617 PolarHBondContact O-N 2.89Å; V615-S617 PolarHBondContact O-N 3.37Å; S617-E621 PolarHBondContact O-N 3.37Å
618	I	71.3	Confident	67.3	Low	84 Å²	84	105 Å²	105	43%	0.431	56%	0.558	S	S	.	*	H	α-helix	trans	-71.7	-38.7	177.1	-69.9	165.5	0	0	0	110.6	F614 V615 E621	F614-I618 HydrophobicContact CD1-CD1 4.04Å; F614-I618 HydrophobicContact CE1-CD1 3.61Å; F614-I618 HydrophobicContact CE2-CD1 4.38Å; F614-I618 HydrophobicContact CZ-CD1 3.8Å; F614-I618 WeakPolarHBondContact O-CG1 3.5Å; F614-I618 PolarHBondContact O-N 2.93Å; V615-I618 WeakPolarHBondContact O-CB 3.45Å; V615-I618 PolarHBondContact O-N 3.28Å; I618-E621 PolarHBondContact O-N 2.8Å
619	V	72.2	Confident	64.9	Low	75 Å²	75	107.1 Å²	107.1	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-67.3	-41.6	177.3	178.7	0	0	0	0	111.1	V615 D616 E621 T622 D623	V615-V619 PolarHBondContact O-N 3.19Å; V615-V619 VanDerWaalsContact O-N 3.11Å; D616-V619 PolarHBondContact O-N 3.22Å; V619-E621 VanDerWaalsContact C-N 3.27Å; V619-E621 PolarHBondContact O-N 3.33Å; V619-T622 PolarHBondContact O-N 3.04Å; V619-T622 PolarHBondContact O-OG1 2.9Å; V619-D623 PolarHBondContact O-N 3.48Å
620	L	56.7	Low	62.5	Low	124 Å²	124	112.6 Å²	112.6	65%	0.649	60%	0.595	S	S	*	*	H	α-helix	trans	-66.2	-24.9	177.5	-74	169.3	0	0	0	113.8	D616 T622	D616-L620 WeakPolarHBondContact O-CG 3.29Å; D616-L620 PolarHBondContact O-N 2.87Å; D616-L620 VanDerWaalsContact O-N 3.12Å; L620-T622 VanDerWaalsContact C-N 3.33Å
621	E	54.1	Low	60.4	Low	141 Å²	141	115.7 Å²	115.7	66%	0.659	60%	0.604	S	S	*	*	H	α-helix	trans	-74.3	-20.4	171.9	-76.7	-176.6	-176.8	0	0	113	S617 I618 V619	S617-E621 PolarHBondContact O-N 3.37Å; I618-E621 PolarHBondContact O-N 2.8Å; V619-E621 VanDerWaalsContact C-N 3.27Å; V619-E621 PolarHBondContact O-N 3.33Å
622	T	53	Low	58.4	Low	88 Å²	88	118.8 Å²	118.8	54%	0.54	62%	0.621	S	S	.	*	H	α-helix	trans	-84.3	-31.9	177	43.5	0	0	0	0	114.4	V619 L620 A624	V619-T622 PolarHBondContact O-N 3.04Å; V619-T622 PolarHBondContact O-OG1 2.9Å; L620-T622 VanDerWaalsContact C-N 3.33Å; T622-A624 VanDerWaalsContact C-N 3.31Å; T622-A624 PolarHBondContact O-N 3.31Å
623	D	48.2	Very low	56.1	Low	112 Å²	112	122 Å²	122	60%	0.599	64%	0.642	S	S	*	*	H	α-helix	trans	-75.4	-18.2	-177.5	-67.6	-23.6	0	0	0	113.4	V619 N625	V619-D623 PolarHBondContact O-N 3.48Å; D623-N625 VanDerWaalsContact C-N 3.26Å; D623-N625 PolarHBondContact O-N 3.08Å
624	A	48.8	Very low	53.6	Low	82 Å²	82	122.6 Å²	122.6	68%	0.678	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-2.9	-172.8	0	0	0	0	0	115.8	T622	T622-A624 VanDerWaalsContact C-N 3.31Å; T622-A624 PolarHBondContact O-N 3.31Å
625	N	42.4	Very low	51.1	Low	134 Å²	134	125.6 Å²	125.6	72%	0.717	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	10.9	-172	-73.7	-47.4	0	0	0	114.9	D623	D623-N625 VanDerWaalsContact C-N 3.26Å; D623-N625 PolarHBondContact O-N 3.08Å
626	Y	41.6	Very low	48.9	Very low	203 Å²	203	128.5 Å²	128.5	80%	0.796	69%	0.689	S	S	*	*			trans	-99.3	90	169.4	-81.7	-83	0	0	0	110.4	T628	Y626-T628 PolarHBondContact O-N 3.35Å
627	E	42.1	Very low	46.2	Very low	193 Å²	193	130.9 Å²	130.9	90%	0.902	71%	0.711	S	S	*	*			trans	-62.9	113.2	162.8	-69	-176.5	132.8	0	0	108.3	D629	E627-D629 PolarHBondContact O-N 3.08Å
628	T	44.6	Very low	44	Very low	121 Å²	121	133.2 Å²	133.2	74%	0.742	73%	0.727	S	S	*	*			trans	-81	105.9	176.5	48.8	0	0	0	0	109.7	Y626 E630	Y626-T628 PolarHBondContact O-N 3.35Å; T628-E630 PolarHBondContact O-N 3.39Å
629	D	39.5	Very low	41.9	Very low	147 Å²	147	137 Å²	137	79%	0.786	74%	0.743	S	S	*	*			trans	-54.5	121.1	170.3	-81.7	-48.6	0	0	0	110.6	E627 F631	E627-D629 PolarHBondContact O-N 3.08Å; D629-F631 PolarHBondContact O-N 3.47Å
630	E	39.5	Very low	39.8	Very low	195 Å²	195	139.5 Å²	139.5	91%	0.911	75%	0.754	S	S	*	*			trans	-73.2	95.7	-176.7	-64.2	-178	140.7	0	0	111.4	T628 D632	T628-E630 PolarHBondContact O-N 3.39Å; E630-D632 PolarHBondContact O-N 3.27Å
631	F	40.6	Very low	38.6	Very low	186 Å²	186	141.6 Å²	141.6	82%	0.816	77%	0.766	S	S	*	*			trans	-83.7	104.3	166.3	-88	-94.1	0	0	0	110.7	D629 D633	D629-F631 PolarHBondContact O-N 3.47Å; F631-D633 VanDerWaalsContact C-N 3.34Å; F631-D633 PolarHBondContact O-N 3.26Å
632	D	36.8	Very low	37.4	Very low	158 Å²	158	142.2 Å²	142.2	85%	0.845	77%	0.772	S	S	*	*			trans	-79.3	67.2	-173.7	-171.9	22.2	0	0	0	113	E630 G634	E630-D632 PolarHBondContact O-N 3.27Å; D632-G634 VanDerWaalsContact C-N 3.27Å; D632-G634 PolarHBondContact O-N 2.97Å
633	D	37.4	Very low	36.2	Very low	144 Å²	144	148.6 Å²	148.6	77%	0.77	79%	0.788	S	S	*	*			trans	-79.4	70.1	176.2	-88.1	-41.7	0	0	0	112.2	F631 F635	F631-D633 VanDerWaalsContact C-N 3.34Å; F631-D633 PolarHBondContact O-N 3.26Å; D633-F635 PolarHBondContact O-N 3.12Å
634	G	32	Very low	35.5	Very low	70 Å²	70	147.9 Å²	147.9	72%	0.722	79%	0.792	S	S	*	*			trans	-71	82	178.4	0	0	0	0	0	114.8	D632	D632-G634 VanDerWaalsContact C-N 3.27Å; D632-G634 PolarHBondContact O-N 2.97Å
635	F	34	Very low	34.5	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.873	80%	0.802	S	S	*	*			trans	-104.9	124.5	165.9	-95.2	-89.6	0	0	0	112.9	D633	D633-F635 PolarHBondContact O-N 3.12Å
636	S	31.1	Very low	34.3	Very low	116 Å²	116	154.9 Å²	154.9	81%	0.811	81%	0.806	S	S	*	*			trans	-78.4	146	-174.5	-176.8	0	0	0	0	113.2
637	S	26.4	Very low	34	Very low	116 Å²	116	153 Å²	153	81%	0.811	81%	0.81	S	S	*	*			trans	-66.4	131.7	178.3	-43.5	0	0	0	0	114.4
638	S	31.2	Very low	33.3	Very low	109 Å²	109	154.1 Å²	154.1	76%	0.762	81%	0.812	S	S	*	*			trans	-161.2	91.8	149	55.7	0	0	0	0	105.2
639	E	28.2	Very low	32.8	Very low	164 Å²	164	156 Å²	156	77%	0.766	82%	0.818	S	S	*	*				55.1	110	67.5	-138.9	-169.2	-119.8	0	0	111.9
640	N	27.9	Very low	32.2	Very low	128 Å²	128	152 Å²	152	68%	0.684	81%	0.811	S	S	*	*			trans	63.3	107.4	169.2	-46.3	-48.9	0	0	0	118.1
641	D	31.9	Very low	31.9	Very low	167 Å²	167	149.7 Å²	149.7	89%	0.893	80%	0.8	S	S	*	*				-146.6	155.1	115.2	-112.7	-32.1	0	0	0	110.3
642	I	29.1	Very low	31.2	Very low	155 Å²	155	149.1 Å²	149.1	80%	0.795	81%	0.806	S	S	*	*			trans	-95.6	136.4	-158.8	-69.1	169.5	0	0	0	112.4
643	Y	27.9	Very low	31.1	Very low	222 Å²	222	150.9 Å²	150.9	87%	0.871	80%	0.801	S	S	*	*			trans	-68	128.9	169.2	-118.8	-103.1	0	0	0	110.5
644	S	32.3	Very low	30.6	Very low	96 Å²	96	153.5 Å²	153.5	67%	0.671	81%	0.808	S	S	*	*			trans	-115.6	113.6	169.2	56.3	0	0	0	0	109.5
645	E	28.1	Very low	30.6	Very low	193 Å²	193	158.1 Å²	158.1	90%	0.902	82%	0.816	S	S	*	*			trans	-74.8	123.3	170.2	-65.6	173.1	109	0	0	109.4
646	E	38.1	Very low	30.3	Very low	170 Å²	170	157 Å²	157	79%	0.794	81%	0.81	S	S	*	*			trans	-124.8	119	169.8	-71.8	-169.5	161.4	0	0	110.2
647	D	35.4	Very low	30.1	Very low	165 Å²	165	159.8 Å²	159.8	88%	0.882	81%	0.811	S	S	*	*			trans	50.2	108.8	153.7	-59.2	-16.4	0	0	0	120.7
648	F	28.2	Very low	30.1	Very low	215 Å²	215	160 Å²	160	94%	0.943	81%	0.812	S	S	*	*			trans	-97.9	116.6	170.3	-175.2	-80.9	0	0	0	110.1
649	D	33.6	Very low	29.9	Very low	161 Å²	161	158.3 Å²	158.3	86%	0.861	81%	0.811	S	S	*	*			trans	-145.8	141.9	-173.1	-150.7	0.1	0	0	0	114.4
650	G	27.7	Very low	29.8	Very low	63 Å²	63	158.5 Å²	158.5	65%	0.649	82%	0.816	S	S	*	*			trans	86.9	99.4	149.3	0	0	0	0	0	122.2
651	E	31.4	Very low	29.7	Very low	147 Å²	147	159.8 Å²	159.8	69%	0.687	82%	0.818	S	S	*	*			trans	56.3	115.2	143.7	-61.4	-158.9	177.9	0	0	122.8	R653	E651-R653 PolarHBondContact O-N 3.06Å; E651-R653 IonicContact OE1-NH2 2.68Å; E651-R653 IonicContact OE2-CZ 2.65Å; E651-R653 IonicContact OE2-NE 3.12Å; E651-R653 PolarHBondContact OE2-NE 3.2Å; E651-R653 IonicContact OE2-NH2 3.67Å; E651-R653 PolarHBondContact OE2-NH2 3.32Å
652	N	26.9	Very low	29.6	Very low	173 Å²	173	157.9 Å²	157.9	93%	0.925	81%	0.808	S	S	*	*			trans	-63.1	122.5	153.7	-79.6	-67.8	0	0	0	111.9
653	R	34.3	Very low	29.6	Very low	196 Å²	196	158.7 Å²	158.7	74%	0.74	81%	0.813	S	S	*	*			trans	-138.2	123.5	158.6	-66.6	-169.2	-171.4	-167.1	2.8	111.9	E651 L655	E651-R653 PolarHBondContact O-N 3.06Å; E651-R653 IonicContact OE1-NH2 2.68Å; E651-R653 IonicContact OE2-CZ 2.65Å; E651-R653 IonicContact OE2-NE 3.12Å; E651-R653 PolarHBondContact OE2-NE 3.2Å; E651-R653 IonicContact OE2-NH2 3.67Å; E651-R653 PolarHBondContact OE2-NH2 3.32Å; R653-L655 PolarHBondContact O-N 3.19Å
654	E	27.1	Very low	29.6	Very low	198 Å²	198	153.2 Å²	153.2	93%	0.925	81%	0.806	S	S	*	*			trans	-67.1	114.5	173.5	-59.3	177.3	127.1	0	0	110.7
655	L	31.2	Very low	29.3	Very low	168 Å²	168	156.7 Å²	156.7	88%	0.88	82%	0.817	S	S	*	*			trans	-130.7	146.3	163	-84.1	174.7	0	0	0	110.5	R653	R653-L655 PolarHBondContact O-N 3.19Å
656	K	29.4	Very low	29.1	Very low	174 Å²	174	153 Å²	153	76%	0.757	81%	0.811	S	S	*	*			trans	-91.1	150	-162.1	-63.7	-177.1	176.4	-173.3	0	113.5	S658	K656-S658 PolarHBondContact O-N 3.36Å
657	E	26	Very low	28.4	Very low	176 Å²	176	152.7 Å²	152.7	82%	0.822	81%	0.81	S	S	*	*			trans	27.3	93.7	134.5	-55.5	171.2	109.5	0	0	117.2
658	S	27	Very low	27.9	Very low	120 Å²	120	155.5 Å²	155.5	84%	0.839	81%	0.81	S	S	*	*			trans	-166.2	101.7	137.2	56.9	0	0	0	0	114.6	K656	K656-S658 PolarHBondContact O-N 3.36Å
659	G	25.6	Very low	27.9	Very low	73 Å²	73	150.2 Å²	150.2	75%	0.753	80%	0.795	S	S	*	*			trans	86.2	162.3	137.7	0	0	0	0	0	119.8
660	I	26.6	Very low	27.4	Very low	168 Å²	168	152 Å²	152	86%	0.862	80%	0.796	S	S	*	*			trans	70.5	94.9	169.9	-48.6	-177.2	0	0	0	113.4
661	Q	26	Very low	27.1	Very low	155 Å²	155	154.3 Å²	154.3	72%	0.724	80%	0.8	S	S	*	*			cis	102.8	132.4	42.6	-179.4	87.7	48.8	0	0	110.7
662	D	29.2	Very low	26.5	Very low	127 Å²	127	158.3 Å²	158.3	68%	0.679	81%	0.809	S	S	*	*			trans	54.1	105.9	168.5	-57	-19.7	0	0	0	119.7
663	L	29.6	Very low	26.4	Very low	172 Å²	172	160.8 Å²	160.8	90%	0.901	81%	0.805	S	S	*	*				-157.1	123.2	118.8	-136	72.4	0	0	0	114.4
664	C	27.2	Very low	25.9	Very low	108 Å²	108	155.7 Å²	155.7	73%	0.73	80%	0.8	S	S	*	*			trans	56	71.9	152.6	-148.9	0	0	0	0	120.4
665	D	26.9	Very low	25.7	Very low	169 Å²	169	152.6 Å²	152.6	90%	0.904	80%	0.8	S	S	*	*			trans	-74.6	122	140.9	-91.8	-49.2	0	0	0	108.9
666	C	23.6	Very low	25.4	Very low	115 Å²	115	155.3 Å²	155.3	78%	0.777	80%	0.799	S	S	*	*			trans	-103.3	86.7	173.9	53.6	0	0	0	0	111.3	Y668	C666-Y668 PolarHBondContact O-N 3.09Å
667	E	24.2	Very low	25.2	Very low	164 Å²	164	158 Å²	158	77%	0.766	80%	0.804	S	S	*	*			trans	-63.7	127.6	176.6	-65.5	-166.5	124.3	0	0	112.5
668	Y	24.4	Very low	25	Very low	224 Å²	224	160.7 Å²	160.7	88%	0.878	81%	0.807	S	S	*	*			trans	-127	56.3	156.1	-117.9	-85.1	0	0	0	113.8	C666	C666-Y668 PolarHBondContact O-N 3.09Å
669	T	27.1	Very low	25	Very low	103 Å²	103	163.6 Å²	163.6	63%	0.632	81%	0.807	S	S	*	*			trans	44.5	80.5	144	61.2	0	0	0	0	119.3	C671	T669-C671 PolarHBondContact O-N 3.31Å; T669-C671 VanDerWaalsContact O-N 3.07Å
670	F	23.5	Very low	24.9	Very low	200 Å²	200	165.9 Å²	165.9	88%	0.877	81%	0.808	S	S	*	*			trans	-69	102.8	161.9	-155.2	-82.5	0	0	0	110.6	R672	F670-R672 PolarHBondContact O-N 2.87Å
671	C	21.8	Very low	24.8	Very low	111 Å²	111	163.9 Å²	163.9	75%	0.75	80%	0.803	S	S	*	*			trans	-75	78.8	-166.3	-157.6	0	0	0	0	114.7	T669 R673	T669-C671 PolarHBondContact O-N 3.31Å; T669-C671 VanDerWaalsContact O-N 3.07Å; C671-R673 PolarHBondContact O-N 2.91Å
672	R	19.8	Very low	24.9	Very low	231 Å²	231	160.6 Å²	160.6	87%	0.872	80%	0.798	S	S	*	*			trans	-74.4	104.5	170	-91.6	-176.8	166.2	-178.6	-1.6	112	F670	F670-R672 PolarHBondContact O-N 2.87Å
673	R	23.2	Very low	24.6	Very low	224 Å²	224	160.6 Å²	160.6	85%	0.845	81%	0.805	S	S	*	*			trans	-139.1	136.7	158.4	-72.5	-177.8	176.4	168.2	0.6	110.8	C671	C671-R673 PolarHBondContact O-N 2.91Å
674	S	24.5	Very low	24.3	Very low	89 Å²	89	161.4 Å²	161.4	62%	0.622	80%	0.797	S	S	*	*			cis	-170.2	110.7	-29.1	36.2	0	0	0	0	106.9	R676	S674-R676 PolarHBondContact O-N 3.45Å
675	S	22.6	Very low	24.4	Very low	134 Å²	134	164.9 Å²	164.9	94%	0.937	80%	0.796	S	S	*	*			trans	-61.3	102.1	-169.1	-49.9	0	0	0	0	113.1	R677	S675-R677 PolarHBondContact O-N 3.06Å
676	R	26	Very low	24.3	Very low	225 Å²	225	165 Å²	165	85%	0.849	79%	0.791	S	S	*	*			trans	-90.1	108.5	178.4	-84.6	-169.4	170	-166.4	-0.9	112.6	S674	S674-R676 PolarHBondContact O-N 3.45Å
677	R	24.8	Very low	24.4	Very low	229 Å²	229	163.8 Å²	163.8	86%	0.864	79%	0.789	S	S	*	*			trans	64.1	101.2	148.1	-64	-174.9	173.5	179.9	-3.6	118.3	S675	S675-R677 PolarHBondContact O-N 3.06Å
678	R	22	Very low	24.7	Very low	234 Å²	234	168 Å²	168	88%	0.883	80%	0.799	S	S	*	*			trans	-31.8	141	146.2	-50.1	165.9	-177.6	168.6	-1.9	112.9
679	H	25.6	Very low	24.8	Very low	181 Å²	181	166 Å²	166	84%	0.838	79%	0.794	S	S	*	*			trans	-161.6	114.1	138.7	-103.4	-72.1	0	0	0	110.3
680	P	24.1	Very low	24.8	Very low	120 Å²	120	167.1 Å²	167.1	78%	0.779	80%	0.801	S	S	*	*			trans	-103.2	113.3	173.7	34.1	-25.7	0	0	0	111.2
681	V	25.4	Very low	25	Very low	126 Å²	126	169.2 Å²	169.2	76%	0.764	80%	0.803	S	S	*	*			trans	-143.9	121	173.8	-178.6	0	0	0	0	111.4
682	S	26.5	Very low	25.2	Very low	87 Å²	87	169.2 Å²	169.2	61%	0.608	80%	0.804	S	S	*	*			trans	50.2	116.5	155.2	-155.3	0	0	0	0	120.8
683	P	24.8	Very low	25.6	Very low	127 Å²	127	167.9 Å²	167.9	83%	0.825	81%	0.805	S	S	*	*			trans	-82.7	129.9	159.2	33.6	-29.6	0	0	0	111.1
684	Y	23.1	Very low	25.7	Very low	189 Å²	189	168.7 Å²	168.7	74%	0.741	81%	0.808	S	S	*	*			trans	-154	151.6	173	-122.9	-75.2	0	0	0	112
685	Y	29	Very low	25.9	Very low	180 Å²	180	171.9 Å²	171.9	71%	0.706	82%	0.817	S	S	*	*			trans	64	90.3	172.5	-76	-70.4	0	0	0	119.9
686	E	25.2	Very low	26.3	Very low	172 Å²	172	170.4 Å²	170.4	80%	0.804	80%	0.804	S	S	*	*				56.4	137.3	120.2	-69.1	-160.7	98.8	0	0	123.3	R688	E686-R688 PolarHBondContact O-N 3.48Å
687	A	25.6	Very low	26.3	Very low	89 Å²	89	165.6 Å²	165.6	74%	0.736	81%	0.805	S	S	*	*			trans	-78.4	109.6	172.4	0	0	0	0	0	112.9	K689	A687-K689 PolarHBondContact O-N 3.32Å
688	R	29.7	Very low	26.4	Very low	254 Å²	254	166.2 Å²	166.2	96%	0.958	81%	0.807	S	S	*	*			trans	-64.3	99.2	164.8	-77.3	-170.6	173.8	-169.7	-1.5	111	E686	E686-R688 PolarHBondContact O-N 3.48Å
689	K	26.4	Very low	26.8	Very low	181 Å²	181	157.9 Å²	157.9	79%	0.787	79%	0.794	S	S	*	*			trans	-60.1	160.3	171	-65.8	168.1	-177.7	160.9	0	111.2	A687	A687-K689 PolarHBondContact O-N 3.32Å
690	T	26.8	Very low	26.9	Very low	127 Å²	127	155.8 Å²	155.8	78%	0.779	79%	0.794	S	S	*	*			trans	73.7	103	166.6	73	0	0	0	0	118.4
691	R	28.3	Very low	27.3	Very low	243 Å²	243	159.8 Å²	159.8	92%	0.917	80%	0.799	S	S	*	*				-144.8	96.2	123.3	-117.3	179.4	-174.4	-171.4	1.9	110.2	F693	R691-F693 PolarHBondContact O-N 3.35Å
692	S	25.7	Very low	27.5	Very low	111 Å²	111	161.1 Å²	161.1	78%	0.776	80%	0.797	S	S	*	*			trans	-64.8	116	177	-47.2	0	0	0	0	109.7	R694	S692-R694 PolarHBondContact O-N 3.04Å
693	F	28.2	Very low	27.7	Very low	203 Å²	203	168.8 Å²	168.8	89%	0.89	81%	0.812	S	S	*	*			trans	-63.6	106.8	174.7	-91.4	-93.5	0	0	0	110.1	R691 I695	R691-F693 PolarHBondContact O-N 3.35Å; F693-I695 PolarHBondContact O-N 3.02Å
694	R	25.2	Very low	27.9	Very low	241 Å²	241	172.1 Å²	172.1	91%	0.909	81%	0.814	S	S	*	*			trans	-67.1	93.2	167.1	-81.4	-178.8	168.4	170.5	-3.9	108.8	S692 P696	S692-R694 PolarHBondContact O-N 3.04Å; R694-P696 WeakPolarHBondContact O-CD 3.01Å
695	I	29.7	Very low	28.2	Very low	156 Å²	156	166.3 Å²	166.3	80%	0.8	81%	0.811	S	S	*	*			trans	-63	122	162.2	-61.2	179	0	0	0	107	F693 S697	F693-I695 PolarHBondContact O-N 3.02Å; I695-S697 PolarHBondContact O-N 2.9Å
696	P	29.6	Very low	28.3	Very low	103 Å²	103	164.5 Å²	164.5	67%	0.669	82%	0.819	S	S	*	*			trans	-65.1	128.5	-174.3	-24.1	35	0	0	0	112.5	R694 R698	R694-P696 WeakPolarHBondContact O-CD 3.01Å; P696-R698 PolarHBondContact O-N 3.21Å
697	S	26.4	Very low	28.7	Very low	125 Å²	125	167.4 Å²	167.4	87%	0.874	82%	0.823	S	S	*	*			trans	-71.7	70.6	175.1	46.5	0	0	0	0	111.8	I695 G699	I695-S697 PolarHBondContact O-N 2.9Å; S697-G699 PolarHBondContact O-N 3.23Å
698	R	28	Very low	28.9	Very low	241 Å²	241	168.3 Å²	168.3	91%	0.909	82%	0.824	S	S	*	*			trans	-68.9	95.7	-179.9	-88.8	-172.1	168.7	178.4	-1.9	112.4	P696	P696-R698 PolarHBondContact O-N 3.21Å
699	G	29.5	Very low	29.1	Very low	59 Å²	59	163.4 Å²	163.4	61%	0.608	81%	0.814	S	S	*	*			trans	60.4	95.6	139.2	0	0	0	0	0	117.2	S697 K701	S697-G699 PolarHBondContact O-N 3.23Å; G699-K701 PolarHBondContact O-N 3.49Å
700	V	27.8	Very low	29.3	Very low	137 Å²	137	164 Å²	164	83%	0.83	82%	0.816	S	S	*	*			trans	-63	91.3	167.2	-178.5	0	0	0	0	110.3	Q702	V700-Q702 HydrophobicContact CG1-CG 4.07Å; V700-Q702 PolarHBondContact O-N 3.42Å
701	K	32.9	Very low	29.5	Very low	204 Å²	204	165.4 Å²	165.4	89%	0.887	82%	0.818	S	S	*	*			trans	-87.2	89.7	165.6	-79.1	-167.6	173.7	-177.6	0	109.6	G699 R703	G699-K701 PolarHBondContact O-N 3.49Å; K701-R703 PolarHBondContact O-N 3.15Å
702	Q	29.1	Very low	29.5	Very low	154 Å²	154	159 Å²	159	72%	0.72	81%	0.81	S	S	*	*			trans	-56.5	120	168.7	-61.3	-175.6	2.9	0	0	109.8	V700	V700-Q702 HydrophobicContact CG1-CG 4.07Å; V700-Q702 PolarHBondContact O-N 3.42Å
703	R	31.7	Very low	30	Very low	248 Å²	248	158.3 Å²	158.3	94%	0.936	81%	0.806	S	S	*	*			trans	-120.7	101.4	158.2	-118.4	-179.6	173.6	170.5	-1.9	109.5	K701 G705	K701-R703 PolarHBondContact O-N 3.15Å; R703-G705 PolarHBondContact O-N 3.27Å
704	K	28.3	Very low	30.1	Very low	198 Å²	198	156.5 Å²	156.5	86%	0.861	80%	0.804	S	S	*	*			trans	-55	124	172.3	-62.9	174.2	179.9	177.4	0	108.1
705	G	29.2	Very low	30.5	Very low	66 Å²	66	152.3 Å²	152.3	68%	0.68	80%	0.8	S	S	*	*			trans	-164.5	21.8	-170.1	0	0	0	0	0	114.1	R703 R707	R703-G705 PolarHBondContact O-N 3.27Å; G705-R707 PolarHBondContact O-N 2.85Å
706	T	30.7	Very low	30.7	Very low	143 Å²	143	150.1 Å²	150.1	88%	0.877	80%	0.799	S	S	*	*			trans	-71.7	74.2	178.6	48.2	0	0	0	0	111.2	S708	T706-S708 VanDerWaalsContact C-N 3.33Å; T706-S708 PolarHBondContact O-N 3.03Å
707	R	33	Very low	30.6	Very low	233 Å²	233	150.5 Å²	150.5	88%	0.879	80%	0.803	S	S	*	*			trans	-66.6	98.9	160	-92	-167	169.8	-154.6	-2.8	107.8	G705 M709	G705-R707 PolarHBondContact O-N 2.85Å; R707-M709 PolarHBondContact O-N 2.81Å
708	S	31.8	Very low	31	Very low	107 Å²	107	149.8 Å²	149.8	75%	0.748	80%	0.795	S	S	*	*			trans	-62.4	98.4	172	-177.3	0	0	0	0	108.7	T706 K710	T706-S708 VanDerWaalsContact C-N 3.33Å; T706-S708 PolarHBondContact O-N 3.03Å; S708-K710 VanDerWaalsContact C-N 3.34Å; S708-K710 PolarHBondContact O-N 3.46Å
709	M	33.8	Very low	31.4	Very low	152 Å²	152	144.8 Å²	144.8	75%	0.749	79%	0.791	S	S	*	*			trans	-69.9	96.9	167.5	-69.9	-64	-73.8	0	0	107.2	R707 L711	R707-M709 PolarHBondContact O-N 2.81Å; M709-L711 PolarHBondContact O-N 3.39Å
710	K	28.7	Very low	31.5	Very low	194 Å²	194	153.4 Å²	153.4	84%	0.843	81%	0.805	S	S	*	*			trans	-63.5	75.9	163.7	-75.7	-175.5	174.2	-178.3	0	108.8	S708 S712	S708-K710 VanDerWaalsContact C-N 3.34Å; S708-K710 PolarHBondContact O-N 3.46Å; K710-S712 PolarHBondContact O-N 3.07Å
711	L	31.4	Very low	31.6	Very low	155 Å²	155	157.9 Å²	157.9	81%	0.812	81%	0.807	S	S	*	*			trans	-69.9	109.4	161.7	-79.5	167.6	0	0	0	106.6	M709	M709-L711 PolarHBondContact O-N 3.39Å
712	S	29.5	Very low	31.6	Very low	108 Å²	108	152.1 Å²	152.1	76%	0.755	79%	0.793	S	S	*	*			trans	-60.7	157.8	-178.8	33.3	0	0	0	0	111.7	K710	K710-S712 PolarHBondContact O-N 3.07Å
713	S	34.6	Very low	31.9	Very low	98 Å²	98	154.8 Å²	154.8	69%	0.685	80%	0.802	S	S	*	*	S	Bend	trans	-50	146.9	174	51.6	0	0	0	0	113.3
714	L	31.8	Very low	32.1	Very low	164 Å²	164	152.3 Å²	152.3	86%	0.859	79%	0.793	S	S	*	*			trans	57.1	63.9	147.7	-61.4	167.8	0	0	0	115.9
715	N	33.8	Very low	32.7	Very low	154 Å²	154	149 Å²	149	82%	0.824	79%	0.789	S	S	*	*			trans	-136.3	112.6	137.3	-100	-50.8	0	0	0	110.2	C717	N715-C717 VanDerWaalsContact C-N 3.34Å; N715-C717 PolarHBondContact O-N 2.92Å
716	S	32.8	Very low	33.1	Very low	110 Å²	110	153.6 Å²	153.6	77%	0.769	80%	0.796	S	S	*	*			trans	-73.1	92.7	169	-175.4	0	0	0	0	107.5	P718	S716-P718 WeakPolarHBondContact O-CD 3.38Å
717	C	28.2	Very low	33.5	Very low	111 Å²	111	154.6 Å²	154.6	75%	0.75	79%	0.788	S	S	*	*			trans	-58.5	106.2	168.6	-68.8	0	0	0	0	107.9	N715 T719	N715-C717 VanDerWaalsContact C-N 3.34Å; N715-C717 PolarHBondContact O-N 2.92Å; C717-T719 PolarHBondContact O-N 2.98Å; C717-T719 VanDerWaalsContact O-N 3.07Å
718	P	34.6	Very low	33.8	Very low	110 Å²	110	147.1 Å²	147.1	71%	0.714	78%	0.777	S	S	*	*			trans	-70.4	116.7	-177	-10.1	27.4	0	0	0	105.9	S716 R720	S716-P718 WeakPolarHBondContact O-CD 3.38Å; P718-R720 PolarHBondContact O-N 2.85Å
719	T	35.6	Very low	34.1	Very low	136 Å²	136	146.5 Å²	146.5	83%	0.834	77%	0.77	S	S	*	*			trans	-56.3	107.2	173.5	-49.3	0	0	0	0	107	C717 R721	C717-T719 PolarHBondContact O-N 2.98Å; C717-T719 VanDerWaalsContact O-N 3.07Å; T719-R721 PolarHBondContact O-N 3.13Å
720	R	33.2	Very low	34.5	Very low	239 Å²	239	146.6 Å²	146.6	90%	0.902	76%	0.762	S	S	*	*			trans	-75.4	60	-169.1	-164.5	-174.7	-173.8	-130.3	8.5	110.5	P718 S722	P718-R720 PolarHBondContact O-N 2.85Å; R720-S722 PolarHBondContact O-N 2.96Å
721	R	29.7	Very low	35.5	Very low	231 Å²	231	140.1 Å²	140.1	87%	0.872	73%	0.732	S	S	*	*			trans	-50.3	108.5	158	-95.7	-172.3	168.2	179.1	-2.8	105.7	T719 K723	T719-R721 PolarHBondContact O-N 3.13Å; R721-K723 PolarHBondContact O-N 2.92Å
722	S	32.9	Very low	36.3	Very low	83 Å²	83	136.9 Å²	136.9	58%	0.58	72%	0.721	S	S	*	*			trans	-58.6	133.6	179.3	52.4	0	0	0	0	107.8	R720 R724	R720-S722 PolarHBondContact O-N 2.96Å; S722-R724 PolarHBondContact O-N 3.5Å
723	K	35.1	Very low	37.3	Very low	211 Å²	211	134.4 Å²	134.4	92%	0.917	70%	0.695	S	S	*	*			trans	-71.1	23.6	166.7	-62.8	-176.2	179.6	-179.9	0	111.2	R721 V725	R721-K723 PolarHBondContact O-N 2.92Å; K723-V725 VanDerWaalsContact C-N 3.27Å; K723-V725 PolarHBondContact O-N 3.49Å
724	R	34.5	Very low	38.1	Very low	196 Å²	196	132.9 Å²	132.9	74%	0.74	68%	0.679	S	S	*	*			trans	-75.3	86	178.8	-172.5	-178.7	-76.9	174.9	-4.1	106	S722 I726	S722-R724 PolarHBondContact O-N 3.5Å; R724-I726 PolarHBondContact O-N 3.47Å
725	V	41.4	Very low	38.9	Very low	129 Å²	129	129.4 Å²	129.4	78%	0.782	66%	0.661	S	S	*	*			trans	-47.9	116.4	169.5	175.7	0	0	0	0	106.7	K723 K727	K723-V725 VanDerWaalsContact C-N 3.27Å; K723-V725 PolarHBondContact O-N 3.49Å; V725-K727 PolarHBondContact O-N 2.91Å
726	I	38.8	Very low	39.4	Very low	161 Å²	161	128.3 Å²	128.3	83%	0.826	65%	0.65	S	S	*	*			trans	-72.7	87.6	176.8	-57	178.2	0	0	0	105.8	R724 A728	R724-I726 PolarHBondContact O-N 3.47Å; I726-A728 PolarHBondContact O-N 3.42Å
727	K	37.6	Very low	39.8	Very low	164 Å²	164	131.9 Å²	131.9	71%	0.713	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-60.1	130.8	171.8	-153.1	172.6	-172.9	-179.7	0	106.3	V725	V725-K727 PolarHBondContact O-N 2.91Å
728	A	41	Very low	40.2	Very low	77 Å²	77	137.5 Å²	137.5	64%	0.636	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-54.7	147.6	175.7	0	0	0	0	0	109.4	I726 R730	I726-A728 PolarHBondContact O-N 3.42Å; A728-R730 PolarHBondContact O-N 3.01Å; A728-R730 VanDerWaalsContact O-N 3.15Å
729	P	38	Very low	40	Very low	94 Å²	94	136.1 Å²	136.1	61%	0.61	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-51.8	124.9	174.2	-24.8	33.9	0	0	0	109.4	R731	P729-R731 PolarHBondContact O-N 2.96Å
730	R	42	Very low	39.9	Very low	154 Å²	154	137.8 Å²	137.8	58%	0.581	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-58.9	125	172.7	-89.6	-173.4	159.2	-173.2	-17.6	108	A728 D734 D735	A728-R730 PolarHBondContact O-N 3.01Å; A728-R730 VanDerWaalsContact O-N 3.15Å; R730-D734 WeakPolarHBondContact CA-OD2 3.37Å; R730-D734 HydrophobicContact CG-CB 4.31Å; R730-D735 IonicContact CZ-OD1 3.24Å; R730-D735 IonicContact NE-OD1 3.32Å; R730-D735 IonicContact NH1-OD1 2.63Å; R730-D735 PolarHBondContact NH1-OD1 2.93Å; R730-D735 IonicContact NH2-OD1 2.8Å
731	R	48.2	Very low	39.7	Very low	58 Å²	58	136.2 Å²	136.2	22%	0.219	65%	0.646	C	S	.	*	P	Polyproline II helix	trans	-75.5	148.7	168.4	-51.1	-172.1	-173.3	168.2	5.5	107.2	Q577 P729 Y733 D734	Q577-R731 VanDerWaalsContact OE1-CZ 3.31Å; P729-R731 PolarHBondContact O-N 2.96Å; R731-Y733 HydrophobicContact CB-CD1 4.49Å; R731-Y733 HydrophobicContact CB-CD2 4.02Å; R731-Y733 HydrophobicContact CB-CE1 4.22Å; R731-Y733 HydrophobicContact CB-CE2 3.72Å; R731-Y733 HydrophobicContact CB-CG 4.42Å; R731-Y733 VanDerWaalsContact CD-CZ 3.46Å; R731-Y733 WeakPolarHBondContact CD-OH 3.27Å; R731-Y733 HydrophobicContact CG-CE2 4.26Å; R731-Y733 PolarHBondContact NH1-OH 3.45Å; R731-Y733 PolarHBondContact O-N 3.27Å; R731-D734 PolarHBondContact N-OD2 3.43Å; R731-D734 WeakPolarHBondContact O-CB 3.38Å; R731-D734 PolarHBondContact O-N 2.83Å
732	P	48.5	Very low	39.8	Very low	87 Å²	87	134.8 Å²	134.8	57%	0.565	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-16.2	-176.3	-27.7	36.2	0	0	0	115.4	F592	F592-P732 HydrophobicContact CE1-CB 4.21Å; F592-P732 HydrophobicContact CE2-CB 3.99Å; F592-P732 HydrophobicContact CZ-CB 3.52Å; F592-P732 HydrophobicContact CZ-CG 4.11Å
733	Y	50.2	Low	39.7	Very low	55 Å²	55	135.9 Å²	135.9	22%	0.216	64%	0.642	C	S	.	*	T	Hydrogen-bonded Turn	trans	-93.6	-5.1	174.5	47.5	-108.6	0	0	0	114.8	V589 F592 R731 D735	V589-Y733 HydrophobicContact CG1-CD1 4.23Å; V589-Y733 HydrophobicContact CG1-CE1 3.84Å; V589-Y733 HydrophobicContact CG2-CD1 4.24Å; V589-Y733 HydrophobicContact CG2-CD2 3.86Å; V589-Y733 HydrophobicContact CG2-CE1 4.44Å; V589-Y733 HydrophobicContact CG2-CE2 4.07Å; V589-Y733 HydrophobicContact CG2-CG 3.93Å; F592-Y733 AromaticContact CD1-CD1 3.87Å; F592-Y733 HydrophobicContact CD1-CD1 3.87Å; F592-Y733 HydrophobicContact CE1-CD1 4.33Å; F592-Y733 HydrophobicContact CG-CD1 4.29Å; R731-Y733 HydrophobicContact CB-CD1 4.49Å; R731-Y733 HydrophobicContact CB-CD2 4.02Å; R731-Y733 HydrophobicContact CB-CE1 4.22Å; R731-Y733 HydrophobicContact CB-CE2 3.72Å; R731-Y733 HydrophobicContact CB-CG 4.42Å; R731-Y733 VanDerWaalsContact CD-CZ 3.46Å; R731-Y733 WeakPolarHBondContact CD-OH 3.27Å; R731-Y733 HydrophobicContact CG-CE2 4.26Å; R731-Y733 PolarHBondContact NH1-OH 3.45Å; R731-Y733 PolarHBondContact O-N 3.27Å; Y733-D735 PolarHBondContact O-N 3.4Å
734	D	52	Low	39.5	Very low	67 Å²	67	136.1 Å²	136.1	36%	0.358	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.1	-8.7	176.7	-62.8	-16.1	0	0	0	112.7	R730 R731	R730-D734 WeakPolarHBondContact CA-OD2 3.37Å; R730-D734 HydrophobicContact CG-CB 4.31Å; R731-D734 PolarHBondContact N-OD2 3.43Å; R731-D734 WeakPolarHBondContact O-CB 3.38Å; R731-D734 PolarHBondContact O-N 2.83Å
735	D	50	Low	39.5	Very low	90 Å²	90	134.8 Å²	134.8	48%	0.481	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-3	-177.3	-75.8	-51.9	0	0	0	114.1	R730 Y733 E737	R730-D735 IonicContact CZ-OD1 3.24Å; R730-D735 IonicContact NE-OD1 3.32Å; R730-D735 IonicContact NH1-OD1 2.63Å; R730-D735 PolarHBondContact NH1-OD1 2.93Å; R730-D735 IonicContact NH2-OD1 2.8Å; Y733-D735 PolarHBondContact O-N 3.4Å; D735-E737 VanDerWaalsContact C-N 3.3Å; D735-E737 PolarHBondContact O-N 2.92Å
736	F	43.4	Very low	39.2	Very low	131 Å²	131	135.9 Å²	135.9	58%	0.575	64%	0.641	S	S	*	*			trans	-74.1	-11.2	179.4	-78	-75.4	0	0	0	114.9	R738	F736-R738 PolarHBondContact O-N 2.89Å
737	E	41.4	Very low	38.9	Very low	186 Å²	186	135.4 Å²	135.4	87%	0.869	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	39.6	177	-68.9	-164	154.3	0	0	114.6	D735	D735-E737 VanDerWaalsContact C-N 3.3Å; D735-E737 PolarHBondContact O-N 2.92Å
738	R	35.8	Very low	38.7	Very low	229 Å²	229	134.1 Å²	134.1	86%	0.864	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.6	-0.7	157.4	-119.6	171	-170.5	-152.8	-1.5	119	F736 Q740	F736-R738 PolarHBondContact O-N 2.89Å; R738-Q740 PolarHBondContact O-N 3.17Å
739	S	32	Very low	38.2	Very low	80 Å²	80	139.4 Å²	139.4	56%	0.559	65%	0.653	S	S	*	*			trans	-63.6	105.9	169.9	54.6	0	0	0	0	108.4
740	Q	31.6	Very low	37.8	Very low	171 Å²	171	139.4 Å²	139.4	80%	0.799	66%	0.655	S	S	*	*			trans	-58.6	146.2	-176.6	-74.4	176.7	-33.2	0	0	110.4	R738 Y742	R738-Q740 PolarHBondContact O-N 3.17Å; Q740-Y742 PolarHBondContact O-N 2.84Å
741	Y	29.3	Very low	37	Very low	206 Å²	206	143 Å²	143	81%	0.808	67%	0.669	S	S	*	*			trans	-29.8	99.7	163.2	-137.9	-101.2	0	0	0	111.3	N743	Y741-N743 VanDerWaalsContact CD1-OD1 3.29Å; Y741-N743 WeakPolarHBondContact CD1-OD1 3.42Å; Y741-N743 PolarHBondContact O-N 3.43Å
742	Y	31.3	Very low	36	Very low	202 Å²	202	147.8 Å²	147.8	79%	0.792	70%	0.697	S	S	*	*			trans	-72.9	81.7	170.6	-82.9	-83.4	0	0	0	107.7	Q740 Y744	Q740-Y742 PolarHBondContact O-N 2.84Å; Y742-Y744 PolarHBondContact O-N 3.48Å
743	N	32.8	Very low	34.9	Very low	106 Å²	106	150.8 Å²	150.8	57%	0.567	71%	0.707	S	S	*	*			trans	-59	119.9	158.9	-81.7	-18.6	0	0	0	107	Y741 E745	Y741-N743 VanDerWaalsContact CD1-OD1 3.29Å; Y741-N743 WeakPolarHBondContact CD1-OD1 3.42Å; Y741-N743 PolarHBondContact O-N 3.43Å; N743-E745 HydrophobicContact CB-CG 4.28Å; N743-E745 PolarHBondContact O-N 2.93Å
744	Y	29.7	Very low	34	Very low	215 Å²	215	156.4 Å²	156.4	84%	0.843	74%	0.739	S	S	*	*			trans	-72.8	76.7	159.6	-77.3	-97.9	0	0	0	107.6	Y742 L746	Y742-Y744 PolarHBondContact O-N 3.48Å; Y744-L746 PolarHBondContact O-N 3.49Å
745	E	34	Very low	33	Very low	169 Å²	169	162.3 Å²	162.3	79%	0.79	76%	0.762	S	S	*	*			trans	-67.3	117.8	157.6	-71.2	-175.2	140.6	0	0	106.4	N743	N743-E745 HydrophobicContact CB-CG 4.28Å; N743-E745 PolarHBondContact O-N 2.93Å
746	L	35.2	Very low	31.8	Very low	152 Å²	152	166 Å²	166	80%	0.796	78%	0.782	S	S	*	*			trans	-72.3	141	-176.8	-69	164.2	0	0	0	109.7	Y744 D748	Y744-L746 PolarHBondContact O-N 3.49Å; L746-D748 PolarHBondContact O-N 2.88Å
747	D	33.4	Very low	31.2	Very low	151 Å²	151	163.6 Å²	163.6	81%	0.807	79%	0.794	S	S	*	*			trans	-65.3	94.4	-172.9	-52.8	-88.2	0	0	0	112.5	E749	D747-E749 PolarHBondContact O-N 3.13Å
748	D	32.5	Very low	30.4	Very low	137 Å²	137	165.6 Å²	165.6	73%	0.733	79%	0.794	S	S	*	*			trans	-79.5	41.1	176.6	-149	5.1	0	0	0	112	L746 S750	L746-D748 PolarHBondContact O-N 2.88Å; D748-S750 PolarHBondContact O-N 2.67Å
749	E	31.4	Very low	30.1	Very low	187 Å²	187	163.7 Å²	163.7	87%	0.874	79%	0.794	S	S	*	*			trans	-70.8	61.2	178	-91.2	-82.5	119.4	0	0	111.1	D747	D747-E749 PolarHBondContact O-N 3.13Å
750	S	30.1	Very low	29.9	Very low	94 Å²	94	163.6 Å²	163.6	66%	0.657	81%	0.806	S	S	*	*			trans	-140.9	19.4	-177.8	71.7	0	0	0	0	114.7	D748	D748-S750 PolarHBondContact O-N 2.67Å
751	R	24.7	Very low	29.5	Very low	230 Å²	230	162.9 Å²	162.9	87%	0.868	81%	0.808	S	S	*	*			trans	-134.2	32.9	-166.5	-138	-177.1	-177.1	95.8	5.5	119.6
752	I	26.1	Very low	29.5	Very low	158 Å²	158	162.9 Å²	162.9	81%	0.81	81%	0.812	S	S	*	*			trans	-140.3	131.7	156.2	-15	178.5	0	0	0	106.3
753	L	26.2	Very low	29.1	Very low	151 Å²	151	156.1 Å²	156.1	79%	0.791	80%	0.804	S	S	*	*			cis	-137.1	142.7	22.2	-62.8	136.6	0	0	0	111.4
754	I	30.8	Very low	28.7	Very low	172 Å²	172	157.2 Å²	157.2	88%	0.882	82%	0.82	S	S	*	*			trans	-126.9	131	156.8	-62.3	-177.4	0	0	0	107.4
755	F	31.1	Very low	28.4	Very low	192 Å²	192	152.1 Å²	152.1	84%	0.842	82%	0.816	S	S	*	*			trans	-69.1	149.6	-174.3	-99.9	-107.5	0	0	0	113.3	G757	F755-G757 PolarHBondContact O-N 2.82Å
756	D	25.9	Very low	28	Very low	167 Å²	167	148.1 Å²	148.1	89%	0.893	81%	0.812	S	S	*	*			trans	-64.1	89.4	173.6	-73.4	-66.7	0	0	0	112.9	R758	D756-R758 PolarHBondContact O-N 3.13Å
757	G	30.2	Very low	27.4	Very low	80 Å²	80	152.3 Å²	152.3	83%	0.825	82%	0.817	S	S	*	*			trans	-79.5	98.1	167.2	0	0	0	0	0	111.3	F755	F755-G757 PolarHBondContact O-N 2.82Å
758	R	25.2	Very low	27	Very low	229 Å²	229	149.9 Å²	149.9	86%	0.864	81%	0.812	S	S	*	*			trans	-81	159.8	179.1	-156.9	-179.7	-169.1	-177.7	4.1	111.8	D756	D756-R758 PolarHBondContact O-N 3.13Å
759	E	27.8	Very low	26.8	Very low	189 Å²	189	150.6 Å²	150.6	88%	0.883	82%	0.815	S	S	*	*			trans	85.5	144	171.3	-52.3	-178.9	-168.8	0	0	116.9
760	G	28	Very low	26.8	Very low	78 Å²	78	150.5 Å²	150.5	80%	0.804	82%	0.817	S	S	*	*			trans	133.4	62.4	179.2	0	0	0	0	0	115.6	F762	G760-F762 PolarHBondContact O-N 2.68Å
761	N	23.8	Very low	26.5	Very low	156 Å²	156	153.6 Å²	153.6	83%	0.834	82%	0.823	S	S	*	*			trans	-94.7	90.6	-173.2	-175.9	40.7	0	0	0	114.3
762	F	29.9	Very low	26.5	Very low	205 Å²	205	150.6 Å²	150.6	90%	0.899	82%	0.819	S	S	*	*			trans	-145.1	142.9	162.3	-72.4	-87.4	0	0	0	109.5	G760	G760-F762 PolarHBondContact O-N 2.68Å
763	G	22.2	Very low	26.6	Very low	61 Å²	61	152.5 Å²	152.5	63%	0.629	82%	0.816	S	S	*	*			cis	129.2	102.6	-4.1	0	0	0	0	0	112.3
764	S	25.2	Very low	26.7	Very low	129 Å²	129	155.2 Å²	155.2	90%	0.902	82%	0.817	S	S	*	*			trans	68	162.8	179.6	-60.2	0	0	0	0	115.9
765	S	22.9	Very low	26.3	Very low	108 Å²	108	152 Å²	152	76%	0.755	81%	0.81	S	S	*	*			cis	-171.9	161.2	-32	-176.4	0	0	0	0	108.1
766	A	26.1	Very low	26	Very low	84 Å²	84	153.4 Å²	153.4	69%	0.694	81%	0.81	S	S	*	*			trans	51.6	118.5	167.5	0	0	0	0	0	118.3
767	R	21.9	Very low	26.2	Very low	241 Å²	241	155.1 Å²	155.1	91%	0.909	81%	0.812	S	S	*	*				58.6	83.3	52.7	-166.2	-173	175.8	159.3	0.3	113.7
768	S	25.5	Very low	26.1	Very low	100 Å²	100	156.5 Å²	156.5	70%	0.699	81%	0.809	S	S	*	*			trans	-163.8	135.1	149.5	-88.4	0	0	0	0	113.8
769	N	28	Very low	26.5	Very low	151 Å²	151	150.9 Å²	150.9	81%	0.807	80%	0.802	S	S	*	*			trans	41.9	113.5	136	-46.7	-17.1	0	0	0	119.4
770	M	31.6	Very low	26.5	Very low	185 Å²	185	149.7 Å²	149.7	91%	0.911	80%	0.802	S	S	*	*				-143.6	142.2	99.5	-146.7	169.8	-162.8	0	0	110.9
771	M	22.8	Very low	26.5	Very low	159 Å²	159	150.9 Å²	150.9	78%	0.783	80%	0.798	S	S	*	*			trans	-119.8	150.9	-176.1	-165.2	153.6	174.1	0	0	108.2
772	E	25.8	Very low	26.7	Very low	168 Å²	168	151.9 Å²	151.9	79%	0.785	80%	0.798	S	S	*	*			trans	55	113.1	169.1	-68.8	169.7	174.2	0	0	118.7
773	R	28.4	Very low	26.9	Very low	197 Å²	197	147 Å²	147	74%	0.743	79%	0.788	S	S	*	*				-158.2	140.7	121.8	-123.6	170.6	-88.1	-160.9	-5.7	115.9
774	Y	28.1	Very low	27.2	Very low	209 Å²	209	150.8 Å²	150.8	82%	0.82	80%	0.795	S	S	*	*			trans	68.8	154	167.7	-59.2	-61.7	0	0	0	119.2
775	S	21.7	Very low	27.6	Very low	104 Å²	104	152.2 Å²	152.2	73%	0.727	79%	0.79	S	S	*	*			trans	-148.5	156.5	-163.7	-177.6	0	0	0	0	108.3
776	R	24.6	Very low	28	Very low	222 Å²	222	153.9 Å²	153.9	84%	0.838	79%	0.791	S	S	*	*			trans	69.3	99.1	174.5	-46.2	173.4	-168.3	179.1	1.8	115.4
777	H	29.7	Very low	28.6	Very low	203 Å²	203	154.5 Å²	154.5	94%	0.94	79%	0.79	S	S	*	*				-142.5	160	114.8	-86.6	-61.6	0	0	0	108.9
778	S	29.4	Very low	29.3	Very low	108 Å²	108	150.9 Å²	150.9	76%	0.755	78%	0.784	S	S	*	*			trans	-155.2	160.5	-172.1	-159	0	0	0	0	108
779	P	33.3	Very low	30	Very low	111 Å²	111	150.3 Å²	150.3	72%	0.721	78%	0.78	S	S	*	*				-121.2	161.9	-68.9	36.3	-24.2	0	0	0	110.8
780	N	26.8	Very low	30.6	Very low	164 Å²	164	145.9 Å²	145.9	88%	0.877	76%	0.764	S	S	*	*			trans	-162.3	170.7	162.2	-117.4	-25.6	0	0	0	112.1
781	S	28.9	Very low	31.3	Very low	104 Å²	104	144 Å²	144	73%	0.727	75%	0.753	S	S	*	*			trans	53.5	80.4	178.4	59.5	0	0	0	0	116.2
782	Q	28.8	Very low	32.3	Very low	177 Å²	177	143.6 Å²	143.6	83%	0.827	75%	0.747	S	S	*	*			trans	-89.4	109.8	148.2	175	73	39.5	0	0	107.1
783	S	33.2	Very low	33.2	Very low	101 Å²	101	138.6 Å²	138.6	71%	0.706	73%	0.73	S	S	*	*			trans	-160.8	60.4	176.5	63.2	0	0	0	0	112.6
784	D	29.4	Very low	34.5	Very low	142 Å²	142	134.7 Å²	134.7	76%	0.759	72%	0.722	S	S	*	*			trans	-129.5	155.5	162.8	-83.1	-56.4	0	0	0	108.2
785	I	31.7	Very low	35.7	Very low	158 Å²	158	130 Å²	130	81%	0.81	71%	0.711	S	S	*	*	S	Bend	trans	71.6	84.4	-171.7	-44.8	168.3	0	0	0	113.5
786	D	32.8	Very low	36.9	Very low	143 Å²	143	129.7 Å²	129.7	77%	0.765	70%	0.7	S	S	*	*			trans	-178.8	103.8	134.9	-101.5	-20.6	0	0	0	109.4
787	S	39.2	Very low	38.4	Very low	98 Å²	98	124 Å²	124	69%	0.685	68%	0.683	S	S	*	*	S	Bend	trans	-146.2	-34	179.2	-62.7	0	0	0	0	114.7	S789 A790	S787-S789 VanDerWaalsContact C-N 3.28Å; S787-S789 PolarHBondContact O-N 3.09Å; S787-A790 PolarHBondContact O-N 3.39Å
788	E	36.6	Very low	39.4	Very low	165 Å²	165	117.9 Å²	117.9	77%	0.771	66%	0.657	S	S	*	*	H	α-helix	trans	-71	-20.7	177.4	-62.9	-167	148.8	0	0	114	A790	E788-A790 VanDerWaalsContact C-N 3.28Å; E788-A790 PolarHBondContact O-N 2.95Å
789	S	38.3	Very low	40.2	Very low	88 Å²	88	116.3 Å²	116.3	62%	0.615	65%	0.647	S	S	*	*	H	α-helix	trans	-74.6	-18.9	178.3	-162	0	0	0	0	112.9	S787 S793	S787-S789 VanDerWaalsContact C-N 3.28Å; S787-S789 PolarHBondContact O-N 3.09Å; S789-S793 WeakPolarHBondContact O-CB 3.33Å; S789-S793 PolarHBondContact O-N 2.93Å
790	A	42.4	Very low	40.7	Very low	57 Å²	57	118.2 Å²	118.2	47%	0.471	64%	0.639	S	S	.	*	H	α-helix	trans	-73.5	-44.1	-178	0	0	0	0	0	112.3	S787 E788 S793 M794	S787-A790 PolarHBondContact O-N 3.39Å; E788-A790 VanDerWaalsContact C-N 3.28Å; E788-A790 PolarHBondContact O-N 2.95Å; A790-S793 WeakPolarHBondContact O-CB 3.1Å; A790-S793 PolarHBondContact O-N 2.92Å; A790-M794 PolarHBondContact O-N 3.34Å
791	E	44.3	Very low	41.8	Very low	145 Å²	145	117 Å²	117	68%	0.678	62%	0.623	S	S	*	*	H	α-helix	trans	-66.8	-44.9	-177.4	-62.7	-166.9	144.4	0	0	112.1	S793 M794 D795	E791-S793 VanDerWaalsContact C-N 3.27Å; E791-S793 PolarHBondContact O-N 2.87Å; E791-M794 WeakPolarHBondContact O-CA 3.49Å; E791-M794 WeakPolarHBondContact O-CB 3.45Å; E791-M794 PolarHBondContact O-N 2.93Å; E791-D795 PolarHBondContact O-N 3.26Å
792	K	43.9	Very low	43.2	Very low	151 Å²	151	120.7 Å²	120.7	66%	0.657	62%	0.621	S	S	*	*	H	α-helix	trans	-63.5	-32.1	173.9	-76.2	170.9	-178.6	158.1	0	112.5	I796	K792-I796 WeakPolarHBondContact O-CD1 3.38Å; K792-I796 VanDerWaalsContact O-CG1 3.3Å; K792-I796 WeakPolarHBondContact O-CG1 3.47Å; K792-I796 PolarHBondContact O-N 3.43Å
793	S	46.5	Very low	43.8	Very low	64 Å²	64	120.3 Å²	120.3	45%	0.448	61%	0.614	S	S	.	*	H	α-helix	trans	-67.3	-41.9	169.8	-162.8	0	0	0	0	111.2	S789 A790 E791 D795 I796 E797	S789-S793 WeakPolarHBondContact O-CB 3.33Å; S789-S793 PolarHBondContact O-N 2.93Å; A790-S793 WeakPolarHBondContact O-CB 3.1Å; A790-S793 PolarHBondContact O-N 2.92Å; E791-S793 VanDerWaalsContact C-N 3.27Å; E791-S793 PolarHBondContact O-N 2.87Å; S793-D795 PolarHBondContact O-N 3.14Å; S793-I796 PolarHBondContact O-N 3.22Å; S793-E797 WeakPolarHBondContact O-CB 3.49Å; S793-E797 PolarHBondContact O-N 2.93Å
794	M	54.4	Low	45.2	Very low	115 Å²	115	120.3 Å²	120.3	57%	0.567	60%	0.602	S	S	*	*	H	α-helix	trans	-62.6	-37.8	178.6	-123.4	-175.4	-60	0	0	112.9	A790 E791 N798	A790-M794 PolarHBondContact O-N 3.34Å; E791-M794 WeakPolarHBondContact O-CA 3.49Å; E791-M794 WeakPolarHBondContact O-CB 3.45Å; E791-M794 PolarHBondContact O-N 2.93Å; M794-N798 WeakPolarHBondContact O-CB 3.36Å; M794-N798 PolarHBondContact O-N 3.14Å; M794-N798 PolarHBondContact O-ND2 3.47Å
795	D	53.2	Low	46.2	Very low	109 Å²	109	116.1 Å²	116.1	58%	0.583	58%	0.58	S	S	*	*	H	α-helix	trans	-71	-36.9	174.7	-95.1	-23.4	0	0	0	112.9	E791 S793 S799	E791-D795 PolarHBondContact O-N 3.26Å; S793-D795 PolarHBondContact O-N 3.14Å; D795-S799 WeakPolarHBondContact O-CB 3.07Å; D795-S799 PolarHBondContact O-N 3.29Å
796	I	47.9	Very low	47.1	Very low	98 Å²	98	114.7 Å²	114.7	50%	0.503	57%	0.569	S	S	.	*	H	α-helix	trans	-67.8	-39.8	173.5	-67.8	168.3	0	0	0	110.7	K792 S793 S799 R800	K792-I796 WeakPolarHBondContact O-CD1 3.38Å; K792-I796 VanDerWaalsContact O-CG1 3.3Å; K792-I796 WeakPolarHBondContact O-CG1 3.47Å; K792-I796 PolarHBondContact O-N 3.43Å; S793-I796 PolarHBondContact O-N 3.22Å; I796-S799 PolarHBondContact O-N 3.08Å; I796-R800 WeakPolarHBondContact O-CB 3.11Å; I796-R800 WeakPolarHBondContact O-CG 3.21Å; I796-R800 PolarHBondContact O-N 2.75Å
797	E	54.9	Low	47.3	Very low	104 Å²	104	114.9 Å²	114.9	49%	0.486	56%	0.561	S	S	.	*	H	α-helix	trans	-67.2	-44.9	175.9	-149.1	77.9	-94.5	0	0	111	S793 S799 R800 Y801	S793-E797 WeakPolarHBondContact O-CB 3.49Å; S793-E797 PolarHBondContact O-N 2.93Å; E797-S799 VanDerWaalsContact C-N 3.35Å; E797-S799 PolarHBondContact O-N 3.09Å; E797-R800 CarbonylContact O-C 3.58Å; E797-R800 WeakPolarHBondContact O-CB 3.39Å; E797-R800 PolarHBondContact O-N 3.06Å; E797-R800 IonicContact OE1-NH1 3.45Å; E797-Y801 VanDerWaalsContact O-CB 3.3Å; E797-Y801 WeakPolarHBondContact O-CB 3.28Å; E797-Y801 PolarHBondContact O-N 3.4Å
798	N	51.7	Low	47.7	Very low	73 Å²	73	116.9 Å²	116.9	39%	0.39	55%	0.553	S	S	.	*	H	α-helix	trans	-62.5	-39.7	173.7	-87.4	-40.6	0	0	0	112	M794 Y801 R802	M794-N798 WeakPolarHBondContact O-CB 3.36Å; M794-N798 PolarHBondContact O-N 3.14Å; M794-N798 PolarHBondContact O-ND2 3.47Å; N798-Y801 PolarHBondContact O-N 3.4Å; N798-R802 WeakPolarHBondContact O-CB 3.42Å; N798-R802 VanDerWaalsContact O-CG 3.3Å; N798-R802 WeakPolarHBondContact O-CG 3.37Å; N798-R802 PolarHBondContact O-N 3.46Å
799	S	45.6	Very low	48.1	Very low	76 Å²	76	112.5 Å²	112.5	53%	0.531	54%	0.541	S	S	.	.	H	α-helix	trans	-61.6	-48.2	174.1	-179.4	0	0	0	0	110.9	D795 I796 E797 Y801 R802 Y803	D795-S799 WeakPolarHBondContact O-CB 3.07Å; D795-S799 PolarHBondContact O-N 3.29Å; I796-S799 PolarHBondContact O-N 3.08Å; E797-S799 VanDerWaalsContact C-N 3.35Å; E797-S799 PolarHBondContact O-N 3.09Å; S799-Y801 VanDerWaalsContact C-N 3.32Å; S799-Y801 PolarHBondContact O-N 3.4Å; S799-R802 PolarHBondContact O-N 3.15Å; S799-Y803 WeakPolarHBondContact O-CB 3.22Å; S799-Y803 PolarHBondContact O-N 2.94Å
800	R	44.8	Very low	48.1	Very low	151 Å²	151	112.7 Å²	112.7	57%	0.57	53%	0.534	S	S	*	.	H	α-helix	trans	-59.4	-39.8	172.1	-76.6	175.6	175.5	163.8	1.1	112.6	I796 E797 Y803 Q804	I796-R800 WeakPolarHBondContact O-CB 3.11Å; I796-R800 WeakPolarHBondContact O-CG 3.21Å; I796-R800 PolarHBondContact O-N 2.75Å; E797-R800 CarbonylContact O-C 3.58Å; E797-R800 WeakPolarHBondContact O-CB 3.39Å; E797-R800 PolarHBondContact O-N 3.06Å; E797-R800 IonicContact OE1-NH1 3.45Å; R800-Y803 PolarHBondContact O-N 3.24Å; R800-Q804 WeakPolarHBondContact O-CB 3.29Å; R800-Q804 WeakPolarHBondContact O-CG 3.49Å; R800-Q804 PolarHBondContact O-N 3.26Å
801	Y	50.1	Low	47.9	Very low	138 Å²	138	116.6 Å²	116.6	54%	0.541	54%	0.541	S	S	.	.	H	α-helix	trans	-71.2	-42.6	-178.5	-160	-105.8	0	0	0	111.5	E797 N798 S799 N805	E797-Y801 VanDerWaalsContact O-CB 3.3Å; E797-Y801 WeakPolarHBondContact O-CB 3.28Å; E797-Y801 PolarHBondContact O-N 3.4Å; N798-Y801 PolarHBondContact O-N 3.4Å; S799-Y801 VanDerWaalsContact C-N 3.32Å; S799-Y801 PolarHBondContact O-N 3.4Å; Y801-N805 WeakPolarHBondContact CD1-ND2 3.42Å; Y801-N805 WeakPolarHBondContact CE1-ND2 3.5Å; Y801-N805 VanDerWaalsContact O-CB 3.23Å; Y801-N805 WeakPolarHBondContact O-CB 3.3Å; Y801-N805 PolarHBondContact O-N 2.93Å; Y801-N805 PolarHBondContact O-ND2 2.84Å
802	R	58.1	Low	47.6	Very low	182 Å²	182	119.3 Å²	119.3	69%	0.687	55%	0.545	S	S	*	.	H	α-helix	trans	-58.5	-46.9	169.4	-70.9	-178.9	-154.6	-179.9	10.9	110.9	N798 S799 N805 H806	N798-R802 WeakPolarHBondContact O-CB 3.42Å; N798-R802 VanDerWaalsContact O-CG 3.3Å; N798-R802 WeakPolarHBondContact O-CG 3.37Å; N798-R802 PolarHBondContact O-N 3.46Å; S799-R802 PolarHBondContact O-N 3.15Å; R802-N805 PolarHBondContact O-N 3.02Å; R802-H806 WeakPolarHBondContact O-CB 3.43Å; R802-H806 PolarHBondContact O-N 3.43Å
803	Y	40.6	Very low	47.2	Very low	169 Å²	169	115.9 Å²	115.9	66%	0.663	54%	0.544	S	S	*	.	H	α-helix	trans	-67	-44.1	-179.1	-158.9	-85.7	0	0	0	112.4	S799 R800 N805 H806 Y807	S799-Y803 WeakPolarHBondContact O-CB 3.22Å; S799-Y803 PolarHBondContact O-N 2.94Å; R800-Y803 PolarHBondContact O-N 3.24Å; Y803-N805 VanDerWaalsContact C-N 3.34Å; Y803-N805 PolarHBondContact O-N 3.05Å; Y803-H806 PolarHBondContact O-N 2.05Å; Y803-Y807 HydrophobicContact CE1-CD2 4.24Å; Y803-Y807 WeakPolarHBondContact O-CB 3.46Å; Y803-Y807 PolarHBondContact O-N 3.15Å
804	Q	62.2	Low	46.4	Very low	100 Å²	100	120.3 Å²	120.3	47%	0.467	56%	0.558	S	S	.	*	H	α-helix	trans	-62.4	-40.2	173.2	-80.1	-164.5	5.8	0	0	111.9	R800 Y807 R808	R800-Q804 WeakPolarHBondContact O-CB 3.29Å; R800-Q804 WeakPolarHBondContact O-CG 3.49Å; R800-Q804 PolarHBondContact O-N 3.26Å; Q804-Y807 PolarHBondContact O-N 3.38Å; Q804-R808 VanDerWaalsContact O-CB 3.25Å; Q804-R808 WeakPolarHBondContact O-CB 3.33Å; Q804-R808 WeakPolarHBondContact O-CG 3.49Å; Q804-R808 PolarHBondContact O-N 2.97Å
805	N	51.9	Low	45.2	Very low	54 Å²	54	121.6 Å²	121.6	29%	0.289	56%	0.562	S	S	.	*	H	α-helix	trans	-70	-37.7	177.6	-72.7	-20.6	0	0	0	111.7	Y801 R802 Y803 R808 S809	Y801-N805 WeakPolarHBondContact CD1-ND2 3.42Å; Y801-N805 WeakPolarHBondContact CE1-ND2 3.5Å; Y801-N805 VanDerWaalsContact O-CB 3.23Å; Y801-N805 WeakPolarHBondContact O-CB 3.3Å; Y801-N805 PolarHBondContact O-N 2.93Å; Y801-N805 PolarHBondContact O-ND2 2.84Å; R802-N805 PolarHBondContact O-N 3.02Å; Y803-N805 VanDerWaalsContact C-N 3.34Å; Y803-N805 PolarHBondContact O-N 3.05Å; N805-R808 PolarHBondContact O-N 2.96Å; N805-S809 WeakPolarHBondContact O-CB 3.45Å; N805-S809 PolarHBondContact O-N 3.32Å; N805-S809 PolarHBondContact O-OG 3.13Å; N805-S809 VanDerWaalsContact O-OG 3.08Å
806	H	49.8	Very low	44.3	Very low	128 Å²	128	122.3 Å²	122.3	59%	0.593	57%	0.573	S	S	*	*	H	α-helix	trans	-59.9	-47.7	171.4	-161.2	-95.8	0	0	0	110.9	R802 Y803 R808 S809 L810	R802-H806 WeakPolarHBondContact O-CB 3.43Å; R802-H806 PolarHBondContact O-N 3.43Å; Y803-H806 PolarHBondContact O-N 2.05Å; H806-R808 PolarHBondContact O-N 3.39Å; H806-S809 PolarHBondContact O-N 3.42Å; H806-L810 WeakPolarHBondContact O-CD1 3.43Å; H806-L810 PolarHBondContact O-N 3.13Å
807	Y	36.3	Very low	43.7	Very low	148 Å²	148	125.8 Å²	125.8	58%	0.58	59%	0.591	S	S	*	*	H	α-helix	trans	-66.8	-34.3	178.2	-141.3	-79	0	0	0	113.3	Y803 Q804 K811	Y803-Y807 HydrophobicContact CE1-CD2 4.24Å; Y803-Y807 WeakPolarHBondContact O-CB 3.46Å; Y803-Y807 PolarHBondContact O-N 3.15Å; Q804-Y807 PolarHBondContact O-N 3.38Å; Y807-K811 PolarHBondContact O-N 2.72Å
808	R	47.7	Very low	42.5	Very low	139 Å²	139	126.6 Å²	126.6	53%	0.525	61%	0.608	S	S	.	*	H	α-helix	trans	-71.3	-35.7	173.1	-76.7	170.3	173.8	175.9	-0.5	112.1	Q804 N805 H806 K811 R812	Q804-R808 VanDerWaalsContact O-CB 3.25Å; Q804-R808 WeakPolarHBondContact O-CB 3.33Å; Q804-R808 WeakPolarHBondContact O-CG 3.49Å; Q804-R808 PolarHBondContact O-N 2.97Å; N805-R808 PolarHBondContact O-N 2.96Å; H806-R808 PolarHBondContact O-N 3.39Å; R808-K811 PolarHBondContact O-N 3.03Å; R808-R812 WeakPolarHBondContact O-CB 3.4Å; R808-R812 WeakPolarHBondContact O-CG 3.47Å; R808-R812 PolarHBondContact O-N 2.97Å
809	S	45	Very low	41.5	Very low	73 Å²	73	125.9 Å²	125.9	51%	0.51	62%	0.618	S	S	.	*	H	α-helix	trans	-67.5	-44.3	174	-70.7	0	0	0	0	111.4	N805 H806 K811 R812 A813	N805-S809 WeakPolarHBondContact O-CB 3.45Å; N805-S809 PolarHBondContact O-N 3.32Å; N805-S809 PolarHBondContact O-OG 3.13Å; N805-S809 VanDerWaalsContact O-OG 3.08Å; H806-S809 PolarHBondContact O-N 3.42Å; S809-K811 VanDerWaalsContact C-N 3.34Å; S809-K811 PolarHBondContact O-N 3.46Å; S809-R812 PolarHBondContact O-N 2.88Å; S809-R812 VanDerWaalsContact O-N 3.17Å; S809-A813 WeakPolarHBondContact O-CB 3.46Å; S809-A813 PolarHBondContact O-N 3.03Å
810	L	37.8	Very low	40.9	Very low	92 Å²	92	128.5 Å²	128.5	48%	0.482	63%	0.631	S	S	.	*	H	α-helix	trans	-61.1	-41.5	171.4	-88.6	83.1	0	0	0	111.8	H806 R812 A813 H814	H806-L810 WeakPolarHBondContact O-CD1 3.43Å; H806-L810 PolarHBondContact O-N 3.13Å; L810-R812 VanDerWaalsContact C-N 3.33Å; L810-R812 PolarHBondContact O-N 3.47Å; L810-A813 PolarHBondContact O-N 2.99Å; L810-H814 PolarHBondContact O-CD2 3.13Å; L810-H814 PolarHBondContact O-N 3.45Å; L810-H814 VanDerWaalsContact O-N 3.17Å
811	K	39.1	Very low	39.9	Very low	140 Å²	140	130.5 Å²	130.5	61%	0.609	65%	0.646	S	S	*	*	H	α-helix	trans	-66.2	-30.1	174.3	-91.6	-163.5	168.1	-169.6	0	114.1	Y807 R808 S809 H814 Q815	Y807-K811 PolarHBondContact O-N 2.72Å; R808-K811 PolarHBondContact O-N 3.03Å; S809-K811 VanDerWaalsContact C-N 3.34Å; S809-K811 PolarHBondContact O-N 3.46Å; K811-H814 CarbonylContact O-C 2.83Å; K811-Q815 WeakPolarHBondContact O-CG 3.46Å; K811-Q815 PolarHBondContact O-N 2.96Å
812	R	38.6	Very low	39.1	Very low	201 Å²	201	129.9 Å²	129.9	76%	0.758	66%	0.66	S	S	*	*	H	α-helix	trans	-74.2	-36.4	172.4	-78.4	179	174.9	178.2	-2.2	112.4	R808 S809 L810 H814 Q815	R808-R812 WeakPolarHBondContact O-CB 3.4Å; R808-R812 WeakPolarHBondContact O-CG 3.47Å; R808-R812 PolarHBondContact O-N 2.97Å; S809-R812 PolarHBondContact O-N 2.88Å; S809-R812 VanDerWaalsContact O-N 3.17Å; L810-R812 VanDerWaalsContact C-N 3.33Å; L810-R812 PolarHBondContact O-N 3.47Å; R812-H814 PolarHBondContact O-N 3.29Å; R812-Q815 PolarHBondContact O-N 3.43Å
813	A	34	Very low	37.6	Very low	79 Å²	79	128.9 Å²	128.9	65%	0.653	66%	0.662	S	S	*	*	H	α-helix	trans	-63.7	-22.5	173	0	0	0	0	0	112.8	S809 L810	S809-A813 WeakPolarHBondContact O-CB 3.46Å; S809-A813 PolarHBondContact O-N 3.03Å; L810-A813 PolarHBondContact O-N 2.99Å
814	H	31.1	Very low	37.1	Very low	158 Å²	158	128.6 Å²	128.6	73%	0.731	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	33.6	176.9	-63.7	-64.5	0	0	0	113.7	L810 K811 R812	L810-H814 PolarHBondContact O-CD2 3.13Å; L810-H814 PolarHBondContact O-N 3.45Å; L810-H814 VanDerWaalsContact O-N 3.17Å; K811-H814 CarbonylContact O-C 2.83Å; R812-H814 PolarHBondContact O-N 3.29Å
815	Q	29.9	Very low	35.3	Very low	141 Å²	141	129.4 Å²	129.4	66%	0.659	68%	0.679	S	S	*	*	S	Bend	trans	-126.2	126.9	162.6	-78.1	-168.1	-39.5	0	0	110.7	K811 R812	K811-Q815 WeakPolarHBondContact O-CG 3.46Å; K811-Q815 PolarHBondContact O-N 2.96Å; R812-Q815 PolarHBondContact O-N 3.43Å
816	P	33.9	Very low	34.3	Very low	124 Å²	124	134.2 Å²	134.2	81%	0.805	70%	0.704	S	S	*	*			trans	-65.1	146	179.7	28	-34.6	0	0	0	110.8	S818	P816-S818 PolarHBondContact O-N 2.88Å
817	I	35.4	Very low	33.4	Very low	172 Å²	172	135.9 Å²	135.9	88%	0.882	72%	0.716	S	S	*	*			trans	-71.1	103.4	-172.2	-61.3	170.8	0	0	0	109.8	G819	I817-G819 VanDerWaalsContact C-N 3.31Å; I817-G819 PolarHBondContact O-N 3.14Å
818	S	28.7	Very low	32.9	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	73%	0.731	S	S	*	*			trans	-76	77.8	177	61.2	0	0	0	0	111.4	P816 T820	P816-S818 PolarHBondContact O-N 2.88Å; S818-T820 PolarHBondContact O-N 3.24Å
819	G	31.9	Very low	31.9	Very low	57 Å²	57	132.2 Å²	132.2	59%	0.588	74%	0.737	S	S	*	*			trans	-74	113.6	177.7	0	0	0	0	0	113.3	I817	I817-G819 VanDerWaalsContact C-N 3.31Å; I817-G819 PolarHBondContact O-N 3.14Å
820	T	32	Very low	31.1	Very low	132 Å²	132	140.7 Å²	140.7	81%	0.81	76%	0.758	S	S	*	*			trans	24.6	117.3	148.6	52.1	0	0	0	0	119.3	S818 P822	S818-T820 PolarHBondContact O-N 3.24Å; T820-P822 WeakPolarHBondContact O-CD 3.38Å
821	Q	24.6	Very low	30.6	Very low	192 Å²	192	141.7 Å²	141.7	90%	0.897	77%	0.772	S	S	*	*			trans	-61.3	132.3	166.8	-62.8	-177.3	-69.4	0	0	112.7
822	P	32.6	Very low	29.9	Very low	126 Å²	126	140.1 Å²	140.1	82%	0.818	78%	0.779	S	S	*	*			trans	-92.6	109.2	150.4	32.4	-24.3	0	0	0	109.4	T820 L824	T820-P822 WeakPolarHBondContact O-CD 3.38Å; P822-L824 PolarHBondContact O-N 2.89Å
823	H	26.8	Very low	29.6	Very low	161 Å²	161	135.8 Å²	135.8	75%	0.745	78%	0.776	S	S	*	*			trans	-74.6	110	174.8	166.1	-58.7	0	0	0	110.3
824	L	29.6	Very low	29.5	Very low	163 Å²	163	139.5 Å²	139.5	85%	0.853	79%	0.786	S	S	*	*			trans	-157.2	112.6	161.9	-110.4	168.4	0	0	0	110.9	P822	P822-L824 PolarHBondContact O-N 2.89Å
825	D	25.5	Very low	29.3	Very low	116 Å²	116	139.9 Å²	139.9	62%	0.62	79%	0.792	S	S	*	*			trans	-74.7	167.1	172.5	-67	-69.7	0	0	0	112.5
826	N	29.8	Very low	29.4	Very low	155 Å²	155	142 Å²	142	83%	0.829	80%	0.802	S	S	*	*			trans	73.6	128.4	177.9	-39.3	-84.9	0	0	0	112.5
827	I	31	Very low	29.4	Very low	164 Å²	164	143.9 Å²	143.9	84%	0.841	81%	0.805	S	S	*	*			cis	-139.8	153.7	40.6	-78.3	166.7	0	0	0	111.7	G829	I827-G829 PolarHBondContact O-N 3.06Å
828	V	26.9	Very low	29.2	Very low	147 Å²	147	146.2 Å²	146.2	89%	0.891	81%	0.805	S	S	*	*			trans	-75	119.4	176.6	175.9	0	0	0	0	111.9
829	G	26.2	Very low	29.5	Very low	62 Å²	62	147.7 Å²	147.7	64%	0.639	80%	0.803	S	S	*	*			trans	87.6	103.8	145.2	0	0	0	0	0	118.3	I827	I827-G829 PolarHBondContact O-N 3.06Å
830	R	28.5	Very low	29.5	Very low	252 Å²	252	153.7 Å²	153.7	95%	0.951	81%	0.813	S	S	*	*			trans	-155.9	164.6	130.2	-106.8	156.1	-163.9	-100.8	-1.1	110.5
831	S	25.8	Very low	30.1	Very low	112 Å²	112	151.2 Å²	151.2	78%	0.783	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.7	162.8	-169.6	44.7	0	0	0	0	113.7
832	S	25	Very low	31.4	Very low	108 Å²	108	146.1 Å²	146.1	76%	0.755	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-55.1	135.7	174.8	-150.5	0	0	0	0	112
833	P	32.8	Very low	32.1	Very low	109 Å²	109	146 Å²	146	71%	0.708	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-79.7	170	143.1	36.2	-30.5	0	0	0	109.8
834	D	31.5	Very low	33	Very low	158 Å²	158	145.3 Å²	145.3	85%	0.845	78%	0.776	S	S	*	*			trans	-88.8	177	-170.8	-71.3	-72.8	0	0	0	114.7	E836	D834-E836 PolarHBondContact O-N 3.17Å
835	L	27.7	Very low	33.5	Very low	165 Å²	165	144 Å²	144	86%	0.864	77%	0.766	S	S	*	*			trans	-90.5	94.9	-167.9	-168.5	77.7	0	0	0	110.8
836	E	32.1	Very low	34.7	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.874	76%	0.757	S	S	*	*			trans	-67.7	136.1	174.9	-68	179.7	163.1	0	0	111.7	D834	D834-E836 PolarHBondContact O-N 3.17Å
837	D	32.3	Very low	35.8	Very low	162 Å²	162	138.9 Å²	138.9	87%	0.866	74%	0.741	S	S	*	*			trans	-67.6	133.5	-175.5	-78.9	-63	0	0	0	113.1	D839	D837-D839 PolarHBondContact O-N 3.31Å
838	Y	31.8	Very low	36.1	Very low	222 Å²	222	139.8 Å²	139.8	87%	0.871	74%	0.735	S	S	*	*			trans	-94.4	90.1	179.2	-164.4	-94.1	0	0	0	110.7
839	D	34.7	Very low	37.1	Very low	151 Å²	151	138 Å²	138	81%	0.807	72%	0.72	S	S	*	*			trans	-63.5	145.6	-170.8	-159	3.8	0	0	0	114	D837	D837-D839 PolarHBondContact O-N 3.31Å
840	F	32.8	Very low	38.5	Very low	184 Å²	184	141.5 Å²	141.5	81%	0.807	71%	0.714	S	S	*	*			trans	-89.1	118.4	-172.5	-109.2	-99.3	0	0	0	111.7	S842	F840-S842 PolarHBondContact O-N 3.46Å
841	S	45.1	Very low	39.1	Very low	79 Å²	79	132.1 Å²	132.1	55%	0.552	69%	0.691	S	S	*	*			trans	-63.7	108.4	-179.8	175.7	0	0	0	0	112.6	D843 Q844	S841-D843 PolarHBondContact O-N 2.9Å; S841-D843 VanDerWaalsContact O-N 3.13Å; S841-Q844 PolarHBondContact O-N 3.43Å
842	S	50.3	Low	39.6	Very low	86 Å²	86	129.5 Å²	129.5	60%	0.601	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-23.8	-179.8	-172	0	0	0	0	114.4	F840 Q844 E845 E846	F840-S842 PolarHBondContact O-N 3.46Å; S842-Q844 PolarHBondContact O-N 2.9Å; S842-Q844 VanDerWaalsContact O-N 3.07Å; S842-E845 PolarHBondContact O-N 3.02Å; S842-E846 PolarHBondContact O-N 3.37Å; S842-E846 VanDerWaalsContact O-N 3.15Å
843	D	48.4	Very low	40.3	Very low	122 Å²	122	127.9 Å²	127.9	65%	0.652	66%	0.664	S	S	*	*	H	α-helix	trans	-53.3	-32.3	178.7	-69	-37.8	0	0	0	113.3	S841 S847	S841-D843 PolarHBondContact O-N 2.9Å; S841-D843 VanDerWaalsContact O-N 3.13Å; D843-S847 VanDerWaalsContact O-CB 3.3Å; D843-S847 WeakPolarHBondContact O-CB 3.41Å; D843-S847 PolarHBondContact O-N 2.93Å
844	Q	44.5	Very low	40.8	Very low	147 Å²	147	128.2 Å²	128.2	69%	0.687	66%	0.664	S	S	*	*	H	α-helix	trans	-76.9	-28.8	-177.1	-161.1	164.4	57.4	0	0	112.7	S841 S842 Y848	S841-Q844 PolarHBondContact O-N 3.43Å; S842-Q844 PolarHBondContact O-N 2.9Å; S842-Q844 VanDerWaalsContact O-N 3.07Å; Q844-Y848 PolarHBondContact O-N 2.95Å
845	E	41.2	Very low	40.8	Very low	135 Å²	135	127.9 Å²	127.9	63%	0.631	66%	0.662	S	S	*	*	H	α-helix	trans	-79.6	-44.4	175.3	-174.8	165.7	-152.9	0	0	111.3	S842 S847 Y848 L849	S842-E845 PolarHBondContact O-N 3.02Å; E845-S847 PolarHBondContact O-N 2.86Å; E845-Y848 WeakPolarHBondContact O-CB 3.21Å; E845-Y848 PolarHBondContact O-N 3.27Å; E845-L849 HydrophobicContact CG-CD1 4.28Å; E845-L849 PolarHBondContact O-N 3.36Å
846	E	51	Low	41	Very low	93 Å²	93	128.4 Å²	128.4	44%	0.435	66%	0.66	S	S	.	*	H	α-helix	trans	-63.4	-29	177.1	-144.6	-158.3	167.7	0	0	112	S842 R850	S842-E846 PolarHBondContact O-N 3.37Å; S842-E846 VanDerWaalsContact O-N 3.15Å; E846-R850 WeakPolarHBondContact O-CB 3.44Å; E846-R850 PolarHBondContact O-N 3.13Å; E846-R850 IonicContact OE1-CZ 3.01Å; E846-R850 IonicContact OE1-NH1 3.56Å; E846-R850 PolarHBondContact OE1-NH1 3.47Å; E846-R850 IonicContact OE1-NH2 3.55Å; E846-R850 IonicContact OE2-CZ 3.55Å; E846-R850 VanDerWaalsContact OE2-CZ 3.25Å; E846-R850 IonicContact OE2-NH1 2.61Å; E846-R850 PolarHBondContact OE2-NH1 3Å; E846-R850 VanDerWaalsContact OE2-NH1 3.12Å; E846-R850 IonicContact OE2-NH2 2.61Å; E846-R850 PolarHBondContact OE2-NH2 2.8Å
847	S	53	Low	41.1	Very low	72 Å²	72	126 Å²	126	50%	0.503	66%	0.658	S	S	.	*	H	α-helix	trans	-64.2	-44.8	170.2	-170.9	0	0	0	0	112.4	D843 E845 R850 A851	D843-S847 VanDerWaalsContact O-CB 3.3Å; D843-S847 WeakPolarHBondContact O-CB 3.41Å; D843-S847 PolarHBondContact O-N 2.93Å; E845-S847 PolarHBondContact O-N 2.86Å; S847-R850 PolarHBondContact O-N 3.13Å; S847-A851 WeakPolarHBondContact O-CB 3.49Å; S847-A851 PolarHBondContact O-N 3.06Å
848	Y	36.7	Very low	40.9	Very low	183 Å²	183	130 Å²	130	72%	0.718	66%	0.661	S	S	*	*	H	α-helix	trans	-64.7	-40.2	175.6	-106.3	-84.1	0	0	0	112.3	Q844 E845 A851 A852	Q844-Y848 PolarHBondContact O-N 2.95Å; E845-Y848 WeakPolarHBondContact O-CB 3.21Å; E845-Y848 PolarHBondContact O-N 3.27Å; Y848-A851 PolarHBondContact O-N 3.25Å; Y848-A852 WeakPolarHBondContact O-CB 3.4Å; Y848-A852 PolarHBondContact O-N 3.08Å
849	L	46.7	Very low	40.8	Very low	108 Å²	108	128.5 Å²	128.5	57%	0.565	66%	0.659	S	S	*	*	H	α-helix	trans	-69.8	-34.7	178.2	-65.2	173.7	0	0	0	112.5	E845 A852 S853	E845-L849 HydrophobicContact CG-CD1 4.28Å; E845-L849 PolarHBondContact O-N 3.36Å; L849-A852 PolarHBondContact O-N 3.38Å; L849-S853 PolarHBondContact O-N 3.11Å; L849-S853 PolarHBondContact O-OG 3Å
850	R	55.5	Low	40.6	Very low	136 Å²	136	129.1 Å²	129.1	51%	0.513	66%	0.662	S	S	.	*	H	α-helix	trans	-67.9	-34.1	169.3	-79.6	-169.8	-83.4	-104.7	-0.2	113.1	E846 S847 S853 T854	E846-R850 WeakPolarHBondContact O-CB 3.44Å; E846-R850 PolarHBondContact O-N 3.13Å; E846-R850 IonicContact OE1-CZ 3.01Å; E846-R850 IonicContact OE1-NH1 3.56Å; E846-R850 PolarHBondContact OE1-NH1 3.47Å; E846-R850 IonicContact OE1-NH2 3.55Å; E846-R850 IonicContact OE2-CZ 3.55Å; E846-R850 VanDerWaalsContact OE2-CZ 3.25Å; E846-R850 IonicContact OE2-NH1 2.61Å; E846-R850 PolarHBondContact OE2-NH1 3Å; E846-R850 VanDerWaalsContact OE2-NH1 3.12Å; E846-R850 IonicContact OE2-NH2 2.61Å; E846-R850 PolarHBondContact OE2-NH2 2.8Å; S847-R850 PolarHBondContact O-N 3.13Å; R850-S853 WeakPolarHBondContact CA-OG 3.5Å; R850-S853 PolarHBondContact O-OG 3.22Å; R850-T854 PolarHBondContact O-N 2.99Å; R850-T854 PolarHBondContact O-OG1 3.33Å
851	A	42.6	Very low	40.5	Very low	56 Å²	56	123.6 Å²	123.6	46%	0.463	66%	0.657	S	S	.	*	H	α-helix	trans	-69.7	-34.8	172.4	0	0	0	0	0	112.8	S847 Y848 T854	S847-A851 WeakPolarHBondContact O-CB 3.49Å; S847-A851 PolarHBondContact O-N 3.06Å; Y848-A851 PolarHBondContact O-N 3.25Å; A851-T854 PolarHBondContact O-OG1 3.12Å
852	A	36.7	Very low	39.6	Very low	57 Å²	57	127 Å²	127	47%	0.471	67%	0.674	S	S	.	*	H	α-helix	trans	-70.8	-47.5	177	0	0	0	0	0	112.5	Y848 L849 T854 L855	Y848-A852 WeakPolarHBondContact O-CB 3.4Å; Y848-A852 PolarHBondContact O-N 3.08Å; L849-A852 PolarHBondContact O-N 3.38Å; A852-T854 VanDerWaalsContact C-N 3.31Å; A852-T854 PolarHBondContact O-N 3.06Å; A852-L855 PolarHBondContact O-N 3.28Å
853	S	39.7	Very low	38.6	Very low	73 Å²	73	128.8 Å²	128.8	51%	0.51	68%	0.682	S	S	.	*	H	α-helix	trans	-65.4	-29.5	-177.8	49.5	0	0	0	0	113.8	L849 R850 L855 Q856	L849-S853 PolarHBondContact O-N 3.11Å; L849-S853 PolarHBondContact O-OG 3Å; R850-S853 WeakPolarHBondContact CA-OG 3.5Å; R850-S853 PolarHBondContact O-OG 3.22Å; S853-L855 PolarHBondContact O-N 3.48Å; S853-Q856 PolarHBondContact O-N 2.73Å
854	T	42.9	Very low	37.4	Very low	116 Å²	116	133.5 Å²	133.5	71%	0.712	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-7.5	178.6	38.5	0	0	0	0	114.7	R850 A851 A852	R850-T854 PolarHBondContact O-N 2.99Å; R850-T854 PolarHBondContact O-OG1 3.33Å; A851-T854 PolarHBondContact O-OG1 3.12Å; A852-T854 VanDerWaalsContact C-N 3.31Å; A852-T854 PolarHBondContact O-N 3.06Å
855	L	31.2	Very low	36.4	Very low	152 Å²	152	131.8 Å²	131.8	80%	0.796	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-7.6	175.6	-78.5	166.7	0	0	0	115.1	A852 S853	A852-L855 PolarHBondContact O-N 3.28Å; S853-L855 PolarHBondContact O-N 3.48Å
856	Q	31.7	Very low	35.6	Very low	176 Å²	176	131.1 Å²	131.1	82%	0.822	71%	0.711	S	S	*	*	S	Bend	trans	-104.4	7.6	-171.4	-68.2	-156.2	-2.5	0	0	117	S853	S853-Q856 PolarHBondContact O-N 2.73Å
857	V	34	Very low	34.4	Very low	137 Å²	137	131.8 Å²	131.8	83%	0.83	73%	0.727	S	S	*	*			trans	-123.1	76.6	177.8	-167.9	0	0	0	0	112.4
858	R	27.5	Very low	33.2	Very low	245 Å²	245	137.1 Å²	137.1	93%	0.925	74%	0.743	S	S	*	*			trans	-150.5	42.7	174.5	-145.7	172.5	-170.9	157.2	3.4	116.4
859	K	30.3	Very low	32.9	Very low	191 Å²	191	133.1 Å²	133.1	83%	0.83	74%	0.739	S	S	*	*	S	Bend	trans	-131.8	122.1	167.9	-80.3	-177.1	177.3	173.7	0	112.5
860	N	30.6	Very low	31.8	Very low	164 Å²	164	135.9 Å²	135.9	88%	0.877	75%	0.754	S	S	*	*			trans	63.1	125.4	150.7	-50.9	-9.9	0	0	0	118.3
861	G	30.2	Very low	30.3	Very low	68 Å²	68	132.8 Å²	132.8	70%	0.701	75%	0.753	S	S	*	*			trans	173.1	7.4	175.1	0	0	0	0	0	118	T863	G861-T863 PolarHBondContact O-N 3.43Å
862	T	25.9	Very low	29.5	Very low	149 Å²	149	139.6 Å²	139.6	91%	0.914	77%	0.772	S	S	*	*			trans	-80.4	83.3	-179.7	49.4	0	0	0	0	112.2
863	T	29.9	Very low	28.8	Very low	125 Å²	125	147.9 Å²	147.9	77%	0.767	79%	0.792	S	S	*	*			trans	-122.1	112.3	171.9	49.7	0	0	0	0	111.5	G861	G861-T863 PolarHBondContact O-N 3.43Å
864	F	22.7	Very low	28.2	Very low	221 Å²	221	149.2 Å²	149.2	97%	0.969	80%	0.801	S	S	*	*			trans	-65.7	131.3	164.2	-88.6	-109.2	0	0	0	109.9
865	S	25.1	Very low	27.4	Very low	110 Å²	110	152.1 Å²	152.1	77%	0.769	81%	0.806	S	S	*	*			trans	-145.4	123.1	155	61.8	0	0	0	0	110.6
866	S	23.5	Very low	27.3	Very low	121 Å²	121	150 Å²	150	85%	0.846	80%	0.799	S	S	*	*			trans	-92.5	125.9	170.5	174.6	0	0	0	0	109.7
867	S	26.7	Very low	27.1	Very low	108 Å²	108	150.7 Å²	150.7	76%	0.755	80%	0.8	S	S	*	*			trans	-159.6	146	158.7	52.7	0	0	0	0	110.9
868	H	27.3	Very low	26.7	Very low	183 Å²	183	151.9 Å²	151.9	85%	0.847	79%	0.794	S	S	*	*			trans	-81.8	160.8	179.9	-100.4	-97.5	0	0	0	112.2
869	P	29.3	Very low	26.6	Very low	99 Å²	99	146.9 Å²	146.9	64%	0.643	78%	0.781	S	S	*	*			trans	-90.9	178.3	-163.9	37.2	-38	0	0	0	114.7
870	L	25.2	Very low	26.4	Very low	166 Å²	166	144.9 Å²	144.9	87%	0.869	78%	0.775	S	S	*	*			trans	80.8	146.8	170.6	-49.4	170	0	0	0	116.2
871	S	23.6	Very low	26.4	Very low	72 Å²	72	144.2 Å²	144.2	50%	0.503	78%	0.777	S	S	.	*			cis	-172.2	150.9	-35.5	71	0	0	0	0	106.7
872	K	26.1	Very low	26.1	Very low	198 Å²	198	148.4 Å²	148.4	86%	0.861	78%	0.778	S	S	*	*			trans	68.7	159.5	165.9	-55.4	157.3	-168.5	168.2	0	114.6
873	R	22.3	Very low	26.1	Very low	232 Å²	232	148.4 Å²	148.4	88%	0.875	77%	0.771	S	S	*	*			cis	179.3	103.4	-24.6	171.9	-167.6	-178.3	-179.8	2.8	107.7
874	S	26.4	Very low	26	Very low	101 Å²	101	148.4 Å²	148.4	71%	0.706	77%	0.767	S	S	*	*			trans	-165	129.3	167.3	21.9	0	0	0	0	107.2
875	Q	26.8	Very low	26.3	Very low	177 Å²	177	145 Å²	145	83%	0.827	76%	0.764	S	S	*	*				58.6	126.9	81.8	-63.8	-178	-3.3	0	0	111.7
876	T	28.8	Very low	26.4	Very low	106 Å²	106	144 Å²	144	65%	0.65	76%	0.762	S	S	*	*			cis	-168.6	168.6	9	7.5	0	0	0	0	109.6
877	K	26.2	Very low	26.7	Very low	191 Å²	191	146.2 Å²	146.2	83%	0.83	76%	0.764	S	S	*	*			trans	44.6	149	139.5	-66.8	170	-179.5	178.1	0	119.9
878	K	25.7	Very low	26.9	Very low	162 Å²	162	144.5 Å²	144.5	70%	0.704	76%	0.764	S	S	*	*			cis	175.5	169.9	-11.4	-171.6	-163.5	177.4	-150.5	0	103.6
879	Q	26.9	Very low	26.8	Very low	140 Å²	140	147.8 Å²	147.8	65%	0.654	77%	0.769	S	S	*	*			trans	78.4	111.2	164	-46.6	-161.3	-114.6	0	0	112.9
880	E	25	Very low	26.6	Very low	149 Å²	149	150.9 Å²	150.9	70%	0.696	78%	0.78	S	S	*	*				69.3	105.6	80.6	-65.4	159.8	125.6	0	0	112.7
881	T	30.1	Very low	26.8	Very low	151 Å²	151	147.5 Å²	147.5	93%	0.926	77%	0.77	S	S	*	*				-161.9	130.5	125.8	4.2	0	0	0	0	111
882	H	23.7	Very low	26.9	Very low	156 Å²	156	153.1 Å²	153.1	72%	0.722	79%	0.791	S	S	*	*			trans	-79.7	138.2	172.3	179.8	-67.3	0	0	0	109.4	D884	H882-D884 IonicContact CE1-OD1 3.75Å; H882-D884 PolarHBondContact CE1-OD1 3.32Å; H882-D884 IonicContact ND1-OD1 3.25Å
883	L	27.7	Very low	27.1	Very low	148 Å²	148	152.7 Å²	152.7	78%	0.775	79%	0.789	S	S	*	*			trans	-177	109	153.3	-104.6	163.3	0	0	0	112.8
884	D	27	Very low	27.3	Very low	126 Å²	126	147.5 Å²	147.5	67%	0.674	79%	0.787	S	S	*	*			trans	12.6	128	145.9	-41.7	-23.7	0	0	0	119.7	H882	H882-D884 IonicContact CE1-OD1 3.75Å; H882-D884 PolarHBondContact CE1-OD1 3.32Å; H882-D884 IonicContact ND1-OD1 3.25Å
885	V	28.9	Very low	27.5	Very low	150 Å²	150	148.9 Å²	148.9	91%	0.909	79%	0.793	S	S	*	*			trans	-127.9	115.2	164.2	177.9	0	0	0	0	109.6
886	A	28.4	Very low	27.5	Very low	87 Å²	87	147.6 Å²	147.6	72%	0.719	80%	0.797	S	S	*	*			trans	-126.1	148.1	169.6	0	0	0	0	0	110.3
887	D	29.6	Very low	27.3	Very low	169 Å²	169	145.8 Å²	145.8	90%	0.904	80%	0.799	S	S	*	*			trans	46.5	87.5	165.7	-61.3	-22.5	0	0	0	118.4
888	G	29.6	Very low	27.6	Very low	72 Å²	72	148.3 Å²	148.3	74%	0.742	80%	0.804	S	S	*	*			trans	-123.1	17.3	177.8	0	0	0	0	0	116.4
889	W	25.4	Very low	27.6	Very low	252 Å²	252	150.4 Å²	150.4	96%	0.955	81%	0.813	S	S	*	*			trans	-104.4	80.6	-173.6	-85.9	49.7	0	0	0	113.5
890	N	25.9	Very low	27.9	Very low	164 Å²	164	151.3 Å²	151.3	88%	0.877	82%	0.82	S	S	*	*	S	Bend	trans	-165.6	146.2	151.6	-110	-57.3	0	0	0	113.7
891	S	28.1	Very low	28.1	Very low	95 Å²	95	151 Å²	151	66%	0.664	82%	0.824	S	S	*	*			trans	59.5	81.2	167.7	-177.3	0	0	0	0	118.7
892	M	27.5	Very low	28	Very low	190 Å²	190	153.5 Å²	153.5	94%	0.936	83%	0.825	S	S	*	*			trans	-115.1	121.1	141.7	-74.3	-158.7	179.7	0	0	110.5
893	K	29.1	Very low	28.3	Very low	189 Å²	189	150.7 Å²	150.7	82%	0.822	82%	0.823	S	S	*	*			trans	-92.4	115.9	176.3	-65	175.3	-178.8	174.9	0	109.1
894	C	27.4	Very low	28.6	Very low	122 Å²	122	150 Å²	150	82%	0.824	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-67.4	127.9	172	-63.3	0	0	0	0	110.2
895	P	30.5	Very low	28.7	Very low	130 Å²	130	150.6 Å²	150.6	84%	0.844	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-77.2	143.6	-174.3	30	-34.9	0	0	0	112.6
896	V	26.5	Very low	28.8	Very low	151 Å²	151	151.2 Å²	151.2	92%	0.915	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-80.5	134	178.9	174.2	0	0	0	0	111.3
897	G	25.3	Very low	28.7	Very low	67 Å²	67	150.7 Å²	150.7	69%	0.691	83%	0.833	S	S	*	*			trans	92.2	106.5	145.9	0	0	0	0	0	117.8
898	R	30.6	Very low	28.9	Very low	244 Å²	244	148.6 Å²	148.6	92%	0.921	83%	0.827	S	S	*	*			trans	-131.6	124.6	140.8	-70.6	-169.2	178.8	-175	0.6	108.6
899	K	26.6	Very low	28.9	Very low	206 Å²	206	155.3 Å²	155.3	90%	0.896	84%	0.835	S	S	*	*			trans	-80.5	138.5	167	-62.5	179.4	176.8	-175	0	108.1
900	I	33.9	Very low	29.3	Very low	159 Å²	159	150.7 Å²	150.7	82%	0.815	83%	0.828	S	S	*	*			trans	-138	145.6	163.3	-60	-176.4	0	0	0	106.7
901	D	29.2	Very low	29.6	Very low	144 Å²	144	146.1 Å²	146.1	77%	0.77	82%	0.82	S	S	*	*			trans	-81.8	159	-147.9	-50.4	-79	0	0	0	117.1	S903	D901-S903 PolarHBondContact O-N 3.04Å
902	E	26.3	Very low	30.1	Very low	202 Å²	202	149.9 Å²	149.9	94%	0.944	83%	0.827	S	S	*	*			trans	-79.2	102.5	171.3	-58.6	172.4	140.2	0	0	111
903	S	30.2	Very low	30.8	Very low	97 Å²	97	145.4 Å²	145.4	68%	0.678	82%	0.815	S	S	*	*			trans	-169.7	58.8	161	58.7	0	0	0	0	114.9	D901	D901-S903 PolarHBondContact O-N 3.04Å
904	S	35.4	Very low	31.4	Very low	134 Å²	134	144.7 Å²	144.7	94%	0.937	81%	0.814	S	S	*	*			trans	-117.2	90	162.5	-75.4	0	0	0	0	110.1
905	I	28.9	Very low	32.3	Very low	138 Å²	138	144.3 Å²	144.3	71%	0.708	80%	0.804	S	S	*	*			trans	-93.1	151.2	-170.7	-77.9	171.3	0	0	0	111.3
906	N	29.7	Very low	33	Very low	163 Å²	163	141 Å²	141	87%	0.872	79%	0.792	S	S	*	*			trans	70.9	143.3	173.7	-63.3	-30.2	0	0	0	117.5
907	G	27	Very low	34.2	Very low	76 Å²	76	138.4 Å²	138.4	78%	0.784	77%	0.769	S	S	*	*			trans	170.4	-72.8	155.7	0	0	0	0	0	115.1
908	V	33.4	Very low	36.5	Very low	126 Å²	126	138 Å²	138	76%	0.764	76%	0.756	S	S	*	*			trans	-126.4	108.2	-160.1	-172.9	0	0	0	0	111.6	L910	V908-L910 HydrophobicContact CG1-CD1 4.38Å; V908-L910 HydrophobicContact CG1-CG 4.01Å; V908-L910 PolarHBondContact O-N 3.42Å
909	K	30.7	Very low	38.6	Very low	212 Å²	212	132.3 Å²	132.3	92%	0.922	74%	0.744	S	S	*	*			trans	-73.4	78.2	161.5	-75.1	-174.6	174	-175.7	0	109.5	G911	K909-G911 PolarHBondContact O-N 3.21Å
910	L	34.3	Very low	41	Very low	155 Å²	155	127.8 Å²	127.8	81%	0.812	73%	0.729	S	S	*	*			trans	-70.1	116	153.1	-86.4	161.8	0	0	0	106	V908 E912	V908-L910 HydrophobicContact CG1-CD1 4.38Å; V908-L910 HydrophobicContact CG1-CG 4.01Å; V908-L910 PolarHBondContact O-N 3.42Å; L910-E912 PolarHBondContact O-N 3.37Å
911	G	32.2	Very low	43.3	Very low	68 Å²	68	124.2 Å²	124.2	70%	0.701	71%	0.709	S	S	*	*			trans	-62.5	130.2	-176	0	0	0	0	0	110.4	K909 S913	K909-G911 PolarHBondContact O-N 3.21Å; G911-S913 VanDerWaalsContact C-N 3.27Å; G911-S913 PolarHBondContact O-N 3.19Å
912	E	37.7	Very low	45.9	Very low	175 Å²	175	123.2 Å²	123.2	82%	0.818	70%	0.695	S	S	*	*			trans	-65.1	91.6	169.6	-67	175.4	130.9	0	0	108.1	L910 H914	L910-E912 PolarHBondContact O-N 3.37Å; E912-H914 PolarHBondContact O-N 3.3Å
913	S	41.3	Very low	48.9	Very low	96 Å²	96	116.7 Å²	116.7	67%	0.671	67%	0.668	S	S	*	*			trans	-62.9	104.4	166.4	53.6	0	0	0	0	106.7	G911 N915	G911-S913 VanDerWaalsContact C-N 3.27Å; G911-S913 PolarHBondContact O-N 3.19Å; S913-N915 PolarHBondContact O-N 3.14Å
914	H	43	Very low	51.5	Low	174 Å²	174	117.2 Å²	117.2	81%	0.806	66%	0.662	S	S	*	*			trans	-61.6	80.2	173.9	-85.2	-103.9	0	0	0	109.8	E912 G916	E912-H914 PolarHBondContact O-N 3.3Å; H914-G916 PolarHBondContact O-N 2.82Å
915	N	46.8	Very low	54	Low	114 Å²	114	116.2 Å²	116.2	61%	0.61	64%	0.643	S	S	*	*			trans	-71.9	62.4	153.6	-73.7	5.4	0	0	0	107.5	S913 F917 R922	S913-N915 PolarHBondContact O-N 3.14Å; N915-F917 HydrophobicContact CB-CD2 4.36Å; N915-F917 HydrophobicContact CB-CE2 4.22Å; N915-F917 WeakPolarHBondContact O-CD2 3.25Å; N915-F917 PolarHBondContact O-N 2.91Å; N915-R922 PolarHBondContact O-NH2 3.44Å
916	G	45.1	Very low	56.9	Low	59 Å²	59	116.6 Å²	116.6	61%	0.608	64%	0.635	S	S	*	*			trans	-72	65	166.8	0	0	0	0	0	109	H914 S918	H914-G916 PolarHBondContact O-N 2.82Å; G916-S918 PolarHBondContact O-N 3.22Å; G916-S918 VanDerWaalsContact O-N 3.13Å
917	F	51.8	Low	59.9	Low	98 Å²	98	113.4 Å²	113.4	43%	0.43	62%	0.615	S	S	.	*			trans	-42.3	119.4	148.9	-68	-75.5	0	0	0	106.6	N915 E921 R922	N915-F917 HydrophobicContact CB-CD2 4.36Å; N915-F917 HydrophobicContact CB-CE2 4.22Å; N915-F917 WeakPolarHBondContact O-CD2 3.25Å; N915-F917 PolarHBondContact O-N 2.91Å; F917-E921 HydrophobicContact CD1-CG 4.48Å; F917-E921 WeakPolarHBondContact CD1-OE1 3.2Å; F917-R922 HydrophobicContact CB-CG 3.93Å; F917-R922 PolarHBondContact O-NE 3.36Å; F917-R922 VanDerWaalsContact O-NE 3.14Å
918	S	71.8	Confident	63	Low	59 Å²	59	114.6 Å²	114.6	41%	0.413	60%	0.603	S	S	.	*			trans	-53.2	150.3	-179.3	-167.3	0	0	0	0	109	G916 D920 E921 R922	G916-S918 PolarHBondContact O-N 3.22Å; G916-S918 VanDerWaalsContact O-N 3.13Å; S918-D920 PolarHBondContact O-N 2.7Å; S918-D920 VanDerWaalsContact O-N 3.13Å; S918-D920 PolarHBondContact OG-OD2 2.79Å; S918-E921 WeakPolarHBondContact O-CA 3.4Å; S918-E921 PolarHBondContact O-N 3.07Å; S918-R922 PolarHBondContact O-N 2.68Å
919	D	74.8	Confident	65.8	Low	123 Å²	123	112.2 Å²	112.2	66%	0.658	59%	0.592	S	S	*	*	H	α-helix	trans	-57.3	-30.2	175.2	-74.9	-50.7	0	0	0	111	R922 V923	D919-R922 CarbonylContact O-C 3.57Å; D919-R922 PolarHBondContact O-N 2.88Å; D919-V923 VanDerWaalsContact O-CG2 3.29Å; D919-V923 WeakPolarHBondContact O-CG2 3.25Å; D919-V923 PolarHBondContact O-N 3.45Å
920	D	78.3	Confident	68.9	Low	112 Å²	112	106.9 Å²	106.9	60%	0.599	57%	0.574	S	S	*	*	H	α-helix	trans	-58.6	-46.2	169.7	-43.1	-67.8	0	0	0	112.6	S918 V923 I924	S918-D920 PolarHBondContact O-N 2.7Å; S918-D920 VanDerWaalsContact O-N 3.13Å; S918-D920 PolarHBondContact OG-OD2 2.79Å; D920-V923 WeakPolarHBondContact O-CB 3.32Å; D920-V923 PolarHBondContact O-N 3.44Å; D920-V923 VanDerWaalsContact O-N 3.13Å; D920-I924 VanDerWaalsContact O-CG1 3.27Å; D920-I924 WeakPolarHBondContact O-CG1 3.36Å; D920-I924 PolarHBondContact O-N 3.12Å
921	E	80.6	Confident	71.8	Confident	83 Å²	83	105.2 Å²	105.2	39%	0.388	56%	0.56	S	S	.	*	H	α-helix	trans	-70.9	-36.7	-179.5	-162.5	-177.4	163.9	0	0	111	F917 S918 V923 I924 Q925	F917-E921 HydrophobicContact CD1-CG 4.48Å; F917-E921 WeakPolarHBondContact CD1-OE1 3.2Å; S918-E921 WeakPolarHBondContact O-CA 3.4Å; S918-E921 PolarHBondContact O-N 3.07Å; E921-V923 PolarHBondContact O-N 2.78Å; E921-I924 PolarHBondContact O-N 2.89Å; E921-Q925 PolarHBondContact O-N 2.7Å
922	R	84.5	Confident	74.7	Confident	124 Å²	124	106 Å²	106	47%	0.468	55%	0.547	S	S	.	.	H	α-helix	trans	-65.8	-21.5	170.7	-64.8	176.2	176.4	-113.1	-5.2	112.8	N915 F917 S918 D919 R926	N915-R922 PolarHBondContact O-NH2 3.44Å; F917-R922 HydrophobicContact CB-CG 3.93Å; F917-R922 PolarHBondContact O-NE 3.36Å; F917-R922 VanDerWaalsContact O-NE 3.14Å; S918-R922 PolarHBondContact O-N 2.68Å; D919-R922 CarbonylContact O-C 3.57Å; D919-R922 PolarHBondContact O-N 2.88Å; R922-R926 VanDerWaalsContact O-CZ 3.31Å; R922-R926 PolarHBondContact O-NE 3.29Å; R922-R926 PolarHBondContact O-NH2 3.12Å
923	V	88.3	Confident	77.3	Confident	65 Å²	65	102 Å²	102	39%	0.394	53%	0.528	S	S	.	.	H	α-helix	trans	-83.9	-47.5	171.2	166	0	0	0	0	110.2	D919 D920 E921 Q925 R926 E927	D919-V923 VanDerWaalsContact O-CG2 3.29Å; D919-V923 WeakPolarHBondContact O-CG2 3.25Å; D919-V923 PolarHBondContact O-N 3.45Å; D920-V923 WeakPolarHBondContact O-CB 3.32Å; D920-V923 PolarHBondContact O-N 3.44Å; D920-V923 VanDerWaalsContact O-N 3.13Å; E921-V923 PolarHBondContact O-N 2.78Å; V923-Q925 VanDerWaalsContact C-N 3.33Å; V923-Q925 PolarHBondContact O-N 3.13Å; V923-R926 WeakPolarHBondContact O-CB 3.39Å; V923-R926 PolarHBondContact O-N 3.27Å; V923-E927 PolarHBondContact O-N 3.47Å
924	I	86.1	Confident	79.8	Confident	107 Å²	107	101 Å²	101	55%	0.549	52%	0.519	S	S	.	.	H	α-helix	trans	-56.8	-43.9	178	-69.6	162.3	0	0	0	111.5	D920 E921 R926 E927 L928	D920-I924 VanDerWaalsContact O-CG1 3.27Å; D920-I924 WeakPolarHBondContact O-CG1 3.36Å; D920-I924 PolarHBondContact O-N 3.12Å; E921-I924 PolarHBondContact O-N 2.89Å; I924-R926 PolarHBondContact O-N 2.98Å; I924-E927 PolarHBondContact O-N 3.43Å; I924-L928 WeakPolarHBondContact O-CB 3.39Å; I924-L928 PolarHBondContact O-N 3.43Å
925	Q	86.6	Confident	82.1	Confident	114 Å²	114	98.9 Å²	98.9	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-67.8	-32.4	177.2	-70.1	-160.6	20.1	0	0	113.2	E921 V923 S929	E921-Q925 PolarHBondContact O-N 2.7Å; V923-Q925 VanDerWaalsContact C-N 3.33Å; V923-Q925 PolarHBondContact O-N 3.13Å; Q925-S929 WeakPolarHBondContact O-CB 3.29Å; Q925-S929 PolarHBondContact O-N 2.77Å
926	R	91.4	Very high	84.2	Confident	145 Å²	145	98 Å²	98	55%	0.547	50%	0.495	S	S	.	.	H	α-helix	trans	-66.9	-52.4	171.8	-100.7	173.9	-68.7	163.1	1.3	111	R922 V923 I924 L928 S929 D930	R922-R926 VanDerWaalsContact O-CZ 3.31Å; R922-R926 PolarHBondContact O-NE 3.29Å; R922-R926 PolarHBondContact O-NH2 3.12Å; V923-R926 WeakPolarHBondContact O-CB 3.39Å; V923-R926 PolarHBondContact O-N 3.27Å; I924-R926 PolarHBondContact O-N 2.98Å; R926-L928 PolarHBondContact O-N 3.41Å; R926-S929 WeakPolarHBondContact O-CB 3.19Å; R926-S929 PolarHBondContact O-N 3.19Å; R926-D930 VanDerWaalsContact O-CG 3.28Å; R926-D930 PolarHBondContact O-N 2.82Å
927	E	92.1	Very high	86.4	Confident	96 Å²	96	100.6 Å²	100.6	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-55.1	-39.2	175.9	-80.2	-162.2	-158.9	0	0	112.5	V923 I924 K931	V923-E927 PolarHBondContact O-N 3.47Å; I924-E927 PolarHBondContact O-N 3.43Å; E927-K931 VanDerWaalsContact O-CB 3.28Å; E927-K931 WeakPolarHBondContact O-CB 3.34Å; E927-K931 VanDerWaalsContact O-CD 3.23Å; E927-K931 WeakPolarHBondContact O-CD 3.49Å; E927-K931 WeakPolarHBondContact O-CG 3.36Å; E927-K931 PolarHBondContact O-N 3.47Å; E927-K931 IonicContact OE2-NZ 3.76Å; E927-K931 PolarHBondContact OE2-NZ 2.81Å
928	L	91.7	Very high	88.2	Confident	102 Å²	102	100.3 Å²	100.3	53%	0.534	50%	0.498	S	S	.	.	H	α-helix	trans	-67.3	-42.8	177.2	-172.6	65.7	0	0	0	111.5	I924 R926 K931 I932	I924-L928 WeakPolarHBondContact O-CB 3.39Å; I924-L928 PolarHBondContact O-N 3.43Å; R926-L928 PolarHBondContact O-N 3.41Å; L928-K931 PolarHBondContact O-N 2.71Å; L928-I932 HydrophobicContact CD1-CD1 4.45Å; L928-I932 HydrophobicContact CG-CD1 4.06Å; L928-I932 WeakPolarHBondContact O-CB 3.32Å; L928-I932 WeakPolarHBondContact O-CD1 3.29Å; L928-I932 VanDerWaalsContact O-CG1 3.24Å; L928-I932 WeakPolarHBondContact O-CG1 3.32Å; L928-I932 PolarHBondContact O-N 3.49Å
929	S	93.1	Very high	89.1	Confident	76 Å²	76	100.2 Å²	100.2	53%	0.531	49%	0.494	S	S	.	.	H	α-helix	trans	-61.6	-47.3	175.3	-162.6	0	0	0	0	111.7	Q925 R926 K931 I932 Q933	Q925-S929 WeakPolarHBondContact O-CB 3.29Å; Q925-S929 PolarHBondContact O-N 2.77Å; R926-S929 WeakPolarHBondContact O-CB 3.19Å; R926-S929 PolarHBondContact O-N 3.19Å; S929-K931 PolarHBondContact O-N 3.01Å; S929-I932 PolarHBondContact O-N 3.07Å; S929-Q933 PolarHBondContact O-N 2.86Å
930	D	95	Very high	89.7	Confident	99 Å²	99	99 Å²	99	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-63.9	-39.7	178.9	-64.1	-27.2	0	0	0	111.6	R926 Q933 T934	R926-D930 VanDerWaalsContact O-CG 3.28Å; R926-D930 PolarHBondContact O-N 2.82Å; D930-Q933 PolarHBondContact O-N 3.44Å; D930-T934 VanDerWaalsContact O-CB 3.29Å; D930-T934 WeakPolarHBondContact O-CB 3.48Å; D930-T934 PolarHBondContact O-N 2.62Å; D930-T934 PolarHBondContact O-OG1 3.06Å
931	K	95.6	Very high	90.2	Very high	120 Å²	120	99 Å²	99	52%	0.522	48%	0.482	S	S	.	.	H	α-helix	trans	-65.6	-40.5	174.3	-73.8	162.5	-165.1	165.8	0	112.1	E927 L928 S929 Y935	E927-K931 VanDerWaalsContact O-CB 3.28Å; E927-K931 WeakPolarHBondContact O-CB 3.34Å; E927-K931 VanDerWaalsContact O-CD 3.23Å; E927-K931 WeakPolarHBondContact O-CD 3.49Å; E927-K931 WeakPolarHBondContact O-CG 3.36Å; E927-K931 PolarHBondContact O-N 3.47Å; E927-K931 IonicContact OE2-NZ 3.76Å; E927-K931 PolarHBondContact OE2-NZ 2.81Å; L928-K931 PolarHBondContact O-N 2.71Å; S929-K931 PolarHBondContact O-N 3.01Å; K931-Y935 WeakPolarHBondContact O-CB 3.43Å; K931-Y935 PolarHBondContact O-N 3.02Å
932	I	93	Very high	90.6	Very high	84 Å²	84	97.3 Å²	97.3	43%	0.431	48%	0.477	S	S	.	.	H	α-helix	trans	-65	-44.8	175.5	-71.5	164.7	0	0	0	110.7	L928 S929 Y935 K936	L928-I932 HydrophobicContact CD1-CD1 4.45Å; L928-I932 HydrophobicContact CG-CD1 4.06Å; L928-I932 WeakPolarHBondContact O-CB 3.32Å; L928-I932 WeakPolarHBondContact O-CD1 3.29Å; L928-I932 VanDerWaalsContact O-CG1 3.24Å; L928-I932 WeakPolarHBondContact O-CG1 3.32Å; L928-I932 PolarHBondContact O-N 3.49Å; S929-I932 PolarHBondContact O-N 3.07Å; I932-Y935 PolarHBondContact O-N 3.45Å; I932-K936 WeakPolarHBondContact O-CG 3.43Å; I932-K936 PolarHBondContact O-N 3.2Å; I932-K936 VanDerWaalsContact O-N 3.09Å
933	Q	91.5	Very high	90.8	Very high	91 Å²	91	94 Å²	94	43%	0.425	47%	0.471	S	S	.	.	H	α-helix	trans	-64.6	-44.9	178	-173.1	61.2	18.8	0	0	111.3	S929 D930 Y935 K936 E937	S929-Q933 PolarHBondContact O-N 2.86Å; D930-Q933 PolarHBondContact O-N 3.44Å; Q933-Y935 VanDerWaalsContact C-N 3.3Å; Q933-Y935 PolarHBondContact O-N 3.22Å; Q933-K936 PolarHBondContact O-N 2.87Å; Q933-E937 WeakPolarHBondContact CG-OE1 3.35Å; Q933-E937 PolarHBondContact NE2-OE1 2.94Å; Q933-E937 PolarHBondContact O-N 2.92Å
934	T	94	Very high	90.9	Very high	77 Å²	77	94.9 Å²	94.9	47%	0.472	47%	0.473	S	S	.	.	H	α-helix	trans	-57.3	-42.4	174.6	-57	0	0	0	0	111.6	D930 E937 T938	D930-T934 VanDerWaalsContact O-CB 3.29Å; D930-T934 WeakPolarHBondContact O-CB 3.48Å; D930-T934 PolarHBondContact O-N 2.62Å; D930-T934 PolarHBondContact O-OG1 3.06Å; T934-E937 PolarHBondContact O-N 2.73Å; T934-T938 HydrophobicContact CG2-CG2 4.12Å; T934-T938 WeakPolarHBondContact O-CB 3.3Å; T934-T938 WeakPolarHBondContact O-CG2 3.3Å; T934-T938 PolarHBondContact O-N 3.23Å; T934-T938 PolarHBondContact O-OG1 3.43Å
935	Y	91.8	Very high	91.1	Very high	128 Å²	128	96.8 Å²	96.8	50%	0.502	48%	0.477	S	S	.	.	H	α-helix	trans	-62.9	-43.9	176.8	178.2	-93.3	0	0	0	112.3	K931 I932 Q933 E937 T938 V939 E940	K931-Y935 WeakPolarHBondContact O-CB 3.43Å; K931-Y935 PolarHBondContact O-N 3.02Å; I932-Y935 PolarHBondContact O-N 3.45Å; Q933-Y935 VanDerWaalsContact C-N 3.3Å; Q933-Y935 PolarHBondContact O-N 3.22Å; Y935-E937 PolarHBondContact O-N 3.19Å; Y935-T938 PolarHBondContact O-N 3.37Å; Y935-V939 HydrophobicContact CD2-CB 4.21Å; Y935-V939 HydrophobicContact CD2-CG2 3.77Å; Y935-V939 HydrophobicContact CE2-CB 3.97Å; Y935-V939 HydrophobicContact CE2-CG1 4.07Å; Y935-V939 HydrophobicContact CE2-CG2 3.77Å; Y935-V939 HydrophobicContact CG-CG2 4.45Å; Y935-V939 WeakPolarHBondContact O-CA 3.45Å; Y935-V939 VanDerWaalsContact O-CB 3.29Å; Y935-V939 WeakPolarHBondContact O-CB 3.47Å; Y935-V939 PolarHBondContact O-N 2.84Å; Y935-E940 HydrophobicContact CD1-CG 4.34Å; Y935-E940 HydrophobicContact CE1-CG 3.93Å
936	K	91.5	Very high	91.1	Very high	96 Å²	96	98.5 Å²	98.5	42%	0.417	48%	0.479	S	S	.	.	I	π-helix	trans	-60.1	-46.7	176.9	-70.1	179.1	173.2	-178.5	0	112.1	I932 Q933 E940 E941	I932-K936 WeakPolarHBondContact O-CG 3.43Å; I932-K936 PolarHBondContact O-N 3.2Å; I932-K936 VanDerWaalsContact O-N 3.09Å; Q933-K936 PolarHBondContact O-N 2.87Å; K936-E940 WeakPolarHBondContact O-CB 3.36Å; K936-E940 PolarHBondContact O-N 3.34Å; K936-E940 VanDerWaalsContact O-N 3.15Å; K936-E941 PolarHBondContact O-N 2.9Å
937	E	90.9	Very high	90.9	Very high	114 Å²	114	96.3 Å²	96.3	53%	0.533	48%	0.478	S	S	.	.	I	π-helix	trans	-71.1	-37	-178.7	-68.8	177.1	-167.1	0	0	113.1	Q933 T934 Y935 P942	Q933-E937 WeakPolarHBondContact CG-OE1 3.35Å; Q933-E937 PolarHBondContact NE2-OE1 2.94Å; Q933-E937 PolarHBondContact O-N 2.92Å; T934-E937 PolarHBondContact O-N 2.73Å; Y935-E937 PolarHBondContact O-N 3.19Å; E937-P942 WeakPolarHBondContact O-CD 3.45Å
938	T	90.2	Very high	90.7	Very high	91 Å²	91	98 Å²	98	56%	0.558	48%	0.484	S	S	*	.	I	π-helix	trans	-90.2	-22.2	-176	59.4	0	0	0	0	114.5	T934 Y935 P942	T934-T938 HydrophobicContact CG2-CG2 4.12Å; T934-T938 WeakPolarHBondContact O-CB 3.3Å; T934-T938 WeakPolarHBondContact O-CG2 3.3Å; T934-T938 PolarHBondContact O-N 3.23Å; T934-T938 PolarHBondContact O-OG1 3.43Å; Y935-T938 PolarHBondContact O-N 3.37Å; T938-P942 VanDerWaalsContact O-CG 3.27Å; T938-P942 WeakPolarHBondContact O-CG 3.17Å
939	V	89.7	Confident	90.6	Very high	57 Å²	57	97.7 Å²	97.7	35%	0.345	48%	0.48	S	S	.	.	I	π-helix	trans	-119.1	-54.3	-175.5	-172.1	0	0	0	0	112.4	Y935 V943	Y935-V939 HydrophobicContact CD2-CB 4.21Å; Y935-V939 HydrophobicContact CD2-CG2 3.77Å; Y935-V939 HydrophobicContact CE2-CB 3.97Å; Y935-V939 HydrophobicContact CE2-CG1 4.07Å; Y935-V939 HydrophobicContact CE2-CG2 3.77Å; Y935-V939 HydrophobicContact CG-CG2 4.45Å; Y935-V939 WeakPolarHBondContact O-CA 3.45Å; Y935-V939 VanDerWaalsContact O-CB 3.29Å; Y935-V939 WeakPolarHBondContact O-CB 3.47Å; Y935-V939 PolarHBondContact O-N 2.84Å; V939-V943 WeakPolarHBondContact O-CB 3.43Å; V939-V943 WeakPolarHBondContact O-CG2 3.3Å; V939-V943 PolarHBondContact O-N 3.36Å
940	E	87.6	Confident	90.4	Very high	99 Å²	99	98.4 Å²	98.4	46%	0.463	48%	0.481	S	S	.	.	I	π-helix	trans	-73.3	-52	-172.1	-60.1	-171.5	162.9	0	0	112.4	Y935 K936 V943 L944	Y935-E940 HydrophobicContact CD1-CG 4.34Å; Y935-E940 HydrophobicContact CE1-CG 3.93Å; K936-E940 WeakPolarHBondContact O-CB 3.36Å; K936-E940 PolarHBondContact O-N 3.34Å; K936-E940 VanDerWaalsContact O-N 3.15Å; E940-V943 PolarHBondContact O-N 2.99Å; E940-L944 WeakPolarHBondContact O-CB 3.48Å; E940-L944 PolarHBondContact O-N 3.43Å
941	E	88.2	Confident	89.9	Confident	112 Å²	112	96.7 Å²	96.7	52%	0.523	48%	0.481	S	S	.	.	H	α-helix	trans	-48.1	-56.7	175.4	-104.1	-68.6	131.8	0	0	113.2	K936 V943 L944 K945	K936-E941 PolarHBondContact O-N 2.9Å; E941-V943 VanDerWaalsContact C-N 3.31Å; E941-V943 PolarHBondContact O-N 3.5Å; E941-L944 PolarHBondContact O-N 3.02Å; E941-K945 VanDerWaalsContact O-CB 3.28Å; E941-K945 WeakPolarHBondContact O-CB 3.33Å; E941-K945 PolarHBondContact O-N 3.41Å
942	P	89.8	Confident	89.6	Confident	46 Å²	46	94.4 Å²	94.4	30%	0.299	48%	0.477	S	S	.	.	H	α-helix	trans	-72	-19.1	-177.9	27	-34.7	0	0	0	114.4	E937 T938 R946	E937-P942 WeakPolarHBondContact O-CD 3.45Å; T938-P942 VanDerWaalsContact O-CG 3.27Å; T938-P942 WeakPolarHBondContact O-CG 3.17Å; P942-R946 PolarHBondContact O-N 2.87Å; P942-R946 PolarHBondContact O-NE 3.01Å; P942-R946 PolarHBondContact O-NH2 3.35Å
943	V	89.6	Confident	89.2	Confident	56 Å²	56	93.6 Å²	93.6	34%	0.339	47%	0.473	S	S	.	.	H	α-helix	trans	-78.7	-47.4	170.7	168.7	0	0	0	0	110.3	V939 E940 E941 K945 R946 N947	V939-V943 WeakPolarHBondContact O-CB 3.43Å; V939-V943 WeakPolarHBondContact O-CG2 3.3Å; V939-V943 PolarHBondContact O-N 3.36Å; E940-V943 PolarHBondContact O-N 2.99Å; E941-V943 VanDerWaalsContact C-N 3.31Å; E941-V943 PolarHBondContact O-N 3.5Å; V943-K945 VanDerWaalsContact C-N 3.29Å; V943-K945 PolarHBondContact O-N 3.36Å; V943-R946 WeakPolarHBondContact O-CB 3.36Å; V943-R946 PolarHBondContact O-N 3.24Å; V943-R946 VanDerWaalsContact O-N 3.13Å; V943-N947 VanDerWaalsContact O-CG 3.3Å; V943-N947 PolarHBondContact O-N 2.95Å; V943-N947 PolarHBondContact O-OD1 3.23Å
944	L	89.3	Confident	88.9	Confident	82 Å²	82	91.6 Å²	91.6	43%	0.429	47%	0.472	S	S	.	.	H	α-helix	trans	-57.8	-42.4	175.7	-179.2	61.3	0	0	0	111.4	E940 E941 N947 K948	E940-L944 WeakPolarHBondContact O-CB 3.48Å; E940-L944 PolarHBondContact O-N 3.43Å; E941-L944 PolarHBondContact O-N 3.02Å; L944-N947 PolarHBondContact O-N 2.99Å; L944-K948 HydrophobicContact CG-CD 4.34Å; L944-K948 WeakPolarHBondContact O-CB 3.38Å; L944-K948 WeakPolarHBondContact O-CG 3.48Å; L944-K948 PolarHBondContact O-N 3.45Å
945	K	89.7	Confident	88.4	Confident	147 Å²	147	90.2 Å²	90.2	64%	0.639	47%	0.468	S	S	*	.	H	α-helix	trans	-63.5	-39.9	175.9	-168.5	168.8	-173.3	167.8	0	112.6	E941 V943 Q949	E941-K945 VanDerWaalsContact O-CB 3.28Å; E941-K945 WeakPolarHBondContact O-CB 3.33Å; E941-K945 PolarHBondContact O-N 3.41Å; V943-K945 VanDerWaalsContact C-N 3.29Å; V943-K945 PolarHBondContact O-N 3.36Å; K945-Q949 WeakPolarHBondContact O-CB 3.42Å; K945-Q949 PolarHBondContact O-N 3.35Å; K945-Q949 VanDerWaalsContact O-N 3.08Å
946	R	87.9	Confident	88.1	Confident	150 Å²	150	90.8 Å²	90.8	57%	0.566	47%	0.47	S	S	*	.	H	α-helix	trans	-64.5	-45.8	172.4	-107.1	175.8	-70.7	137.7	-2.1	111.8	P942 V943 K948 Q949 T950	P942-R946 PolarHBondContact O-N 2.87Å; P942-R946 PolarHBondContact O-NE 3.01Å; P942-R946 PolarHBondContact O-NH2 3.35Å; V943-R946 WeakPolarHBondContact O-CB 3.36Å; V943-R946 PolarHBondContact O-N 3.24Å; V943-R946 VanDerWaalsContact O-N 3.13Å; R946-K948 PolarHBondContact O-N 3.28Å; R946-Q949 WeakPolarHBondContact O-CB 3.47Å; R946-Q949 PolarHBondContact O-N 2.95Å; R946-Q949 VanDerWaalsContact O-N 3.16Å; R946-T950 PolarHBondContact O-N 3.29Å; R946-T950 PolarHBondContact O-OG1 2.81Å; R946-T950 VanDerWaalsContact O-OG1 3.05Å
947	N	86.8	Confident	87.7	Confident	100 Å²	100	91.8 Å²	91.8	54%	0.535	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-42.8	-179.4	-66.8	-6.6	0	0	0	111.6	V943 L944 Q949 T950 A951	V943-N947 VanDerWaalsContact O-CG 3.3Å; V943-N947 PolarHBondContact O-N 2.95Å; V943-N947 PolarHBondContact O-OD1 3.23Å; L944-N947 PolarHBondContact O-N 2.99Å; N947-Q949 VanDerWaalsContact C-N 3.35Å; N947-Q949 PolarHBondContact O-N 3.26Å; N947-T950 PolarHBondContact O-N 2.92Å; N947-A951 PolarHBondContact O-N 3.27Å
948	K	88.4	Confident	87.4	Confident	132 Å²	132	92.1 Å²	92.1	57%	0.574	48%	0.484	S	S	*	.	H	α-helix	trans	-58.6	-43.8	172.1	-74.3	175.4	177.9	177.6	0	111.8	L944 R946 A951 V952	L944-K948 HydrophobicContact CG-CD 4.34Å; L944-K948 WeakPolarHBondContact O-CB 3.38Å; L944-K948 WeakPolarHBondContact O-CG 3.48Å; L944-K948 PolarHBondContact O-N 3.45Å; R946-K948 PolarHBondContact O-N 3.28Å; K948-A951 PolarHBondContact O-N 2.77Å; K948-V952 WeakPolarHBondContact O-CG2 3.42Å; K948-V952 PolarHBondContact O-N 3.41Å; K948-V952 VanDerWaalsContact O-N 3.14Å
949	Q	90	Very high	87	Confident	95 Å²	95	93.1 Å²	93.1	44%	0.444	49%	0.485	S	S	.	.	H	α-helix	trans	-63.2	-46.9	176.9	-174.4	58.2	50.8	0	0	112.1	K945 R946 N947 A951 V952 D953	K945-Q949 WeakPolarHBondContact O-CB 3.42Å; K945-Q949 PolarHBondContact O-N 3.35Å; K945-Q949 VanDerWaalsContact O-N 3.08Å; R946-Q949 WeakPolarHBondContact O-CB 3.47Å; R946-Q949 PolarHBondContact O-N 2.95Å; R946-Q949 VanDerWaalsContact O-N 3.16Å; N947-Q949 VanDerWaalsContact C-N 3.35Å; N947-Q949 PolarHBondContact O-N 3.26Å; Q949-A951 VanDerWaalsContact C-N 3.3Å; Q949-A951 PolarHBondContact O-N 3.4Å; Q949-V952 PolarHBondContact O-N 3.44Å; Q949-V952 VanDerWaalsContact O-N 3.16Å; Q949-D953 WeakPolarHBondContact CG-OD2 3.21Å; Q949-D953 PolarHBondContact NE2-OD1 2.82Å; Q949-D953 PolarHBondContact NE2-OD2 2.84Å; Q949-D953 VanDerWaalsContact O-CG 3.3Å; Q949-D953 PolarHBondContact O-N 2.82Å
950	T	87.4	Confident	86.7	Confident	91 Å²	91	91.6 Å²	91.6	56%	0.558	48%	0.481	S	S	*	.	H	α-helix	trans	-59.4	-39.2	177.6	-55.3	0	0	0	0	112.2	R946 N947 D953 A954	R946-T950 PolarHBondContact O-N 3.29Å; R946-T950 PolarHBondContact O-OG1 2.81Å; R946-T950 VanDerWaalsContact O-OG1 3.05Å; N947-T950 PolarHBondContact O-N 2.92Å; T950-D953 PolarHBondContact O-N 3.47Å; T950-A954 WeakPolarHBondContact O-CB 3.21Å; T950-A954 PolarHBondContact O-N 3.44Å
951	A	85.3	Confident	86.4	Confident	63 Å²	63	90.6 Å²	90.6	52%	0.521	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-43.2	175.4	0	0	0	0	0	112.3	N947 K948 Q949 A954 A955	N947-A951 PolarHBondContact O-N 3.27Å; K948-A951 PolarHBondContact O-N 2.77Å; Q949-A951 VanDerWaalsContact C-N 3.3Å; Q949-A951 PolarHBondContact O-N 3.4Å; A951-A954 PolarHBondContact O-N 3.02Å; A951-A955 WeakPolarHBondContact O-CB 3.5Å; A951-A955 PolarHBondContact O-N 2.79Å
952	V	88.3	Confident	85.6	Confident	72 Å²	72	88.4 Å²	88.4	44%	0.436	48%	0.475	S	S	.	.	H	α-helix	trans	-64.6	-40.5	175.6	172.2	0	0	0	0	111.5	K948 Q949 A955 R956	K948-V952 WeakPolarHBondContact O-CG2 3.42Å; K948-V952 PolarHBondContact O-N 3.41Å; K948-V952 VanDerWaalsContact O-N 3.14Å; Q949-V952 PolarHBondContact O-N 3.44Å; Q949-V952 VanDerWaalsContact O-N 3.16Å; V952-A955 PolarHBondContact O-N 3.44Å; V952-R956 PolarHBondContact O-N 2.9Å
953	D	86.4	Confident	85.2	Confident	66 Å²	66	92.5 Å²	92.5	35%	0.353	49%	0.491	S	S	.	.	H	α-helix	trans	-68.4	-38.3	179	-65.9	-30	0	0	0	111.8	Q949 T950 R956 L957	Q949-D953 WeakPolarHBondContact CG-OD2 3.21Å; Q949-D953 PolarHBondContact NE2-OD1 2.82Å; Q949-D953 PolarHBondContact NE2-OD2 2.84Å; Q949-D953 VanDerWaalsContact O-CG 3.3Å; Q949-D953 PolarHBondContact O-N 2.82Å; T950-D953 PolarHBondContact O-N 3.47Å; D953-R956 PolarHBondContact O-N 3.48Å; D953-R956 IonicContact OD1-CZ 2.7Å; D953-R956 IonicContact OD1-NH1 2.62Å; D953-R956 PolarHBondContact OD1-NH1 2.95Å; D953-R956 IonicContact OD1-NH2 2.73Å; D953-R956 PolarHBondContact OD1-NH2 3.34Å; D953-R956 VanDerWaalsContact OD1-NH2 3.11Å; D953-L957 PolarHBondContact O-N 3.36Å; D953-L957 VanDerWaalsContact O-N 3.14Å
954	A	83.6	Confident	84.5	Confident	49 Å²	49	94.1 Å²	94.1	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-63.2	-43.6	171.3	0	0	0	0	0	112.2	T950 A951 R956 L957 L958	T950-A954 WeakPolarHBondContact O-CB 3.21Å; T950-A954 PolarHBondContact O-N 3.44Å; A951-A954 PolarHBondContact O-N 3.02Å; A954-R956 PolarHBondContact O-N 2.95Å; A954-L957 WeakPolarHBondContact O-CB 3.24Å; A954-L957 PolarHBondContact O-N 3.36Å; A954-L957 VanDerWaalsContact O-N 3.09Å; A954-L958 PolarHBondContact O-N 3.25Å
955	A	83.7	Confident	84	Confident	48 Å²	48	95.7 Å²	95.7	40%	0.397	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-42.2	177	0	0	0	0	0	112.3	A951 V952 L957 L958 L959	A951-A955 WeakPolarHBondContact O-CB 3.5Å; A951-A955 PolarHBondContact O-N 2.79Å; V952-A955 PolarHBondContact O-N 3.44Å; A955-L957 VanDerWaalsContact C-N 3.3Å; A955-L957 PolarHBondContact O-N 3.3Å; A955-L958 PolarHBondContact O-N 3.24Å; A955-L959 WeakPolarHBondContact O-CG 3.19Å; A955-L959 PolarHBondContact O-N 3.34Å
956	R	86.6	Confident	83.3	Confident	141 Å²	141	92.1 Å²	92.1	53%	0.532	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-35	173.5	-68.4	-159.5	-125.8	83.2	2	112.6	V952 D953 A954 G960	V952-R956 PolarHBondContact O-N 2.9Å; D953-R956 PolarHBondContact O-N 3.48Å; D953-R956 IonicContact OD1-CZ 2.7Å; D953-R956 IonicContact OD1-NH1 2.62Å; D953-R956 PolarHBondContact OD1-NH1 2.95Å; D953-R956 IonicContact OD1-NH2 2.73Å; D953-R956 PolarHBondContact OD1-NH2 3.34Å; D953-R956 VanDerWaalsContact OD1-NH2 3.11Å; A954-R956 PolarHBondContact O-N 2.95Å; R956-G960 PolarHBondContact O-N 3.33Å
957	L	83.1	Confident	82.5	Confident	116 Å²	116	90.5 Å²	90.5	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-65.5	-44.4	177.1	-127.9	171.1	0	0	0	111.6	D953 A954 A955 G960 I961	D953-L957 PolarHBondContact O-N 3.36Å; D953-L957 VanDerWaalsContact O-N 3.14Å; A954-L957 WeakPolarHBondContact O-CB 3.24Å; A954-L957 PolarHBondContact O-N 3.36Å; A954-L957 VanDerWaalsContact O-N 3.09Å; A955-L957 VanDerWaalsContact C-N 3.3Å; A955-L957 PolarHBondContact O-N 3.3Å; L957-G960 PolarHBondContact O-N 3.04Å; L957-I961 HydrophobicContact CD2-CD1 4.1Å; L957-I961 HydrophobicContact CD2-CG1 4.46Å; L957-I961 WeakPolarHBondContact O-CG1 3.33Å; L957-I961 PolarHBondContact O-N 3.17Å
958	L	83	Confident	81.6	Confident	121 Å²	121	93.6 Å²	93.6	63%	0.634	50%	0.496	S	S	*	.	H	α-helix	trans	-63.7	-42.6	175.8	-67.6	172.1	0	0	0	112.2	A954 A955 G960 I961 S962	A954-L958 PolarHBondContact O-N 3.25Å; A955-L958 PolarHBondContact O-N 3.24Å; L958-G960 VanDerWaalsContact C-N 3.34Å; L958-G960 PolarHBondContact O-N 2.81Å; L958-I961 PolarHBondContact O-N 3.42Å; L958-S962 PolarHBondContact O-N 2.8Å
959	L	83.3	Confident	80.7	Confident	112 Å²	112	93 Å²	93	59%	0.586	50%	0.495	S	S	*	.	H	α-helix	trans	-60.8	-41.4	173.7	-72.1	170	0	0	0	112	A955 S962 Q963	A955-L959 WeakPolarHBondContact O-CG 3.19Å; A955-L959 PolarHBondContact O-N 3.34Å; L959-S962 PolarHBondContact O-N 3.28Å; L959-Q963 WeakPolarHBondContact O-CG 3.23Å; L959-Q963 PolarHBondContact O-N 2.86Å
960	G	82.9	Confident	79.6	Confident	26 Å²	26	94.5 Å²	94.5	27%	0.268	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-41	174.9	0	0	0	0	0	113.2	R956 L957 L958 Q963 I964	R956-G960 PolarHBondContact O-N 3.33Å; L957-G960 PolarHBondContact O-N 3.04Å; L958-G960 VanDerWaalsContact C-N 3.34Å; L958-G960 PolarHBondContact O-N 2.81Å; G960-Q963 PolarHBondContact O-N 3.45Å; G960-I964 WeakPolarHBondContact O-CD1 3.47Å; G960-I964 VanDerWaalsContact O-CG1 3.29Å; G960-I964 WeakPolarHBondContact O-CG1 3.4Å; G960-I964 PolarHBondContact O-N 3.35Å
961	I	81.2	Confident	78	Confident	77 Å²	77	93.4 Å²	93.4	40%	0.395	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-45.4	174.9	-68.6	163.5	0	0	0	110.7	L957 L958 Q963 I964 Q965	L957-I961 HydrophobicContact CD2-CD1 4.1Å; L957-I961 HydrophobicContact CD2-CG1 4.46Å; L957-I961 WeakPolarHBondContact O-CG1 3.33Å; L957-I961 PolarHBondContact O-N 3.17Å; L958-I961 PolarHBondContact O-N 3.42Å; I961-Q963 PolarHBondContact O-N 2.79Å; I961-I964 PolarHBondContact O-N 3.45Å; I961-Q965 WeakPolarHBondContact O-CG 3.25Å; I961-Q965 PolarHBondContact O-N 3.43Å
962	S	72.3	Confident	76.4	Confident	66 Å²	66	96.9 Å²	96.9	46%	0.462	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-43.4	176.7	178.5	0	0	0	0	112.3	L958 L959 I964 Q965 N966	L958-S962 PolarHBondContact O-N 2.8Å; L959-S962 PolarHBondContact O-N 3.28Å; S962-I964 PolarHBondContact O-N 2.87Å; S962-Q965 PolarHBondContact O-N 3.34Å; S962-N966 WeakPolarHBondContact O-CB 3.49Å; S962-N966 PolarHBondContact O-N 3.08Å
963	Q	81.1	Confident	74.4	Confident	133 Å²	133	97.4 Å²	97.4	62%	0.621	51%	0.508	S	S	*	.	H	α-helix	trans	-61.3	-41.4	174.3	-73.6	177.2	-0.9	0	0	112.3	L959 G960 I961 Q965 N966 L967	L959-Q963 WeakPolarHBondContact O-CG 3.23Å; L959-Q963 PolarHBondContact O-N 2.86Å; G960-Q963 PolarHBondContact O-N 3.45Å; I961-Q963 PolarHBondContact O-N 2.79Å; Q963-Q965 VanDerWaalsContact C-N 3.35Å; Q963-Q965 PolarHBondContact O-N 3.17Å; Q963-N966 PolarHBondContact O-N 2.86Å; Q963-L967 WeakPolarHBondContact O-CB 3.48Å; Q963-L967 WeakPolarHBondContact O-CG 3.49Å; Q963-L967 PolarHBondContact O-N 3.17Å
964	I	74.3	Confident	72.6	Confident	89 Å²	89	98.6 Å²	98.6	46%	0.456	52%	0.517	S	S	.	.	H	α-helix	trans	-65.1	-37.4	176.2	-69.3	164.4	0	0	0	111.5	G960 I961 S962 R968	G960-I964 WeakPolarHBondContact O-CD1 3.47Å; G960-I964 VanDerWaalsContact O-CG1 3.29Å; G960-I964 WeakPolarHBondContact O-CG1 3.4Å; G960-I964 PolarHBondContact O-N 3.35Å; I961-I964 PolarHBondContact O-N 3.45Å; S962-I964 PolarHBondContact O-N 2.87Å; I964-R968 WeakPolarHBondContact O-CG 3.45Å; I964-R968 PolarHBondContact O-N 3.4Å; I964-R968 VanDerWaalsContact O-N 3.15Å
965	Q	78.3	Confident	70.4	Confident	115 Å²	115	102.6 Å²	102.6	54%	0.537	53%	0.532	S	S	.	.	H	α-helix	trans	-67	-44.6	174.6	-72.3	170.7	-28.9	0	0	111.7	I961 S962 Q963 L967 R968 Q969	I961-Q965 WeakPolarHBondContact O-CG 3.25Å; I961-Q965 PolarHBondContact O-N 3.43Å; S962-Q965 PolarHBondContact O-N 3.34Å; Q963-Q965 VanDerWaalsContact C-N 3.35Å; Q963-Q965 PolarHBondContact O-N 3.17Å; Q965-L967 VanDerWaalsContact C-N 3.33Å; Q965-L967 PolarHBondContact O-N 3.28Å; Q965-R968 PolarHBondContact O-N 3.31Å; Q965-Q969 PolarHBondContact O-N 3.35Å; Q965-Q969 VanDerWaalsContact O-N 3.09Å
966	N	74.4	Confident	68.4	Low	73 Å²	73	105.3 Å²	105.3	39%	0.39	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-38.8	177.5	-161.9	-85.9	0	0	0	112.1	S962 Q963 K970	S962-N966 WeakPolarHBondContact O-CB 3.49Å; S962-N966 PolarHBondContact O-N 3.08Å; Q963-N966 PolarHBondContact O-N 2.86Å; N966-K970 WeakPolarHBondContact O-CG 3.44Å; N966-K970 PolarHBondContact O-N 3.28Å; N966-K970 VanDerWaalsContact OD1-CE 3.23Å; N966-K970 WeakPolarHBondContact OD1-CE 3.5Å; N966-K970 PolarHBondContact OD1-NZ 3.14Å
967	L	71.3	Confident	66	Low	115 Å²	115	102.7 Å²	102.7	60%	0.602	55%	0.547	S	S	*	.	H	α-helix	trans	-66	-37.5	174.4	-73.8	172.4	0	0	0	112.7	Q963 Q965 K970 S971	Q963-L967 WeakPolarHBondContact O-CB 3.48Å; Q963-L967 WeakPolarHBondContact O-CG 3.49Å; Q963-L967 PolarHBondContact O-N 3.17Å; Q965-L967 VanDerWaalsContact C-N 3.33Å; Q965-L967 PolarHBondContact O-N 3.28Å; L967-K970 PolarHBondContact O-N 2.84Å; L967-S971 PolarHBondContact O-N 3.41Å; L967-S971 PolarHBondContact O-OG 2.9Å
968	R	68	Low	63.7	Low	166 Å²	166	102.3 Å²	102.3	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-63.2	-48.5	175.1	-75.4	171	179.2	-112.1	2.4	111.9	I964 Q965 K970 S971 E972	I964-R968 WeakPolarHBondContact O-CG 3.45Å; I964-R968 PolarHBondContact O-N 3.4Å; I964-R968 VanDerWaalsContact O-N 3.15Å; Q965-R968 PolarHBondContact O-N 3.31Å; R968-K970 VanDerWaalsContact C-N 3.29Å; R968-K970 PolarHBondContact O-N 3.25Å; R968-S971 WeakPolarHBondContact CA-OG 3.1Å; R968-S971 PolarHBondContact O-N 2.99Å; R968-S971 VanDerWaalsContact O-N 3.14Å; R968-S971 PolarHBondContact O-OG 3.17Å; R968-E972 WeakPolarHBondContact O-CG 3.3Å; R968-E972 PolarHBondContact O-N 2.87Å
969	Q	69	Low	61.3	Low	120 Å²	120	100.2 Å²	100.2	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-58.8	-41.2	175.3	-71.9	179.4	-25.1	0	0	111.5	Q965 S971 E972 C973	Q965-Q969 PolarHBondContact O-N 3.35Å; Q965-Q969 VanDerWaalsContact O-N 3.09Å; Q969-S971 PolarHBondContact O-N 2.96Å; Q969-E972 PolarHBondContact O-N 3.02Å; Q969-C973 PolarHBondContact O-N 3.27Å; Q969-C973 PolarHBondContact O-SG 3.4Å
970	K	68.5	Low	58.7	Low	125 Å²	125	100.2 Å²	100.2	54%	0.543	56%	0.558	S	S	.	*	H	α-helix	trans	-63.8	-37.7	175.5	-78.7	171.4	174.5	159.5	0	113.4	N966 L967 R968 C973 V974	N966-K970 WeakPolarHBondContact O-CG 3.44Å; N966-K970 PolarHBondContact O-N 3.28Å; N966-K970 VanDerWaalsContact OD1-CE 3.23Å; N966-K970 WeakPolarHBondContact OD1-CE 3.5Å; N966-K970 PolarHBondContact OD1-NZ 3.14Å; L967-K970 PolarHBondContact O-N 2.84Å; R968-K970 VanDerWaalsContact C-N 3.29Å; R968-K970 PolarHBondContact O-N 3.25Å; K970-C973 PolarHBondContact O-N 3.04Å; K970-V974 PolarHBondContact O-N 3.44Å
971	S	52.4	Low	56.2	Low	69 Å²	69	104 Å²	104	48%	0.483	58%	0.58	S	S	.	*	H	α-helix	trans	-65.4	-39.3	172.4	45.7	0	0	0	0	112.7	L967 R968 Q969 C973 V974	L967-S971 PolarHBondContact O-N 3.41Å; L967-S971 PolarHBondContact O-OG 2.9Å; R968-S971 WeakPolarHBondContact CA-OG 3.1Å; R968-S971 PolarHBondContact O-N 2.99Å; R968-S971 VanDerWaalsContact O-N 3.14Å; R968-S971 PolarHBondContact O-OG 3.17Å; Q969-S971 PolarHBondContact O-N 2.96Å; S971-C973 VanDerWaalsContact C-N 3.3Å; S971-C973 PolarHBondContact O-N 3.23Å; S971-V974 PolarHBondContact O-N 3Å
972	E	51.5	Low	53.7	Low	135 Å²	135	106.7 Å²	106.7	63%	0.631	60%	0.601	S	S	*	*	H	α-helix	trans	-65.1	-32.2	177.5	-70.4	168.6	174.1	0	0	112.4	R968 Q969	R968-E972 WeakPolarHBondContact O-CG 3.3Å; R968-E972 PolarHBondContact O-N 2.87Å; Q969-E972 PolarHBondContact O-N 3.02Å
973	C	46.3	Very low	51.8	Low	84 Å²	84	111 Å²	111	57%	0.568	62%	0.617	S	S	*	*	H	α-helix	trans	-67.1	-39.7	174	-66.6	0	0	0	0	113.6	Q969 K970 S971 D975 T976	Q969-C973 PolarHBondContact O-N 3.27Å; Q969-C973 PolarHBondContact O-SG 3.4Å; K970-C973 PolarHBondContact O-N 3.04Å; S971-C973 VanDerWaalsContact C-N 3.3Å; S971-C973 PolarHBondContact O-N 3.23Å; C973-D975 PolarHBondContact O-N 3Å; C973-T976 PolarHBondContact O-N 3.18Å; C973-T976 PolarHBondContact O-OG1 3.06Å
974	V	48.7	Very low	49.5	Very low	90 Å²	90	110.9 Å²	110.9	55%	0.545	62%	0.621	S	S	.	*	H	α-helix	trans	-63.3	-44.6	-173.5	172.3	0	0	0	0	112.2	K970 S971 T976 S977	K970-V974 PolarHBondContact O-N 3.44Å; S971-V974 PolarHBondContact O-N 3Å; V974-T976 PolarHBondContact O-N 3.15Å; V974-T976 VanDerWaalsContact O-N 3.08Å; V974-S977 PolarHBondContact O-N 3.07Å; V974-S977 PolarHBondContact O-OG 3.43Å
975	D	38.5	Very low	47.1	Very low	134 Å²	134	116.8 Å²	116.8	72%	0.717	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-17.8	-176.4	-77.4	-17.3	0	0	0	113.6	C973	C973-D975 PolarHBondContact O-N 3Å
976	T	41.3	Very low	45	Very low	105 Å²	105	120 Å²	120	64%	0.644	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-20.1	175.5	67.5	0	0	0	0	114.3	C973 V974	C973-T976 PolarHBondContact O-N 3.18Å; C973-T976 PolarHBondContact O-OG1 3.06Å; V974-T976 PolarHBondContact O-N 3.15Å; V974-T976 VanDerWaalsContact O-N 3.08Å
977	S	36.4	Very low	42.6	Very low	86 Å²	86	128.3 Å²	128.3	60%	0.601	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	-25.4	-171.9	66.2	0	0	0	0	114.5	V974	V974-S977 PolarHBondContact O-N 3.07Å; V974-S977 PolarHBondContact O-OG 3.43Å
978	V	35.4	Very low	40.7	Very low	108 Å²	108	128.6 Å²	128.6	66%	0.655	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-86.8	-12.2	-172.3	-174.8	0	0	0	0	112.6	S980	V978-S980 VanDerWaalsContact C-N 3.29Å; V978-S980 PolarHBondContact O-N 3.34Å
979	A	31.2	Very low	38.6	Very low	76 Å²	76	126.4 Å²	126.4	63%	0.628	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-76.3	-2.5	-170.8	0	0	0	0	0	116.1
980	S	29	Very low	37	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-121.4	34.4	-164	-63.6	0	0	0	0	115.6	V978	V978-S980 VanDerWaalsContact C-N 3.29Å; V978-S980 PolarHBondContact O-N 3.34Å
981	S	30.3	Very low	35	Very low	106 Å²	106	127 Å²	127	74%	0.741	72%	0.718	S	S	*	*			trans	-148.3	29.9	175.3	58.1	0	0	0	0	115.5	L983	S981-L983 PolarHBondContact O-N 3.13Å; S981-L983 VanDerWaalsContact O-N 3.08Å
982	T	30.1	Very low	33.7	Very low	133 Å²	133	130.9 Å²	130.9	82%	0.816	73%	0.733	S	S	*	*			trans	-77.1	89.6	177	55.4	0	0	0	0	112.8
983	L	32.4	Very low	32.9	Very low	156 Å²	156	130.8 Å²	130.8	82%	0.817	74%	0.742	S	S	*	*			trans	-138.3	145.8	166.5	-97.3	174.2	0	0	0	113.6	S981	S981-L983 PolarHBondContact O-N 3.13Å; S981-L983 VanDerWaalsContact O-N 3.08Å
984	D	31.2	Very low	32	Very low	131 Å²	131	134.3 Å²	134.3	70%	0.701	76%	0.755	S	S	*	*			trans	52.4	83.7	163.5	-67.2	-1.3	0	0	0	120	K986	D984-K986 PolarHBondContact O-N 3.04Å; D984-K986 VanDerWaalsContact O-N 3.08Å
985	F	25.4	Very low	31.2	Very low	213 Å²	213	137.4 Å²	137.4	93%	0.934	77%	0.769	S	S	*	*			trans	-53.8	106.9	149.8	-94.6	-104.5	0	0	0	111.3
986	K	33.6	Very low	30.6	Very low	183 Å²	183	135.9 Å²	135.9	80%	0.796	78%	0.775	S	S	*	*			trans	-110.8	115.5	157	-86.3	-179.7	178	168.6	0	110.8	D984 T988	D984-K986 PolarHBondContact O-N 3.04Å; D984-K986 VanDerWaalsContact O-N 3.08Å; K986-T988 PolarHBondContact O-N 3.41Å
987	R	24.3	Very low	30.3	Very low	247 Å²	247	136.5 Å²	136.5	93%	0.932	78%	0.779	S	S	*	*			trans	-93.6	72.6	-166.8	-165.5	-175.5	-161.3	167.3	4.8	111.2
988	T	32.1	Very low	29.9	Very low	122 Å²	122	138 Å²	138	75%	0.748	79%	0.789	S	S	*	*			trans	-95.2	102.5	176.7	47.5	0	0	0	0	111.5	K986 I990	K986-T988 PolarHBondContact O-N 3.41Å; T988-I990 PolarHBondContact O-N 3.42Å
989	S	24.1	Very low	29.8	Very low	120 Å²	120	141.3 Å²	141.3	84%	0.839	80%	0.798	S	S	*	*			trans	-80.1	110	172.8	52.7	0	0	0	0	111.2
990	I	33.7	Very low	29.6	Very low	159 Å²	159	142.7 Å²	142.7	82%	0.815	80%	0.802	S	S	*	*			trans	-127.6	147.4	167.7	-62.4	-177.6	0	0	0	108.3	T988	T988-I990 PolarHBondContact O-N 3.42Å
991	S	27.7	Very low	29.8	Very low	97 Å²	97	144 Å²	144	68%	0.678	80%	0.799	S	S	*	*			trans	-84.1	149.9	-164.7	52.7	0	0	0	0	115.4
992	N	24.2	Very low	29.9	Very low	152 Å²	152	146 Å²	146	81%	0.813	80%	0.8	S	S	*	*			trans	7.4	117.5	150.8	-53.3	5.5	0	0	0	118
993	T	34.8	Very low	29.9	Very low	133 Å²	133	147.2 Å²	147.2	82%	0.816	80%	0.801	S	S	*	*			trans	-137.9	131.5	133.1	43	0	0	0	0	109.2
994	D	27.3	Very low	29.9	Very low	157 Å²	157	148.1 Å²	148.1	84%	0.84	80%	0.801	S	S	*	*			trans	-71.3	136.3	169.6	-57.6	-85.8	0	0	0	110.1
995	N	32.5	Very low	30	Very low	155 Å²	155	150.6 Å²	150.6	83%	0.829	81%	0.808	S	S	*	*			trans	-153.9	120	156.8	-103.4	-41	0	0	0	109.8
996	A	26.6	Very low	30.4	Very low	103 Å²	103	146.5 Å²	146.5	85%	0.851	80%	0.8	S	S	*	*			trans	-102.8	103.2	-176	0	0	0	0	0	110.8
997	T	35.2	Very low	30.5	Very low	117 Å²	117	142 Å²	142	72%	0.718	79%	0.79	S	S	*	*			trans	-130.4	81.4	172.9	52.4	0	0	0	0	111.4	E999	T997-E999 PolarHBondContact O-N 2.94Å
998	S	27.8	Very low	31.2	Very low	117 Å²	117	134.3 Å²	134.3	82%	0.818	78%	0.779	S	S	*	*			trans	25.9	89.8	140.2	58.6	0	0	0	0	118.7
999	E	32.4	Very low	31.6	Very low	179 Å²	179	134.6 Å²	134.6	84%	0.836	78%	0.781	S	S	*	*			trans	-104.5	93.8	153	-71.7	-164.5	151.2	0	0	109.6	T997 I1001	T997-E999 PolarHBondContact O-N 2.94Å; E999-I1001 PolarHBondContact O-N 3.45Å; E999-I1001 VanDerWaalsContact O-N 3.09Å
1000	S	27.7	Very low	31.8	Very low	104 Å²	104	136 Å²	136	73%	0.727	78%	0.778	S	S	*	*			trans	-82.2	78.6	178.1	57.7	0	0	0	0	111	I1002	S1000-I1002 PolarHBondContact O-N 3.38Å; S1000-I1002 VanDerWaalsContact O-N 3.1Å
1001	I	32.7	Very low	31.9	Very low	139 Å²	139	137.4 Å²	137.4	71%	0.713	79%	0.785	S	S	*	*			trans	-66.8	109.8	171.1	-60.9	179.8	0	0	0	108.4	E999 L1003	E999-I1001 PolarHBondContact O-N 3.45Å; E999-I1001 VanDerWaalsContact O-N 3.09Å; I1001-L1003 PolarHBondContact O-N 2.69Å
1002	I	32.3	Very low	32.1	Very low	148 Å²	148	139.5 Å²	139.5	76%	0.759	79%	0.791	S	S	*	*			trans	-71.9	100.5	-177.5	-60.1	174.3	0	0	0	108.8	S1000 Q1004	S1000-I1002 PolarHBondContact O-N 3.38Å; S1000-I1002 VanDerWaalsContact O-N 3.1Å; I1002-Q1004 VanDerWaalsContact C-N 3.27Å; I1002-Q1004 PolarHBondContact O-N 2.82Å
1003	L	29.5	Very low	32.5	Very low	160 Å²	160	138.8 Å²	138.8	84%	0.838	79%	0.79	S	S	*	*			trans	-69.9	88.2	165.4	-72.1	173.6	0	0	0	108.6	I1001 E1005	I1001-L1003 PolarHBondContact O-N 2.69Å; L1003-E1005 PolarHBondContact O-N 2.65Å
1004	Q	33.5	Very low	32.4	Very low	175 Å²	175	139.1 Å²	139.1	82%	0.818	79%	0.788	S	S	*	*			trans	-62.2	117.1	-179.6	-167	171	5.8	0	0	109.9	I1002 V1006	I1002-Q1004 VanDerWaalsContact C-N 3.27Å; I1002-Q1004 PolarHBondContact O-N 2.82Å; Q1004-V1006 PolarHBondContact O-N 3.12Å
1005	E	32.7	Very low	32.7	Very low	182 Å²	182	138.1 Å²	138.1	85%	0.85	79%	0.785	S	S	*	*			trans	-65.9	115.7	-171.1	-62.3	-174.5	130	0	0	111.5	L1003 P1007	L1003-E1005 PolarHBondContact O-N 2.65Å; E1005-P1007 WeakPolarHBondContact O-CD 3.42Å
1006	V	33.5	Very low	32.7	Very low	127 Å²	127	137 Å²	137	77%	0.77	78%	0.782	S	S	*	*			trans	-68.1	122.4	169.3	179.3	0	0	0	0	108.1	Q1004 A1008	Q1004-V1006 PolarHBondContact O-N 3.12Å; V1006-A1008 PolarHBondContact O-N 2.68Å
1007	P	35.7	Very low	33.1	Very low	89 Å²	89	139.3 Å²	139.3	58%	0.578	78%	0.778	S	S	*	*			trans	-58.6	132.9	-174.9	-27	35.4	0	0	0	112.7	E1005 T1009	E1005-P1007 WeakPolarHBondContact O-CD 3.42Å; P1007-T1009 PolarHBondContact O-N 3.46Å
1008	A	39.4	Very low	33	Very low	85 Å²	85	140.9 Å²	140.9	70%	0.702	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-68	9.7	-175.6	0	0	0	0	0	115.2	V1006 L1010	V1006-A1008 PolarHBondContact O-N 2.68Å; A1008-L1010 VanDerWaalsContact C-N 3.28Å; A1008-L1010 PolarHBondContact O-N 3.34Å
1009	T	39.9	Very low	33.4	Very low	129 Å²	129	142.7 Å²	142.7	79%	0.791	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-80.9	0.6	179.2	49.6	0	0	0	0	114.1	P1007	P1007-T1009 PolarHBondContact O-N 3.46Å
1010	L	29.6	Very low	33.5	Very low	150 Å²	150	139.7 Å²	139.7	79%	0.785	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-101.6	17.2	-178.9	-143.7	85.7	0	0	0	114.4	A1008	A1008-L1010 VanDerWaalsContact C-N 3.28Å; A1008-L1010 PolarHBondContact O-N 3.34Å
1011	I	35.4	Very low	34	Very low	188 Å²	188	142.9 Å²	142.9	96%	0.964	78%	0.779	S	S	*	*			trans	-125.1	0	-174.4	-53.3	178.8	0	0	0	111	K520	K520-I1011 PolarHBondContact NZ-O 3.44Å; K520-I1011 VanDerWaalsContact NZ-O 3.12Å

Retrieved 1,011 of 1,011 residues in 1361.1 ms (Link to these results)

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