A0A077Z3H7_TRITR Loading...

ATP binding cassette sub family A

AlphaFold DB , UniProt , Accession A0A077Z3H7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,972 aa.

						>A0A077Z3H7_TRITR|A0A077Z3H7
MKKVAQAKTAKPKVNTGNLFKSLSLPILRHRGAATSPVRKENPKVEKPVKPYAVQKVDFPRLAQLSAILKAERRFDFKPSWVLCFFGPIILCYLILHAELAERLQISFCYHPPIGMPSSGWLSVLQSHFCSYRRVCVFDRLSDCELGPIDSRVPLNVLLSDLPQLLNSYTVNGIISFSSDLWDVLNTQRFPYNGKAPKVKLIDYFAPGCDDDAKEDMAFEAFYGGHDIYLGSYHWISNDDMKRCLREAVISQEYLFSFAKEISKQILPSSLNYEQVLDLIDPSNVITRRVTQRLLEHSFYATNYFATTFVPGLHCNTVPSIFRGAVHRMHVYYLGQRSRWTDRLFRERILIDAFGDVTGFNLSLVDILKWMQLINRLHEAVHETPLIVSALSVWNILSGCRQLVESHSPTTDYLMSLSTVLCNATFNNTQCFAWIKSFNFSEGETIALYTLLRGYVLLSPPTATANEKLKQLSDLNNFFAILNATARNITSSFTAANVSENTRTFTELLFVMLRKFGLPKGEDEKMFELFALTTCALRSDWWSDMGSRIINTVLPIKQLLGCIRTEGRIQVVTSEELQTTVGCLISEYNLLSTVEFKKDNNETEVLPSLWEYTINMVDYLLDSNSSLDEDADSYHFSGYNYPYAIVRDVIDEAIMELHGRRGKRIGRFVQPFPRKAIVRYPPFYPLMHLPFVFTLFFFAHSMHMLLVAARERQQGFSSYMKVSGLKWVTFLTSFLIRALVIYFLSGVILFYVLLDVAVINEGTVLWSIVLYASCSVAAATQCYLLYTTFPTLCSVMAAGSLVYIIGYVTFEVILYFFSNIGYIVQMILSIFLPQLAWNFGCVSVTAYARLEEELSWKKLNVSFFENKNYTIGWSLVALQCNSLFNIMVALLIDLGVLSHLIHCAKLTLKKLRRRRNEVRSDVGLHFTKTLPHEIPLAPVGLSVSSLSHSFRKNGNIPAVILTNVTVDFYEGQITVIYGEEHSGKSTLMRLLGGLLTPHGGSILVPGKKDKLVVPTFNDIAYCPEKFCLFENLTVREHLDFYQRLRGCRNRSMACRSIIMETGLMAFSSVRAGCLSIQMKRILQIAVAIVCDARVWLLDQPTKGLKPINRRILWNFLIRHRNGRTIIVTSSSYLEAETISDRIAILSRKTLLCCGSFTFLRNQTNLGFKMKLRKMPMDDKDIVSTNAENHWTRHILSRLMPEAEITKYGQEKIHVAIPLVDFKILRKLIAKIERMLGEFACDSYVLSSATLEQVVEKVSNMSIAPDQLITRTNSQSEQIGANPEFVPKRTDAFTTSWKGDRLCENALARFLNYSFLLGLSKMFENNNKILYNSKDCIVTPFCQIEAIVKRRYLKLVRDKWALFFMVLFPAILLSMVTKAISIANSTGNMMDDDVEMTPFSSVGDSLAIFFNFTHPDIKTEAVHWKKYLLQMFRNRRVLKGLDENFTILTTLPEGNCTDQPLDYIPTFENLYNPKILVHENDFLYDARKLGIASWTGGFSGAASENSPAAVNYSKLADHALKIYTNVQRLLATESDTKSRGNEIMQLVRNFSLLTPTLSVASNVKIWYPGSSCSSLSKSMSIMNNAMLYTPSSNQSTNVVEIRSHLGSLKTFQLHRMYRLVELEKYTEGISLRYAAVFAVVVSISSLAGPVASWAVKEKSAGIKYIMICQGATFGVFVKDTCPDVVPWKPLAQFISSFIPQFYLFDALVALNGPCKGDLFADLFDDRCFLEFGGLKRSLWAIFALVMMGATAFVVLIAVENQQLRKECNAYYVALLSLQPKKKRAYEIHALSDLSSLFSNFATFKEAIKEAAIKQTVNLIRSIRPGECIGIFGANGVGKSSVLRIAMARSRASYFGKMSFKELFKNAFTPMGNGFCYCPQWDALDESLTVRETLVFYAALYGVSKTSRLSVVSYYLHRFDMSNIADTKNSSLSMDMRRRLSIASALMGPCSILVLDEPTSRRKINHNDVTKVAN
					

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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	27.7	Very low	28.2	Very low	191 Å²	191	154.5 Å²	154.5	94%	0.941	83%	0.825	S	S	*	*				0	119.4	0	-32.2	-162.8	173.4	0	0	107.8	K3 V4	M1-K3 VanDerWaalsContact CA-O 3.23Å; M1-K3 WeakPolarHBondContact CA-O 3.4Å; M1-K3 PolarHBondContact N-O 2.89Å; M1-V4 HydrophobicContact CB-CB 3.93Å; M1-V4 HydrophobicContact CE-CG1 4.36Å; M1-V4 HydrophobicContact CG-CB 3.68Å; M1-V4 HydrophobicContact CG-CG1 4.06Å; M1-V4 HydrophobicContact CG-CG2 3.89Å; M1-V4 HydrophobicContact SD-CG1 4.24Å
2	K	25	Very low	28.4	Very low	210 Å²	210	146.3 Å²	146.3	91%	0.913	79%	0.787	S	S	*	*			cis	-91.1	6.5	15.4	-100.8	-171.6	173	-168.7	0	117.9	V4	K2-V4 PolarHBondContact O-N 2.95Å
3	K	29	Very low	28.3	Very low	209 Å²	209	147.4 Å²	147.4	91%	0.909	78%	0.78	S	S	*	*	S	Bend	trans	-73.3	82.9	135.9	-86.2	-168.8	176.2	-177.3	0	106.9	M1	M1-K3 VanDerWaalsContact CA-O 3.23Å; M1-K3 WeakPolarHBondContact CA-O 3.4Å; M1-K3 PolarHBondContact N-O 2.89Å
4	V	29.4	Very low	28.2	Very low	86 Å²	86	144.5 Å²	144.5	52%	0.521	77%	0.771	S	S	.	*	S	Bend	trans	167.4	132.4	166.1	160.8	0	0	0	0	103.1	M1 K2	M1-V4 HydrophobicContact CB-CB 3.93Å; M1-V4 HydrophobicContact CE-CG1 4.36Å; M1-V4 HydrophobicContact CG-CB 3.68Å; M1-V4 HydrophobicContact CG-CG1 4.06Å; M1-V4 HydrophobicContact CG-CG2 3.89Å; M1-V4 HydrophobicContact SD-CG1 4.24Å; K2-V4 PolarHBondContact O-N 2.95Å
5	A	29.8	Very low	28.1	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	77%	0.765	S	S	*	*	S	Bend	trans	80.1	56.1	-174.9	0	0	0	0	0	116.7
6	Q	28.6	Very low	28.1	Very low	204 Å²	204	142.5 Å²	142.5	95%	0.953	77%	0.766	S	S	*	*			trans	-150.6	82	133	-115.6	170	-7.4	0	0	109.2
7	A	27.3	Very low	28.2	Very low	98 Å²	98	138.1 Å²	138.1	81%	0.81	76%	0.763	S	S	*	*			trans	-140	109.2	168.1	0	0	0	0	0	106.7
8	K	30.2	Very low	28.2	Very low	199 Å²	199	138.2 Å²	138.2	87%	0.865	76%	0.762	S	S	*	*			trans	-166.6	148.4	171.7	-111	-178.2	-179	-172.4	0	108.3
9	T	28.4	Very low	28.3	Very low	146 Å²	146	139.9 Å²	139.9	90%	0.896	77%	0.769	S	S	*	*			trans	73.7	120.7	-164.4	74.7	0	0	0	0	112.2
10	A	29.6	Very low	28.2	Very low	92 Å²	92	139.6 Å²	139.6	76%	0.76	76%	0.759	S	S	*	*			cis	-138.8	170	1.1	0	0	0	0	0	114
11	K	25.6	Very low	28.2	Very low	172 Å²	172	140.3 Å²	140.3	75%	0.748	76%	0.756	S	S	*	*			trans	-89.5	-168.2	-177.9	-101.7	-173.7	178.3	-174.9	0	110.7	P191 Y192	K11-P191 CarbonylContact C-O 3.49Å; K11-P191 CarbonylContact O-C 3.59Å; K11-Y192 PolarHBondContact O-N 2.78Å
12	P	30.8	Very low	28.4	Very low	56 Å²	56	136.4 Å²	136.4	36%	0.364	75%	0.747	S	S	.	*			cis	-137	171.8	-43.9	36.5	-20.2	0	0	0	115.1	P191 Y192	P12-P191 CarbonylContact C-O 3.52Å; P12-P191 VanDerWaalsContact CA-O 3.3Å; P12-P191 WeakPolarHBondContact CA-O 3.12Å; P12-P191 CarbonylContact O-C 3.56Å; P12-P191 WeakPolarHBondContact O-CB 3.23Å; P12-P191 WeakPolarHBondContact O-CD 3.35Å; P12-Y192 WeakPolarHBondContact CD-O 3.49Å; P12-Y192 PolarHBondContact O-N 3.08Å
13	K	25.9	Very low	28.5	Very low	161 Å²	161	132.8 Å²	132.8	70%	0.7	74%	0.737	S	S	*	*			trans	123	144	156.4	-67.4	177.4	173.9	-174.2	0	118	P191	K13-P191 VanDerWaalsContact C-CD 3.4Å; K13-P191 HydrophobicContact CB-CB 4.29Å; K13-P191 HydrophobicContact CB-CG 3.74Å; K13-P191 WeakPolarHBondContact O-CD 3.38Å; K13-P191 WeakPolarHBondContact O-CG 3.3Å
14	V	27.2	Very low	28.4	Very low	107 Å²	107	127 Å²	127	65%	0.648	72%	0.723	S	S	*	*				58.8	122.6	105.3	-177.1	0	0	0	0	113.7
15	N	27.2	Very low	28.3	Very low	129 Å²	129	130.8 Å²	130.8	69%	0.69	74%	0.739	S	S	*	*			cis	-161	167	10.3	-126.8	5.3	0	0	0	114
16	T	28.4	Very low	28.3	Very low	128 Å²	128	131.2 Å²	131.2	79%	0.785	73%	0.734	S	S	*	*			trans	46	133.2	147.9	56.5	0	0	0	0	120.7
17	G	30	Very low	28.1	Very low	68 Å²	68	128.3 Å²	128.3	70%	0.701	72%	0.724	S	S	*	*			cis	162.1	152.5	-0.7	0	0	0	0	0	112.7
18	N	28.2	Very low	28	Very low	139 Å²	139	130.4 Å²	130.4	74%	0.743	72%	0.721	S	S	*	*			trans	30.5	114.2	152.2	-56.4	-13.5	0	0	0	119.6
19	L	29	Very low	27.7	Very low	172 Å²	172	130.8 Å²	130.8	90%	0.901	72%	0.716	S	S	*	*				-157.6	134.9	127.6	-124.6	87.8	0	0	0	108.2
20	F	27.4	Very low	27.5	Very low	132 Å²	132	131 Å²	131	58%	0.579	71%	0.707	S	S	*	*			cis	-172.5	152.5	-34.1	-132.1	-62.7	0	0	0	107.8
21	K	27.1	Very low	27.3	Very low	156 Å²	156	138.3 Å²	138.3	68%	0.678	72%	0.715	S	S	*	*			trans	61	144	160	-74.6	131.7	-177.4	172.3	0	116.2	L23	K21-L23 HydrophobicContact CB-CD1 4.44Å; K21-L23 HydrophobicContact CG-CD1 3.66Å
22	S	33.3	Very low	27.2	Very low	108 Å²	108	133 Å²	133	76%	0.755	71%	0.709	S	S	*	*			cis	-131.7	129.6	8.6	35.8	0	0	0	0	109.4
23	L	26	Very low	27	Very low	134 Å²	134	135.3 Å²	135.3	70%	0.702	73%	0.733	S	S	*	*				63.5	133.6	65.5	-66.1	165.3	0	0	0	112.5	K21	K21-L23 HydrophobicContact CB-CD1 4.44Å; K21-L23 HydrophobicContact CG-CD1 3.66Å
24	S	26.1	Very low	27	Very low	88 Å²	88	132 Å²	132	62%	0.615	74%	0.736	S	S	*	*			cis	-178	155.4	-10.5	40.6	0	0	0	0	109.4	P26	S24-P26 WeakPolarHBondContact O-CD 3.45Å
25	L	29	Very low	27	Very low	166 Å²	166	133.1 Å²	133.1	87%	0.869	74%	0.743	S	S	*	*			trans	-65.2	139.2	152.8	-86.5	151.2	0	0	0	110.4
26	P	28.3	Very low	27	Very low	101 Å²	101	131.9 Å²	131.9	66%	0.656	74%	0.744	S	S	*	*			trans	-109.4	122.1	143.3	2.8	18.5	0	0	0	108.5	S24	S24-P26 WeakPolarHBondContact O-CD 3.45Å
27	I	25.5	Very low	27.1	Very low	143 Å²	143	131.1 Å²	131.1	73%	0.733	74%	0.741	S	S	*	*				79	113	80.5	-69.4	164.4	0	0	0	112.8
28	L	25	Very low	27	Very low	142 Å²	142	133.2 Å²	133.2	74%	0.743	74%	0.74	S	S	*	*			trans	40.9	128.1	146.1	-65.2	169.7	0	0	0	122
29	R	23.4	Very low	26.9	Very low	206 Å²	206	136.2 Å²	136.2	78%	0.777	74%	0.741	S	S	*	*			trans	82.8	140.3	133.3	-78.5	177.7	178	178.8	-0.9	121
30	H	24.7	Very low	26.8	Very low	152 Å²	152	136.3 Å²	136.3	70%	0.704	73%	0.734	S	S	*	*			trans	78	128	148.6	-78.9	-57.2	0	0	0	121.4
31	R	24.3	Very low	26.8	Very low	245 Å²	245	138.1 Å²	138.1	93%	0.925	75%	0.745	S	S	*	*			trans	65.7	150	157.6	-59.4	166.3	179.9	-178.2	-1.3	113.8
32	G	25.1	Very low	26.8	Very low	61 Å²	61	138.1 Å²	138.1	63%	0.629	75%	0.752	S	S	*	*			cis	-160.6	143.7	-8.1	0	0	0	0	0	105.5
33	A	25.1	Very low	26.7	Very low	103 Å²	103	138 Å²	138	85%	0.851	75%	0.748	S	S	*	*				65	131.6	90.8	0	0	0	0	0	113.6
34	A	26.7	Very low	26.8	Very low	92 Å²	92	140.7 Å²	140.7	76%	0.76	76%	0.755	S	S	*	*			trans	66.3	143	176.8	0	0	0	0	0	114.9
35	T	26.9	Very low	27	Very low	131 Å²	131	143.3 Å²	143.3	80%	0.804	77%	0.767	S	S	*	*			cis	-169.1	149.9	-3.4	15.9	0	0	0	0	103.9
36	S	27.2	Very low	26.7	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	76%	0.759	S	S	*	*			cis	-173.6	-156.8	10.3	55.9	0	0	0	0	105
37	P	31.1	Very low	26.7	Very low	111 Å²	111	144 Å²	144	72%	0.721	76%	0.755	S	S	*	*				-113	-176.2	-128.5	24.1	3.1	0	0	0	111
38	V	27.9	Very low	26.7	Very low	112 Å²	112	142.7 Å²	142.7	68%	0.679	76%	0.755	S	S	*	*				-172.7	121.8	65.7	158.7	0	0	0	0	108.6
39	R	25.7	Very low	27	Very low	203 Å²	203	141.5 Å²	141.5	77%	0.766	75%	0.754	S	S	*	*			trans	53.1	129.3	135.1	-59.3	-179.3	172.3	176.6	-3.2	119.6
40	K	26.6	Very low	27	Very low	173 Å²	173	140.4 Å²	140.4	75%	0.752	75%	0.754	S	S	*	*				57.5	135	93.7	-44.8	175.3	177.6	-171.7	0	111.6
41	E	28.4	Very low	27	Very low	171 Å²	171	138.8 Å²	138.8	80%	0.799	76%	0.757	S	S	*	*			cis	-141.6	139.5	26.4	-64.1	167.1	158.9	0	0	108.7
42	N	26.3	Very low	27.2	Very low	155 Å²	155	137.7 Å²	137.7	83%	0.829	76%	0.755	S	S	*	*				32.6	142.8	87.1	-81.8	-9.9	0	0	0	116.3
43	P	31.6	Very low	27.2	Very low	105 Å²	105	138.9 Å²	138.9	68%	0.682	76%	0.759	S	S	*	*			cis	-139.7	-177.9	-19.6	35.8	-14.9	0	0	0	115.2
44	K	27.7	Very low	27.2	Very low	192 Å²	192	140 Å²	140	84%	0.835	76%	0.755	S	S	*	*			trans	102	103	157.9	-61.6	177.1	-178.5	176.3	0	120
45	V	29.7	Very low	27.1	Very low	143 Å²	143	143.3 Å²	143.3	87%	0.867	76%	0.755	S	S	*	*			trans	75.8	77.9	148.4	-161.5	0	0	0	0	119.8
46	E	23.9	Very low	26.9	Very low	150 Å²	150	145.9 Å²	145.9	70%	0.701	76%	0.755	S	S	*	*			trans	-150.7	141.1	152.2	-90.3	-148.6	130.6	0	0	113.7
47	K	26.9	Very low	27	Very low	132 Å²	132	147.7 Å²	147.7	57%	0.574	76%	0.761	S	S	*	*			trans	69.6	159.4	151.2	-68.5	165	-172.8	149.2	0	117.1	V49	K47-V49 HydrophobicContact CD-CB 4.33Å; K47-V49 HydrophobicContact CG-CB 4.19Å
48	P	26.5	Very low	26.7	Very low	115 Å²	115	149 Å²	149	75%	0.747	76%	0.762	S	S	*	*			cis	-91.4	117.7	37.7	34.5	-35	0	0	0	113.4	K50	P48-K50 HydrophobicContact CB-CB 3.81Å; P48-K50 HydrophobicContact CB-CG 4.4Å
49	V	30.4	Very low	26.7	Very low	117 Å²	117	153.5 Å²	153.5	71%	0.709	77%	0.773	S	S	*	*				-57.7	115.8	73.8	-172.3	0	0	0	0	115.2	K47	K47-V49 HydrophobicContact CD-CB 4.33Å; K47-V49 HydrophobicContact CG-CB 4.19Å
50	K	25	Very low	26.8	Very low	182 Å²	182	148.3 Å²	148.3	79%	0.791	77%	0.766	S	S	*	*			trans	-149.4	152	170.9	-102.2	-171.5	-180	-177.7	0	109.3	P48	P48-K50 HydrophobicContact CB-CB 3.81Å; P48-K50 HydrophobicContact CB-CG 4.4Å
51	P	24.2	Very low	26.8	Very low	118 Å²	118	147.9 Å²	147.9	77%	0.766	76%	0.759	S	S	*	*				-134.2	-175.5	-97.6	39	-22.9	0	0	0	115.7
52	Y	27.2	Very low	26.8	Very low	222 Å²	222	146.8 Å²	146.8	87%	0.871	76%	0.758	S	S	*	*			trans	-71.7	165.9	176	-95.9	-106.2	0	0	0	115.4
53	A	25.9	Very low	27	Very low	87 Å²	87	143.7 Å²	143.7	72%	0.719	75%	0.754	S	S	*	*			trans	76.8	136.3	142.3	0	0	0	0	0	121.1
54	V	25.6	Very low	26.9	Very low	127 Å²	127	146.2 Å²	146.2	77%	0.77	76%	0.757	S	S	*	*				172.6	91.9	122.1	159.2	0	0	0	0	104.5
55	Q	25.1	Very low	27	Very low	160 Å²	160	142.5 Å²	142.5	75%	0.748	75%	0.745	S	S	*	*				94.3	129.8	88.9	-85.6	-173.7	-6.8	0	0	113.8
56	K	23	Very low	26.9	Very low	185 Å²	185	140 Å²	140	80%	0.804	74%	0.735	S	S	*	*			trans	48	117.6	152.6	-62	-179.4	175.2	-176.5	0	119
57	V	27.9	Very low	27.2	Very low	142 Å²	142	136.2 Å²	136.2	86%	0.861	73%	0.729	S	S	*	*				-159.6	133.9	97.8	157.4	0	0	0	0	107.1
58	D	25.2	Very low	27.4	Very low	138 Å²	138	134.2 Å²	134.2	74%	0.738	72%	0.723	S	S	*	*			trans	-76.6	140.2	172.4	-61.1	-74	0	0	0	110.8
59	F	28.3	Very low	27.6	Very low	206 Å²	206	133.9 Å²	133.9	90%	0.904	72%	0.715	S	S	*	*			trans	179.7	149.6	134.4	-99.5	-77.4	0	0	0	108.4
60	P	28.4	Very low	27.6	Very low	95 Å²	95	137.8 Å²	137.8	62%	0.617	72%	0.722	S	S	*	*			trans	-111	174.6	-148.6	43.2	-38.1	0	0	0	115.1
61	R	25.1	Very low	27.7	Very low	163 Å²	163	131.5 Å²	131.5	62%	0.615	70%	0.704	S	S	*	*	S	Bend	trans	62.2	101.3	163.9	-56.6	164.8	-175.2	177.5	0.3	116.3
62	L	28.2	Very low	27.9	Very low	149 Å²	149	131.2 Å²	131.2	78%	0.78	69%	0.693	S	S	*	*	S	Bend	trans	174.3	-28.6	135.7	-96.8	153.4	0	0	0	113.6	Q64	L62-Q64 PolarHBondContact O-N 3.44Å
63	A	31.3	Very low	28	Very low	90 Å²	90	132.5 Å²	132.5	74%	0.744	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-5.8	-169.8	0	0	0	0	0	117.1
64	Q	30.5	Very low	28.1	Very low	157 Å²	157	139.5 Å²	139.5	73%	0.734	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-15.7	-179.5	-81.6	-178.2	-18.9	0	0	114.4	L62 I68	L62-Q64 PolarHBondContact O-N 3.44Å; Q64-I68 HydrophobicContact CB-CD1 4.38Å; Q64-I68 WeakPolarHBondContact O-CD1 3.46Å; Q64-I68 VanDerWaalsContact O-CG1 3.29Å; Q64-I68 WeakPolarHBondContact O-CG1 3.28Å; Q64-I68 PolarHBondContact O-N 3.02Å
65	L	28.3	Very low	28.1	Very low	114 Å²	114	140.7 Å²	140.7	60%	0.597	70%	0.699	S	S	*	*	H	α-helix	trans	-69.5	-39.9	-175.3	-86.8	152.4	0	0	0	113.7	A67 I68 L69	L65-A67 PolarHBondContact O-N 2.74Å; L65-I68 PolarHBondContact O-N 3.03Å; L65-L69 WeakPolarHBondContact O-CB 3.44Å; L65-L69 WeakPolarHBondContact O-CD1 3.29Å; L65-L69 VanDerWaalsContact O-CG 3.25Å; L65-L69 WeakPolarHBondContact O-CG 3.5Å; L65-L69 PolarHBondContact O-N 3.27Å
66	S	28.9	Very low	28.2	Very low	92 Å²	92	140.6 Å²	140.6	64%	0.643	70%	0.703	S	S	*	*	H	α-helix	trans	-74.9	-20.8	-174.3	65	0	0	0	0	114.7
67	A	30.3	Very low	28.4	Very low	70 Å²	70	140 Å²	140	58%	0.579	70%	0.702	S	S	*	*	H	α-helix	trans	-86.9	-32.5	173.3	0	0	0	0	0	112.4	L65 K70	L65-A67 PolarHBondContact O-N 2.74Å; A67-K70 PolarHBondContact O-N 2.97Å
68	I	31	Very low	28.5	Very low	89 Å²	89	139.1 Å²	139.1	46%	0.456	69%	0.686	S	S	.	*	H	α-helix	trans	-68.3	-42.5	173.9	-68.7	171.5	0	0	0	110.3	Q64 L65 K70 A71 E72	Q64-I68 HydrophobicContact CB-CD1 4.38Å; Q64-I68 WeakPolarHBondContact O-CD1 3.46Å; Q64-I68 VanDerWaalsContact O-CG1 3.29Å; Q64-I68 WeakPolarHBondContact O-CG1 3.28Å; Q64-I68 PolarHBondContact O-N 3.02Å; L65-I68 PolarHBondContact O-N 3.03Å; I68-K70 PolarHBondContact O-N 3.36Å; I68-A71 WeakPolarHBondContact O-CA 3.41Å; I68-A71 PolarHBondContact O-N 2.87Å; I68-E72 HydrophobicContact CG2-CG 4.46Å; I68-E72 PolarHBondContact O-N 2.61Å
69	L	30.1	Very low	28.7	Very low	109 Å²	109	136.3 Å²	136.3	57%	0.571	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-11.5	176.1	-74.4	166	0	0	0	115.3	L65	L65-L69 WeakPolarHBondContact O-CB 3.44Å; L65-L69 WeakPolarHBondContact O-CD1 3.29Å; L65-L69 VanDerWaalsContact O-CG 3.25Å; L65-L69 WeakPolarHBondContact O-CG 3.5Å; L65-L69 PolarHBondContact O-N 3.27Å
70	K	29.4	Very low	29	Very low	198 Å²	198	129 Å²	129	86%	0.861	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	-6.6	170.1	-89.8	175.8	178.6	166.5	0	114.2	A67 I68	A67-K70 PolarHBondContact O-N 2.97Å; I68-K70 PolarHBondContact O-N 3.36Å
71	A	28.5	Very low	29.2	Very low	50 Å²	50	132.5 Å²	132.5	41%	0.413	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.5	-18.3	175.6	0	0	0	0	0	113.6	I68 R73 R74	I68-A71 WeakPolarHBondContact O-CA 3.41Å; I68-A71 PolarHBondContact O-N 2.87Å; A71-R73 PolarHBondContact O-N 3.26Å; A71-R74 PolarHBondContact O-N 3.05Å; A71-R74 VanDerWaalsContact O-N 3.17Å
72	E	28.4	Very low	29.6	Very low	113 Å²	113	129.5 Å²	129.5	53%	0.528	65%	0.65	S	S	.	*	G	3₁₀ helix	trans	-59	-16.7	-175.9	-80.6	173.1	171.5	0	0	115.9	I68 R74	I68-E72 HydrophobicContact CG2-CG 4.46Å; I68-E72 PolarHBondContact O-N 2.61Å; E72-R74 PolarHBondContact O-N 3.38Å; E72-R74 VanDerWaalsContact O-N 3.17Å
73	R	27.8	Very low	30	Very low	249 Å²	249	126.9 Å²	126.9	94%	0.94	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-76.6	11.6	173.2	-74.2	-170.3	176.7	-173.2	-1.5	115.2	A71	A71-R73 PolarHBondContact O-N 3.26Å
74	R	28.1	Very low	30.3	Very low	234 Å²	234	125.2 Å²	125.2	88%	0.883	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-136.7	9.4	179	-73.6	-168.8	179.1	174.3	1.4	115.9	A71 E72 D76	A71-R74 PolarHBondContact O-N 3.05Å; A71-R74 VanDerWaalsContact O-N 3.17Å; E72-R74 PolarHBondContact O-N 3.38Å; E72-R74 VanDerWaalsContact O-N 3.17Å; R74-D76 PolarHBondContact O-N 3.39Å
75	F	25.8	Very low	30.7	Very low	152 Å²	152	121.3 Å²	121.3	67%	0.667	60%	0.6	S	S	*	*			trans	-89.5	97.8	166.5	-83.1	-82	0	0	0	110.1	F77	F75-F77 HydrophobicContact CB-CD2 4.27Å; F75-F77 HydrophobicContact CD1-CD2 4.18Å; F75-F77 HydrophobicContact CD1-CE2 4.24Å; F75-F77 PolarHBondContact O-N 2.95Å
76	D	28	Very low	31.5	Very low	157 Å²	157	121.4 Å²	121.4	84%	0.84	60%	0.595	S	S	*	*			trans	-69	58.4	159.7	-81.1	-35.3	0	0	0	110.3	R74 K78	R74-D76 PolarHBondContact O-N 3.39Å; D76-K78 PolarHBondContact O-N 3.36Å
77	F	26.8	Very low	32.2	Very low	174 Å²	174	118 Å²	118	76%	0.763	58%	0.575	S	S	*	*			trans	-67	90.9	152.3	-96.8	-75.4	0	0	0	105.9	F75 P79	F75-F77 HydrophobicContact CB-CD2 4.27Å; F75-F77 HydrophobicContact CD1-CD2 4.18Å; F75-F77 HydrophobicContact CD1-CE2 4.24Å; F75-F77 PolarHBondContact O-N 2.95Å; F77-P79 WeakPolarHBondContact O-CD 3.16Å
78	K	29.3	Very low	33	Very low	122 Å²	122	115.9 Å²	115.9	53%	0.53	56%	0.555	S	S	.	*			trans	-55.8	115	176.8	-70.6	-170.5	174.3	-168.4	0	107.9	D76 S80 W81	D76-K78 PolarHBondContact O-N 3.36Å; K78-S80 WeakPolarHBondContact CB-OG 3.16Å; K78-S80 PolarHBondContact O-N 3.11Å; K78-W81 PolarHBondContact O-N 2.95Å; K78-W81 VanDerWaalsContact O-N 3.14Å
79	P	29.8	Very low	33.8	Very low	80 Å²	80	113.5 Å²	113.5	52%	0.519	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.7	-177.2	26.1	-34.6	0	0	0	111.9	F77 W81 V82 L83	F77-P79 WeakPolarHBondContact O-CD 3.16Å; P79-W81 PolarHBondContact O-N 2.98Å; P79-V82 PolarHBondContact O-N 3.02Å; P79-L83 HydrophobicContact CB-CD1 4.19Å; P79-L83 WeakPolarHBondContact O-CB 3.38Å; P79-L83 PolarHBondContact O-N 3.22Å
80	S	35.2	Very low	34.7	Very low	52 Å²	52	111.1 Å²	111.1	36%	0.364	53%	0.53	S	S	.	.	H	α-helix	trans	-53.6	-29.5	170.9	68.8	0	0	0	0	114.9	K78 C84	K78-S80 WeakPolarHBondContact CB-OG 3.16Å; K78-S80 PolarHBondContact O-N 3.11Å; S80-C84 WeakPolarHBondContact O-CB 3.32Å; S80-C84 PolarHBondContact O-N 3.17Å; S80-C84 PolarHBondContact O-SG 3.4Å
81	W	32.4	Very low	35.6	Very low	169 Å²	169	106 Å²	106	64%	0.64	51%	0.512	S	S	*	.	H	α-helix	trans	-70.6	-45.7	-179.6	-80.5	63.2	0	0	0	111.7	K78 P79 F85 H703	K78-W81 PolarHBondContact O-N 2.95Å; K78-W81 VanDerWaalsContact O-N 3.14Å; P79-W81 PolarHBondContact O-N 2.98Å; W81-F85 PolarHBondContact O-N 3.38Å; W81-H703 AromaticContact CZ2-NE2 3.94Å
82	V	33.8	Very low	36.4	Very low	99 Å²	99	104.8 Å²	104.8	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-72.3	-42.6	177.7	-176.4	0	0	0	0	110.5	P79 C84 F85 F86 G87	P79-V82 PolarHBondContact O-N 3.02Å; V82-C84 PolarHBondContact O-N 3.28Å; V82-F85 PolarHBondContact O-N 3.36Å; V82-F86 HydrophobicContact CG1-CD2 4.09Å; V82-F86 WeakPolarHBondContact O-CB 3.31Å; V82-F86 PolarHBondContact O-N 2.9Å; V82-G87 PolarHBondContact O-N 3.1Å
83	L	36.6	Very low	37.3	Very low	94 Å²	94	106 Å²	106	49%	0.492	50%	0.501	S	S	.	.	H	α-helix	trans	-68	-30	177.6	-82.2	157.2	0	0	0	114	P79 G87	P79-L83 HydrophobicContact CB-CD1 4.19Å; P79-L83 WeakPolarHBondContact O-CB 3.38Å; P79-L83 PolarHBondContact O-N 3.22Å; L83-G87 WeakPolarHBondContact O-CA 3.45Å; L83-G87 PolarHBondContact O-N 3.29Å; L83-G87 VanDerWaalsContact O-N 3.16Å
84	C	37.3	Very low	38.1	Very low	55 Å²	55	98 Å²	98	37%	0.372	48%	0.476	S	S	.	.	H	α-helix	trans	-82.5	-28.1	176.5	-69.3	0	0	0	0	113.7	S80 V82	S80-C84 WeakPolarHBondContact O-CB 3.32Å; S80-C84 PolarHBondContact O-N 3.17Å; S80-C84 PolarHBondContact O-SG 3.4Å; V82-C84 PolarHBondContact O-N 3.28Å
85	F	38.8	Very low	39.1	Very low	76 Å²	76	90.8 Å²	90.8	33%	0.333	45%	0.454	S	S	.	.	H	α-helix	trans	-88.9	-48	177.3	-109.1	-87.4	0	0	0	112.8	W81 V82 I89 H700	W81-F85 PolarHBondContact O-N 3.38Å; V82-F85 PolarHBondContact O-N 3.36Å; F85-I89 WeakPolarHBondContact O-CD1 3.14Å; F85-H700 AromaticContact CZ-CE1 3.99Å
86	F	45	Very low	40.1	Very low	115 Å²	115	85.9 Å²	85.9	50%	0.504	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-23.4	-176.7	-65.8	-82.4	0	0	0	113.4	V82 I89 I90	V82-F86 HydrophobicContact CG1-CD2 4.09Å; V82-F86 WeakPolarHBondContact O-CB 3.31Å; V82-F86 PolarHBondContact O-N 2.9Å; F86-I89 PolarHBondContact O-N 3.26Å; F86-I89 VanDerWaalsContact O-N 3.15Å; F86-I90 HydrophobicContact CB-CD1 3.95Å; F86-I90 WeakPolarHBondContact O-CB 3.45Å; F86-I90 VanDerWaalsContact O-CG1 3.3Å; F86-I90 WeakPolarHBondContact O-CG1 3.46Å; F86-I90 PolarHBondContact O-N 3.27Å
87	G	44.8	Very low	40.9	Very low	21 Å²	21	81.6 Å²	81.6	22%	0.216	41%	0.409	C	S	.	.	H	α-helix	trans	-55.9	-48.1	-178.8	0	0	0	0	0	114	V82 L83 I89 L91	V82-G87 PolarHBondContact O-N 3.1Å; L83-G87 WeakPolarHBondContact O-CA 3.45Å; L83-G87 PolarHBondContact O-N 3.29Å; L83-G87 VanDerWaalsContact O-N 3.16Å; G87-I89 VanDerWaalsContact C-N 3.34Å; G87-I89 PolarHBondContact O-N 3.45Å; G87-L91 VanDerWaalsContact O-CB 3.22Å; G87-L91 WeakPolarHBondContact O-CB 3.35Å; G87-L91 PolarHBondContact O-N 2.94Å
88	P	46.6	Very low	41.4	Very low	25 Å²	25	76.1 Å²	76.1	16%	0.162	40%	0.396	C	S	.	.	H	α-helix	trans	-65.3	-34.2	176	-23	34.9	0	0	0	113.4	C92 F696 A699	P88-C92 VanDerWaalsContact O-CB 3.25Å; P88-C92 WeakPolarHBondContact O-CB 3.24Å; P88-C92 PolarHBondContact O-N 3.19Å; P88-F696 HydrophobicContact CB-CD1 3.95Å; P88-F696 HydrophobicContact CB-CE1 3.63Å; P88-F696 HydrophobicContact CB-CE2 4.2Å; P88-F696 HydrophobicContact CB-CG 4.38Å; P88-F696 HydrophobicContact CB-CZ 3.76Å; P88-A699 HydrophobicContact CG-CB 4.42Å
89	I	47.9	Very low	42	Very low	40 Å²	40	73.5 Å²	73.5	21%	0.205	39%	0.386	C	S	.	.	H	α-helix	trans	-69.5	-47.3	178.2	-56.3	169.7	0	0	0	110.3	F85 F86 G87 L91 C92 Y93 F696 I748	F85-I89 WeakPolarHBondContact O-CD1 3.14Å; F86-I89 PolarHBondContact O-N 3.26Å; F86-I89 VanDerWaalsContact O-N 3.15Å; G87-I89 VanDerWaalsContact C-N 3.34Å; G87-I89 PolarHBondContact O-N 3.45Å; I89-L91 VanDerWaalsContact C-N 3.33Å; I89-L91 PolarHBondContact O-N 3.05Å; I89-C92 PolarHBondContact O-N 3.17Å; I89-Y93 WeakPolarHBondContact O-CB 3.46Å; I89-Y93 PolarHBondContact O-N 3.04Å; I89-F696 HydrophobicContact CG1-CE1 3.76Å; I89-F696 HydrophobicContact CG1-CZ 3.96Å; I89-I748 HydrophobicContact CD1-CG2 3.76Å
90	I	49.3	Very low	42.4	Very low	58 Å²	58	73.8 Å²	73.8	30%	0.297	38%	0.383	S	S	.	.	H	α-helix	trans	-64.6	-39.1	176.5	-66.5	166.1	0	0	0	110.2	F86 Y93 L94	F86-I90 HydrophobicContact CB-CD1 3.95Å; F86-I90 WeakPolarHBondContact O-CB 3.45Å; F86-I90 VanDerWaalsContact O-CG1 3.3Å; F86-I90 WeakPolarHBondContact O-CG1 3.46Å; F86-I90 PolarHBondContact O-N 3.27Å; I90-Y93 PolarHBondContact O-N 3.36Å; I90-L94 HydrophobicContact CG2-CD1 3.75Å; I90-L94 HydrophobicContact CG2-CG 4.22Å; I90-L94 VanDerWaalsContact O-CB 3.24Å; I90-L94 WeakPolarHBondContact O-CB 3.4Å; I90-L94 WeakPolarHBondContact O-CG 3.48Å; I90-L94 PolarHBondContact O-N 3.19Å
91	L	47.5	Very low	42.2	Very low	92 Å²	92	72.8 Å²	72.8	48%	0.482	38%	0.378	S	S	.	.	H	α-helix	trans	-65.1	-44.4	175.2	-170.1	73.6	0	0	0	111.4	G87 I89 L94 I95	G87-L91 VanDerWaalsContact O-CB 3.22Å; G87-L91 WeakPolarHBondContact O-CB 3.35Å; G87-L91 PolarHBondContact O-N 2.94Å; I89-L91 VanDerWaalsContact C-N 3.33Å; I89-L91 PolarHBondContact O-N 3.05Å; L91-L94 PolarHBondContact O-N 3.19Å; L91-I95 HydrophobicContact CD2-CD1 4.43Å; L91-I95 HydrophobicContact CG-CD1 3.91Å; L91-I95 WeakPolarHBondContact O-CB 3.41Å; L91-I95 VanDerWaalsContact O-CG1 3.22Å; L91-I95 WeakPolarHBondContact O-CG1 3.39Å; L91-I95 PolarHBondContact O-N 3.25Å
92	C	45.9	Very low	42.3	Very low	23 Å²	23	72.7 Å²	72.7	16%	0.155	38%	0.384	C	S	.	.	H	α-helix	trans	-59.1	-49.2	174.8	-168.5	0	0	0	0	111.1	P88 I89 L94 I95 L96 V692	P88-C92 VanDerWaalsContact O-CB 3.25Å; P88-C92 WeakPolarHBondContact O-CB 3.24Å; P88-C92 PolarHBondContact O-N 3.19Å; I89-C92 PolarHBondContact O-N 3.17Å; C92-L94 PolarHBondContact O-N 3.21Å; C92-I95 PolarHBondContact O-N 2.9Å; C92-L96 WeakPolarHBondContact O-CB 3.48Å; C92-L96 WeakPolarHBondContact O-CD1 3.43Å; C92-L96 VanDerWaalsContact O-CG 3.29Å; C92-L96 WeakPolarHBondContact O-CG 3.38Å; C92-L96 PolarHBondContact O-N 2.85Å; C92-V692 HydrophobicContact CB-CG1 4.47Å
93	Y	46.4	Very low	42.4	Very low	139 Å²	139	75.3 Å²	75.3	55%	0.545	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-39.2	177.3	-169	-100.9	0	0	0	112.7	I89 I90 H97	I89-Y93 WeakPolarHBondContact O-CB 3.46Å; I89-Y93 PolarHBondContact O-N 3.04Å; I90-Y93 PolarHBondContact O-N 3.36Å; Y93-H97 AromaticContact CD1-CD2 3.77Å; Y93-H97 AromaticContact CE1-CD2 3.44Å; Y93-H97 VanDerWaalsContact CE1-CD2 3.44Å; Y93-H97 WeakPolarHBondContact CE1-CD2 3.3Å; Y93-H97 AromaticContact CE1-NE2 3.74Å; Y93-H97 AromaticContact CE2-CD2 3.69Å; Y93-H97 AromaticContact CE2-NE2 3.53Å; Y93-H97 AromaticContact CZ-CD2 3.4Å; Y93-H97 AromaticContact CZ-NE2 3.21Å; Y93-H97 WeakPolarHBondContact O-CB 3.23Å; Y93-H97 PolarHBondContact O-CD2 3.24Å; Y93-H97 PolarHBondContact O-N 3.16Å; Y93-H97 PolarHBondContact OH-NE2 2.84Å
94	L	44.1	Very low	42	Very low	80 Å²	80	76 Å²	76	42%	0.419	39%	0.387	S	S	.	.	H	α-helix	trans	-71	-36.3	176	-76.3	171.4	0	0	0	113	I90 L91 C92 A98	I90-L94 HydrophobicContact CG2-CD1 3.75Å; I90-L94 HydrophobicContact CG2-CG 4.22Å; I90-L94 VanDerWaalsContact O-CB 3.24Å; I90-L94 WeakPolarHBondContact O-CB 3.4Å; I90-L94 WeakPolarHBondContact O-CG 3.48Å; I90-L94 PolarHBondContact O-N 3.19Å; L91-L94 PolarHBondContact O-N 3.19Å; C92-L94 PolarHBondContact O-N 3.21Å; L94-A98 WeakPolarHBondContact O-CB 3.37Å; L94-A98 PolarHBondContact O-N 3.36Å
95	I	49	Very low	41.7	Very low	83 Å²	83	82 Å²	82	43%	0.426	41%	0.41	S	S	.	.	H	α-helix	trans	-64.5	-52.1	173.8	-71.5	165.1	0	0	0	109	L91 C92 H97 A98 E99	L91-I95 HydrophobicContact CD2-CD1 4.43Å; L91-I95 HydrophobicContact CG-CD1 3.91Å; L91-I95 WeakPolarHBondContact O-CB 3.41Å; L91-I95 VanDerWaalsContact O-CG1 3.22Å; L91-I95 WeakPolarHBondContact O-CG1 3.39Å; L91-I95 PolarHBondContact O-N 3.25Å; C92-I95 PolarHBondContact O-N 2.9Å; I95-H97 VanDerWaalsContact C-N 3.29Å; I95-H97 PolarHBondContact O-N 3.21Å; I95-A98 PolarHBondContact O-N 3.17Å; I95-A98 VanDerWaalsContact O-N 3.13Å; I95-E99 PolarHBondContact O-N 3.21Å; I95-E99 VanDerWaalsContact O-N 3.12Å
96	L	47.8	Very low	41.1	Very low	50 Å²	50	83.1 Å²	83.1	26%	0.262	42%	0.418	S	S	.	.	H	α-helix	trans	-57	-38.5	177.2	-74.1	165.9	0	0	0	112.8	C92 L100 V756	C92-L96 WeakPolarHBondContact O-CB 3.48Å; C92-L96 WeakPolarHBondContact O-CD1 3.43Å; C92-L96 VanDerWaalsContact O-CG 3.29Å; C92-L96 WeakPolarHBondContact O-CG 3.38Å; C92-L96 PolarHBondContact O-N 2.85Å; L96-L100 WeakPolarHBondContact O-CB 3.5Å; L96-L100 PolarHBondContact O-N 3.14Å; L96-V756 HydrophobicContact CD1-CG1 4.35Å; L96-V756 HydrophobicContact CD1-CG2 4.09Å; L96-V756 HydrophobicContact CD2-CG1 3.94Å
97	H	44.4	Very low	40.2	Very low	67 Å²	67	82.7 Å²	82.7	31%	0.31	43%	0.429	S	S	.	.	H	α-helix	trans	-82	-25.4	176.3	-89.1	-72.9	0	0	0	114.8	Y93 I95 L100 A101	Y93-H97 AromaticContact CD1-CD2 3.77Å; Y93-H97 AromaticContact CE1-CD2 3.44Å; Y93-H97 VanDerWaalsContact CE1-CD2 3.44Å; Y93-H97 WeakPolarHBondContact CE1-CD2 3.3Å; Y93-H97 AromaticContact CE1-NE2 3.74Å; Y93-H97 AromaticContact CE2-CD2 3.69Å; Y93-H97 AromaticContact CE2-NE2 3.53Å; Y93-H97 AromaticContact CZ-CD2 3.4Å; Y93-H97 AromaticContact CZ-NE2 3.21Å; Y93-H97 WeakPolarHBondContact O-CB 3.23Å; Y93-H97 PolarHBondContact O-CD2 3.24Å; Y93-H97 PolarHBondContact O-N 3.16Å; Y93-H97 PolarHBondContact OH-NE2 2.84Å; I95-H97 VanDerWaalsContact C-N 3.29Å; I95-H97 PolarHBondContact O-N 3.21Å; H97-L100 CarbonylContact O-C 3.53Å; H97-L100 WeakPolarHBondContact O-CB 3.31Å; H97-L100 PolarHBondContact O-N 2.87Å; H97-A101 PolarHBondContact O-N 3.03Å
98	A	38.5	Very low	39.3	Very low	59 Å²	59	88.6 Å²	88.6	49%	0.488	45%	0.449	S	S	.	.	H	α-helix	trans	-69.5	-44.5	175.6	0	0	0	0	0	110.9	L94 I95 L100 A101 E102	L94-A98 WeakPolarHBondContact O-CB 3.37Å; L94-A98 PolarHBondContact O-N 3.36Å; I95-A98 PolarHBondContact O-N 3.17Å; I95-A98 VanDerWaalsContact O-N 3.13Å; A98-L100 PolarHBondContact O-N 3.09Å; A98-A101 WeakPolarHBondContact O-CB 3.3Å; A98-A101 PolarHBondContact O-N 3.39Å; A98-E102 PolarHBondContact O-N 3.28Å
99	E	41.2	Very low	38.3	Very low	66 Å²	66	91.8 Å²	91.8	31%	0.308	47%	0.471	S	S	.	.	H	α-helix	trans	-59.1	-33	170.1	-69.2	-178.5	117.7	0	0	111.7	I95 R103	I95-E99 PolarHBondContact O-N 3.21Å; I95-E99 VanDerWaalsContact O-N 3.12Å; E99-R103 VanDerWaalsContact O-CG 3.28Å; E99-R103 WeakPolarHBondContact O-CG 3.41Å; E99-R103 PolarHBondContact O-N 3.43Å
100	L	37.5	Very low	37.3	Very low	87 Å²	87	98.3 Å²	98.3	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-74.8	-24.2	176.8	-136.4	140.3	0	0	0	113.1	L96 H97 A98	L96-L100 WeakPolarHBondContact O-CB 3.5Å; L96-L100 PolarHBondContact O-N 3.14Å; H97-L100 CarbonylContact O-C 3.53Å; H97-L100 WeakPolarHBondContact O-CB 3.31Å; H97-L100 PolarHBondContact O-N 2.87Å; A98-L100 PolarHBondContact O-N 3.09Å
101	A	31.6	Very low	36.3	Very low	31 Å²	31	101.5 Å²	101.5	26%	0.256	51%	0.508	S	S	.	.	H	α-helix	trans	-80.2	-38	174.2	0	0	0	0	0	112.1	H97 A98 R103 L104 F108	H97-A101 PolarHBondContact O-N 3.03Å; A98-A101 WeakPolarHBondContact O-CB 3.3Å; A98-A101 PolarHBondContact O-N 3.39Å; A101-R103 VanDerWaalsContact C-N 3.26Å; A101-R103 PolarHBondContact O-N 2.84Å; A101-L104 PolarHBondContact O-N 2.92Å; A101-L104 VanDerWaalsContact O-N 3.08Å; A101-F108 HydrophobicContact CB-CE2 4.34Å
102	E	34.4	Very low	35.5	Very low	166 Å²	166	101.5 Å²	101.5	78%	0.776	51%	0.513	S	S	*	.	H	α-helix	trans	-60.2	-38.4	172.6	-134.8	166.5	-154.5	0	0	110.9	A98 L104 Q105	A98-E102 PolarHBondContact O-N 3.28Å; E102-L104 PolarHBondContact O-N 2.79Å; E102-L104 VanDerWaalsContact O-N 3.12Å; E102-Q105 PolarHBondContact O-N 2.83Å
103	R	35.4	Very low	34.8	Very low	154 Å²	154	106.6 Å²	106.6	58%	0.581	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-9.4	173.1	-74.9	173.6	-178.6	-168.2	2.5	115.9	E99 A101	E99-R103 VanDerWaalsContact O-CG 3.28Å; E99-R103 WeakPolarHBondContact O-CG 3.41Å; E99-R103 PolarHBondContact O-N 3.43Å; A101-R103 VanDerWaalsContact C-N 3.26Å; A101-R103 PolarHBondContact O-N 2.84Å
104	L	28.9	Very low	34	Very low	110 Å²	110	108.2 Å²	108.2	58%	0.576	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	0.7	-176.4	-75.2	169	0	0	0	114.6	A101 E102 I106	A101-L104 PolarHBondContact O-N 2.92Å; A101-L104 VanDerWaalsContact O-N 3.08Å; E102-L104 PolarHBondContact O-N 2.79Å; E102-L104 VanDerWaalsContact O-N 3.12Å; L104-I106 HydrophobicContact CB-CD1 3.85Å; L104-I106 HydrophobicContact CB-CG1 3.91Å; L104-I106 HydrophobicContact CD1-CD1 4.15Å; L104-I106 PolarHBondContact O-N 2.98Å; L104-I106 VanDerWaalsContact O-N 3.11Å
105	Q	29.9	Very low	33.2	Very low	181 Å²	181	107.5 Å²	107.5	85%	0.846	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.7	29.3	-174.9	-74.1	-167.9	-26.4	0	0	114.3	E102 S107	E102-Q105 PolarHBondContact O-N 2.83Å; Q105-S107 PolarHBondContact O-N 3.04Å
106	I	26.5	Very low	32.1	Very low	99 Å²	99	112.6 Å²	112.6	51%	0.508	60%	0.599	S	S	.	*			trans	-81.2	111.1	178.2	-62.7	171	0	0	0	109	L104 F108	L104-I106 HydrophobicContact CB-CD1 3.85Å; L104-I106 HydrophobicContact CB-CG1 3.91Å; L104-I106 HydrophobicContact CD1-CD1 4.15Å; L104-I106 PolarHBondContact O-N 2.98Å; L104-I106 VanDerWaalsContact O-N 3.11Å; I106-F108 HydrophobicContact CG2-CD2 4.33Å; I106-F108 HydrophobicContact CG2-CE2 4.18Å; I106-F108 PolarHBondContact O-N 3.44Å
107	S	26	Very low	31.2	Very low	105 Å²	105	115.5 Å²	115.5	73%	0.734	62%	0.621	S	S	*	*			trans	-67.9	92.1	175	50.2	0	0	0	0	111.6	Q105 C109	Q105-S107 PolarHBondContact O-N 3.04Å; S107-C109 PolarHBondContact O-N 3.08Å
108	F	27.7	Very low	30.5	Very low	145 Å²	145	118 Å²	118	64%	0.636	65%	0.646	S	S	*	*			trans	-69	95.1	169.7	-83.8	-82.2	0	0	0	110.7	A101 I106 Y110	A101-F108 HydrophobicContact CB-CE2 4.34Å; I106-F108 HydrophobicContact CG2-CD2 4.33Å; I106-F108 HydrophobicContact CG2-CE2 4.18Å; I106-F108 PolarHBondContact O-N 3.44Å; F108-Y110 VanDerWaalsContact C-N 3.29Å; F108-Y110 HydrophobicContact CB-CD2 4.27Å; F108-Y110 PolarHBondContact O-N 3.28Å
109	C	24.4	Very low	30	Very low	93 Å²	93	120.9 Å²	120.9	63%	0.628	66%	0.662	S	S	*	*			trans	-64.5	87.3	167.2	-75.2	0	0	0	0	110.6	S107 H111	S107-C109 PolarHBondContact O-N 3.08Å; C109-H111 PolarHBondContact O-N 3.13Å
110	Y	27.9	Very low	29.5	Very low	176 Å²	176	119.6 Å²	119.6	69%	0.69	67%	0.667	S	S	*	*			trans	-72.8	90.9	174.8	-108.5	-84.2	0	0	0	110.8	F108 P112	F108-Y110 VanDerWaalsContact C-N 3.29Å; F108-Y110 HydrophobicContact CB-CD2 4.27Å; F108-Y110 PolarHBondContact O-N 3.28Å; Y110-P112 VanDerWaalsContact O-CD 3.3Å; Y110-P112 WeakPolarHBondContact O-CD 3.02Å
111	H	26.6	Very low	29.2	Very low	125 Å²	125	125 Å²	125	58%	0.579	68%	0.681	S	S	*	*			trans	-83.4	112.6	159.6	-95.5	-85	0	0	0	109.8	C109 P113 T308	C109-H111 PolarHBondContact O-N 3.13Å; H111-P113 WeakPolarHBondContact O-CD 3.39Å; H111-T308 PolarHBondContact NE2-OG1 3.22Å
112	P	32.4	Very low	29.2	Very low	93 Å²	93	128.8 Å²	128.8	60%	0.604	70%	0.697	S	S	*	*			trans	-72.2	124.1	175	28.8	-32.9	0	0	0	110	Y110 I114	Y110-P112 VanDerWaalsContact O-CD 3.3Å; Y110-P112 WeakPolarHBondContact O-CD 3.02Å; P112-I114 PolarHBondContact O-N 3.32Å
113	P	29.6	Very low	29	Very low	130 Å²	130	124.1 Å²	124.1	84%	0.844	68%	0.682	S	S	*	*			trans	-69.6	117	178.7	26.7	-33	0	0	0	110.7	H111 G115	H111-P113 WeakPolarHBondContact O-CD 3.39Å; P113-G115 PolarHBondContact O-N 2.92Å
114	I	29.6	Very low	28.9	Very low	172 Å²	172	120.7 Å²	120.7	88%	0.882	68%	0.678	S	S	*	*			trans	-71.1	110.7	-175.5	-60.9	170.5	0	0	0	110.8	P112	P112-I114 PolarHBondContact O-N 3.32Å
115	G	28	Very low	29	Very low	66 Å²	66	118.8 Å²	118.8	68%	0.68	67%	0.668	S	S	*	*			trans	92.1	93.8	153	0	0	0	0	0	118.1	P113	P113-G115 PolarHBondContact O-N 2.92Å
116	M	27	Very low	28.8	Very low	190 Å²	190	116.1 Å²	116.1	94%	0.936	66%	0.656	S	S	*	*			trans	-142.3	142	150.5	-83.9	-150.8	172.3	0	0	112.8
117	P	28.3	Very low	28.9	Very low	110 Å²	110	114.7 Å²	114.7	71%	0.714	66%	0.655	S	S	*	*			trans	-92.1	134	-173.6	35	-34.6	0	0	0	114.6	S119	P117-S119 PolarHBondContact O-N 2.88Å; P117-S119 VanDerWaalsContact O-N 3.14Å
118	S	28.9	Very low	29.1	Very low	120 Å²	120	114.3 Å²	114.3	84%	0.839	64%	0.641	S	S	*	*	S	Bend	trans	44.2	49.3	141.9	74.1	0	0	0	0	120.4
119	S	29.1	Very low	29.2	Very low	119 Å²	119	113.6 Å²	113.6	83%	0.832	64%	0.638	S	S	*	*			trans	178.1	109.6	143	54.9	0	0	0	0	112.7	P117	P117-S119 PolarHBondContact O-N 2.88Å; P117-S119 VanDerWaalsContact O-N 3.14Å
120	G	29.3	Very low	29.3	Very low	39 Å²	39	114.4 Å²	114.4	40%	0.402	64%	0.643	S	S	.	*			trans	157.1	74.8	169.6	0	0	0	0	0	117.4	L122 S123	G120-L122 PolarHBondContact O-N 2.98Å; G120-S123 PolarHBondContact O-N 2.81Å; G120-S123 PolarHBondContact O-OG 3.44Å
121	W	32.7	Very low	29.4	Very low	200 Å²	200	110.4 Å²	110.4	76%	0.758	64%	0.641	S	S	*	*	H	α-helix	trans	-69.7	-17.8	165.7	-89.3	59	0	0	0	112.9
122	L	31	Very low	29.5	Very low	111 Å²	111	112.6 Å²	112.6	58%	0.581	65%	0.646	S	S	*	*	H	α-helix	trans	-73	-29.5	172.3	-107.1	83.7	0	0	0	113.3	G120 L125 Q126	G120-L122 PolarHBondContact O-N 2.98Å; L122-L125 PolarHBondContact O-N 2.84Å; L122-Q126 WeakPolarHBondContact O-CG 3.4Å; L122-Q126 PolarHBondContact O-N 3.19Å
123	S	30.5	Very low	29.2	Very low	68 Å²	68	119.3 Å²	119.3	48%	0.476	66%	0.659	S	S	.	*	H	α-helix	trans	-76.8	-25.3	-175.9	49.9	0	0	0	0	113.3	G120 Q126 S127	G120-S123 PolarHBondContact O-N 2.81Å; G120-S123 PolarHBondContact O-OG 3.44Å; S123-Q126 PolarHBondContact O-N 3.11Å; S123-S127 PolarHBondContact O-N 3.33Å; S123-S127 PolarHBondContact O-OG 2.88Å
124	V	33.1	Very low	29	Very low	83 Å²	83	124.4 Å²	124.4	50%	0.503	66%	0.661	S	S	.	*	H	α-helix	trans	-71.8	-40.6	172.6	-179.4	0	0	0	0	110.7	S127 H128	V124-S127 WeakPolarHBondContact CA-OG 3.28Å; V124-S127 PolarHBondContact O-N 3.49Å; V124-S127 PolarHBondContact O-OG 2.63Å; V124-H128 PolarHBondContact O-CD2 2.84Å; V124-H128 VanDerWaalsContact O-CD2 3.23Å; V124-H128 PolarHBondContact O-N 3.15Å; V124-H128 VanDerWaalsContact O-N 3.09Å
125	L	29.6	Very low	28.8	Very low	69 Å²	69	122.5 Å²	122.5	36%	0.361	66%	0.658	S	S	.	*	H	α-helix	trans	-64.1	-41.7	169.4	-82.9	160.1	0	0	0	111.3	L122 S127 H128 F129	L122-L125 PolarHBondContact O-N 2.84Å; L125-S127 PolarHBondContact O-N 2.89Å; L125-H128 PolarHBondContact O-N 2.79Å; L125-F129 HydrophobicContact CD2-CD2 4.37Å; L125-F129 HydrophobicContact CD2-CE2 4.09Å; L125-F129 WeakPolarHBondContact O-CB 3.24Å; L125-F129 WeakPolarHBondContact O-CD2 3.49Å; L125-F129 PolarHBondContact O-N 3.1Å
126	Q	27.4	Very low	28.6	Very low	125 Å²	125	125 Å²	125	58%	0.584	66%	0.663	S	S	*	*	H	α-helix	trans	-67.1	-31.6	175.5	-73.8	-178.9	-64	0	0	113.6	L122 S123 C130	L122-Q126 WeakPolarHBondContact O-CG 3.4Å; L122-Q126 PolarHBondContact O-N 3.19Å; S123-Q126 PolarHBondContact O-N 3.11Å; Q126-C130 WeakPolarHBondContact O-CB 3.5Å; Q126-C130 PolarHBondContact O-N 3.23Å
127	S	28.9	Very low	28.5	Very low	70 Å²	70	121.5 Å²	121.5	49%	0.49	65%	0.652	S	S	.	*	H	α-helix	trans	-71	-39	174.2	56.8	0	0	0	0	112.4	S123 V124 L125 S131	S123-S127 PolarHBondContact O-N 3.33Å; S123-S127 PolarHBondContact O-OG 2.88Å; V124-S127 WeakPolarHBondContact CA-OG 3.28Å; V124-S127 PolarHBondContact O-N 3.49Å; V124-S127 PolarHBondContact O-OG 2.63Å; L125-S127 PolarHBondContact O-N 2.89Å; S127-S131 PolarHBondContact O-N 2.82Å
128	H	29.8	Very low	28.4	Very low	97 Å²	97	125.4 Å²	125.4	45%	0.449	66%	0.658	S	S	.	*	H	α-helix	trans	-67.6	-42.6	172.7	-76.6	-68.8	0	0	0	112	V124 L125 C130 S131	V124-H128 PolarHBondContact O-CD2 2.84Å; V124-H128 VanDerWaalsContact O-CD2 3.23Å; V124-H128 PolarHBondContact O-N 3.15Å; V124-H128 VanDerWaalsContact O-N 3.09Å; L125-H128 PolarHBondContact O-N 2.79Å; H128-C130 PolarHBondContact O-N 3.31Å; H128-S131 PolarHBondContact O-N 3.14Å
129	F	29.2	Very low	28.2	Very low	130 Å²	130	127.2 Å²	127.2	57%	0.57	66%	0.658	S	S	*	*	H	α-helix	trans	-73.4	-22.7	177.7	-85.2	-80.3	0	0	0	114.4	L125	L125-F129 HydrophobicContact CD2-CD2 4.37Å; L125-F129 HydrophobicContact CD2-CE2 4.09Å; L125-F129 WeakPolarHBondContact O-CB 3.24Å; L125-F129 WeakPolarHBondContact O-CD2 3.49Å; L125-F129 PolarHBondContact O-N 3.1Å
130	C	27	Very low	27.9	Very low	109 Å²	109	130.8 Å²	130.8	74%	0.736	65%	0.654	S	S	*	*	H	α-helix	trans	-79.9	-18.6	174	-89.5	0	0	0	0	114.4	Q126 H128	Q126-C130 WeakPolarHBondContact O-CB 3.5Å; Q126-C130 PolarHBondContact O-N 3.23Å; H128-C130 PolarHBondContact O-N 3.31Å
131	S	28.9	Very low	27.9	Very low	92 Å²	92	134 Å²	134	64%	0.643	66%	0.661	S	S	*	*	H	α-helix	trans	-86.9	-15.3	175.8	-153.3	0	0	0	0	113.4	S127 H128 R133	S127-S131 PolarHBondContact O-N 2.82Å; H128-S131 PolarHBondContact O-N 3.14Å; S131-R133 PolarHBondContact O-N 2.83Å
132	Y	29.2	Very low	27.6	Very low	171 Å²	171	127.9 Å²	127.9	67%	0.671	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	23.3	-178.4	-106.6	-90.6	0	0	0	115
133	R	27.1	Very low	27.4	Very low	235 Å²	235	128.8 Å²	128.8	89%	0.887	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	18.3	-177	-130.9	-179.8	-170.4	-161.7	0.4	115.3	S131	S131-R133 PolarHBondContact O-N 2.83Å
134	R	23.9	Very low	27.3	Very low	236 Å²	236	131.7 Å²	131.7	89%	0.891	67%	0.673	S	S	*	*			trans	-142.8	71.5	171.5	-72.9	-170.5	176.9	-178.8	-2.6	111.8
135	V	25.1	Very low	26.9	Very low	133 Å²	133	136.3 Å²	136.3	81%	0.806	69%	0.69	S	S	*	*			trans	-137.7	71.7	160	-171	0	0	0	0	108.5
136	C	24.8	Very low	26.9	Very low	119 Å²	119	141.1 Å²	141.1	80%	0.804	72%	0.715	S	S	*	*			trans	-108.2	126	147.4	-63.1	0	0	0	0	103.8
137	V	24.6	Very low	27	Very low	116 Å²	116	138.2 Å²	138.2	70%	0.703	72%	0.718	S	S	*	*				56.8	122.4	68	-172.2	0	0	0	0	109.9
138	F	25.6	Very low	27	Very low	192 Å²	192	140.7 Å²	140.7	84%	0.842	73%	0.733	S	S	*	*			trans	85.7	85.4	-168.3	-63.8	-77.5	0	0	0	117
139	D	24.4	Very low	26.9	Very low	157 Å²	157	144.6 Å²	144.6	84%	0.84	76%	0.755	S	S	*	*			trans	-55.2	153.2	132.1	-95.7	-44.4	0	0	0	110.4
140	R	24.4	Very low	26.7	Very low	194 Å²	194	144.9 Å²	144.9	73%	0.732	76%	0.763	S	S	*	*			trans	73.5	84.1	-177.7	-51.4	-179.8	-178.1	-177.1	0.6	115.9
141	L	28.3	Very low	26.8	Very low	106 Å²	106	144.1 Å²	144.1	56%	0.555	76%	0.758	S	S	*	*				-170.9	138.7	112.2	-104.9	165.2	0	0	0	111.2	L166	L141-L166 HydrophobicContact CD1-CD2 3.82Å; L141-L166 HydrophobicContact CD1-CG 4.13Å; L141-L166 HydrophobicContact CD2-CD2 4.04Å; L141-L166 HydrophobicContact CG-CD2 3.74Å
142	S	26.1	Very low	26.8	Very low	72 Å²	72	148.4 Å²	148.4	50%	0.503	76%	0.761	S	S	.	*			trans	-88	170.3	176.6	50.3	0	0	0	0	112.1
143	D	27.1	Very low	26.9	Very low	131 Å²	131	147.1 Å²	147.1	70%	0.701	77%	0.77	S	S	*	*			trans	94.5	141.3	154.2	-49.9	-49.6	0	0	0	120.4
144	C	27.7	Very low	27	Very low	129 Å²	129	141.3 Å²	141.3	87%	0.872	76%	0.763	S	S	*	*			trans	72.8	94	170.4	-66.3	0	0	0	0	119
145	E	26.7	Very low	27.2	Very low	180 Å²	180	137.3 Å²	137.3	84%	0.841	76%	0.758	S	S	*	*			trans	-46.4	146.7	153.6	-47.8	175.2	130.7	0	0	113.3
146	L	28.5	Very low	27.2	Very low	170 Å²	170	137.6 Å²	137.6	89%	0.89	76%	0.755	S	S	*	*				175.7	135.4	115.7	-96.8	158.4	0	0	0	113.8
147	G	29.5	Very low	27.4	Very low	64 Å²	64	138.2 Å²	138.2	66%	0.66	76%	0.755	S	S	*	*			trans	78.5	113.9	131.2	0	0	0	0	0	119.4
148	P	28.6	Very low	27.6	Very low	122 Å²	122	140 Å²	140	79%	0.792	76%	0.76	S	S	*	*			trans	-83	149.6	170.9	35.1	-33.8	0	0	0	112.1
149	I	27.8	Very low	27.5	Very low	178 Å²	178	139.3 Å²	139.3	91%	0.913	76%	0.764	S	S	*	*			trans	-158.8	155.9	153.7	-100.9	141	0	0	0	111.6
150	D	26.2	Very low	27.7	Very low	137 Å²	137	135.5 Å²	135.5	73%	0.733	75%	0.75	S	S	*	*			trans	-70.5	151.4	-167.2	-91	-58.5	0	0	0	118.1
151	S	28.6	Very low	28	Very low	93 Å²	93	132.6 Å²	132.6	65%	0.65	75%	0.749	S	S	*	*			trans	79.7	113.6	137.2	74.3	0	0	0	0	122.9
152	R	29.5	Very low	27.9	Very low	182 Å²	182	135.5 Å²	135.5	69%	0.687	76%	0.764	S	S	*	*			trans	53.7	89.9	132.8	-57.7	178.8	-177.2	-150.7	4.1	119.4
153	V	31.4	Very low	27.9	Very low	143 Å²	143	137.6 Å²	137.6	87%	0.867	78%	0.776	S	S	*	*			trans	-138	135.7	141.3	-173.9	0	0	0	0	109
154	P	29.1	Very low	28	Very low	114 Å²	114	140.5 Å²	140.5	74%	0.74	79%	0.785	S	S	*	*			trans	-107.6	151.4	179.8	38.4	-31	0	0	0	114.3
155	L	27.4	Very low	28	Very low	152 Å²	152	142.4 Å²	142.4	80%	0.796	79%	0.786	S	S	*	*	S	Bend	trans	59.6	133	153.4	-139.1	82.9	0	0	0	119.9
156	N	25.7	Very low	28	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	77%	0.774	S	S	*	*			trans	71.9	154.6	170.2	-57	-19.3	0	0	0	116.2
157	V	27.5	Very low	27.8	Very low	133 Å²	133	135.7 Å²	135.7	81%	0.806	76%	0.756	S	S	*	*			trans	88.4	126.9	-179.6	-173.1	0	0	0	0	115.2
158	L	28.7	Very low	27.7	Very low	152 Å²	152	137 Å²	137	80%	0.796	76%	0.755	S	S	*	*			trans	72.3	65.7	167.4	-70.1	159.4	0	0	0	118.9
159	L	25	Very low	27.6	Very low	178 Å²	178	141.4 Å²	141.4	93%	0.932	76%	0.758	S	S	*	*				-74.2	118.3	127	-91.7	157.6	0	0	0	108.7
160	S	27.2	Very low	27.6	Very low	78 Å²	78	138.5 Å²	138.5	55%	0.545	75%	0.748	S	S	.	*			trans	-177.8	156.3	134.9	67.5	0	0	0	0	110.8
161	D	31	Very low	27.5	Very low	133 Å²	133	137.6 Å²	137.6	71%	0.711	75%	0.748	S	S	*	*			trans	65.6	79.8	159	-42.2	-44.3	0	0	0	117.4
162	L	25.9	Very low	27.3	Very low	167 Å²	167	141 Å²	141	87%	0.874	76%	0.758	S	S	*	*				82.7	144	85.7	-105.2	82.3	0	0	0	115.6
163	P	25.9	Very low	27.2	Very low	115 Å²	115	135.7 Å²	135.7	75%	0.747	76%	0.76	S	S	*	*			trans	-92.7	155.8	-171.3	37.9	-34.5	0	0	0	113
164	Q	29.2	Very low	27	Very low	193 Å²	193	136.3 Å²	136.3	90%	0.902	76%	0.757	S	S	*	*			trans	-154.8	-4.1	168.9	-126.8	176.3	19.8	0	0	118.7
165	L	29.1	Very low	26.9	Very low	169 Å²	169	139.2 Å²	139.2	89%	0.885	77%	0.765	S	S	*	*			trans	-124.7	94.2	-172.9	-80	157.9	0	0	0	112.7
166	L	25.6	Very low	26.8	Very low	113 Å²	113	136 Å²	136	59%	0.592	76%	0.755	S	S	*	*			trans	-102.2	138.9	171.8	-98.2	161	0	0	0	111	L141	L141-L166 HydrophobicContact CD1-CD2 3.82Å; L141-L166 HydrophobicContact CD1-CG 4.13Å; L141-L166 HydrophobicContact CD2-CD2 4.04Å; L141-L166 HydrophobicContact CG-CD2 3.74Å
167	N	24.3	Very low	26.7	Very low	95 Å²	95	137.6 Å²	137.6	51%	0.508	76%	0.755	S	S	.	*			trans	62.8	115.6	149	-60	-20.3	0	0	0	121.4
168	S	28	Very low	26.6	Very low	93 Å²	93	135.8 Å²	135.8	65%	0.65	75%	0.749	S	S	*	*			trans	165.2	147.8	139.8	41.8	0	0	0	0	109.3
169	Y	27.1	Very low	26.5	Very low	214 Å²	214	133.2 Å²	133.2	84%	0.839	74%	0.743	S	S	*	*			cis	-169.8	165.9	-17.6	-122.6	-72.2	0	0	0	107.3
170	T	27.2	Very low	26.5	Very low	116 Å²	116	130.3 Å²	130.3	71%	0.712	73%	0.729	S	S	*	*			trans	62.4	131.1	156.6	49.9	0	0	0	0	119.2
171	V	24.7	Very low	26.6	Very low	119 Å²	119	133.6 Å²	133.6	72%	0.721	74%	0.74	S	S	*	*				74.6	125.4	51.5	177.2	0	0	0	0	113.5
172	N	23.2	Very low	26.4	Very low	164 Å²	164	136.8 Å²	136.8	88%	0.877	74%	0.742	S	S	*	*			trans	70.4	70.8	167.2	-64.1	-12.3	0	0	0	119.2
173	G	28.1	Very low	26.3	Very low	71 Å²	71	131.2 Å²	131.2	73%	0.732	71%	0.713	S	S	*	*			trans	-168.4	142.3	154.2	0	0	0	0	0	109.5
174	I	27.6	Very low	26.4	Very low	155 Å²	155	132.3 Å²	132.3	80%	0.795	72%	0.717	S	S	*	*			cis	-136.6	135.2	3.8	-75	171.6	0	0	0	109.3	S176	I174-S176 PolarHBondContact O-N 2.77Å
175	I	25.3	Very low	26.7	Very low	175 Å²	175	130.5 Å²	130.5	90%	0.897	71%	0.713	S	S	*	*			trans	-66.6	110.6	167.8	-66.9	161.6	0	0	0	108.7
176	S	25.7	Very low	26.6	Very low	84 Å²	84	126.8 Å²	126.8	59%	0.587	69%	0.694	S	S	*	*			trans	-159.1	145.2	158.8	66.4	0	0	0	0	111.2	I174	I174-S176 PolarHBondContact O-N 2.77Å
177	F	23.6	Very low	26.5	Very low	172 Å²	172	125.6 Å²	125.6	75%	0.754	69%	0.691	S	S	*	*			trans	69.1	62.1	174.2	-64.9	-80.2	0	0	0	118.2
178	S	25.1	Very low	26.7	Very low	95 Å²	95	130.2 Å²	130.2	66%	0.664	71%	0.71	S	S	*	*				-47.7	161.4	125.9	55.1	0	0	0	0	112.7	D180	S178-D180 PolarHBondContact O-N 2.81Å
179	S	26.6	Very low	26.6	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	70%	0.697	S	S	*	*			trans	58.2	48.1	157.9	60.9	0	0	0	0	118
180	D	25.3	Very low	26.5	Very low	117 Å²	117	126.6 Å²	126.6	63%	0.626	68%	0.684	S	S	*	*			trans	-149.2	79.3	162.6	-129	-21.1	0	0	0	111.7	S178 W182	S178-D180 PolarHBondContact O-N 2.81Å; D180-W182 PolarHBondContact OD1-N 2.78Å
181	L	30.7	Very low	26.4	Very low	148 Å²	148	122.3 Å²	122.3	78%	0.775	66%	0.659	S	S	*	*			cis	57.6	33.6	6.8	-125.3	169.9	0	0	0	115.9
182	W	26.8	Very low	26.5	Very low	199 Å²	199	123.5 Å²	123.5	75%	0.754	65%	0.651	S	S	*	*	S	Bend		-169.1	-23.2	124.4	-112.7	60	0	0	0	117	D180	D180-W182 PolarHBondContact OD1-N 2.78Å
183	D	23.6	Very low	26.7	Very low	50 Å²	50	122.2 Å²	122.2	27%	0.267	65%	0.645	S	S	.	*	S	Bend	trans	-134.3	16	-155.9	-105.4	10.2	0	0	0	121.8	L185 N186 T187 R189	D183-L185 CarbonylContact C-O 3.41Å; D183-L185 VanDerWaalsContact CA-O 3.31Å; D183-L185 WeakPolarHBondContact CA-O 3.23Å; D183-N186 CarbonylContact O-C 3.59Å; D183-T187 PolarHBondContact O-N 2.93Å; D183-T187 PolarHBondContact O-OG1 2.9Å; D183-R189 IonicContact OD1-CZ 3.23Å; D183-R189 IonicContact OD1-NH1 2.71Å; D183-R189 PolarHBondContact OD1-NH1 3.08Å; D183-R189 VanDerWaalsContact OD1-NH1 3.14Å; D183-R189 IonicContact OD1-NH2 2.7Å; D183-R189 PolarHBondContact OD1-NH2 3.03Å; D183-R189 IonicContact OD2-CZ 2.84Å; D183-R189 IonicContact OD2-NH1 3.23Å; D183-R189 PolarHBondContact OD2-NH1 3.45Å; D183-R189 IonicContact OD2-NH2 3.14Å
184	V	27	Very low	26.7	Very low	139 Å²	139	122.2 Å²	122.2	84%	0.842	65%	0.645	S	S	*	*	S	Bend	trans	-106.9	-22	163	-179.4	0	0	0	0	113	N186	V184-N186 PolarHBondContact O-N 3.26Å
185	L	36.9	Very low	26.8	Very low	155 Å²	155	125 Å²	125	81%	0.812	65%	0.651	S	S	*	*	S	Bend		-61.8	86.5	122.8	-86.5	163.7	0	0	0	107.5	D183	D183-L185 CarbonylContact C-O 3.41Å; D183-L185 VanDerWaalsContact CA-O 3.31Å; D183-L185 WeakPolarHBondContact CA-O 3.23Å
186	N	25.3	Very low	26.8	Very low	91 Å²	91	120.9 Å²	120.9	49%	0.487	64%	0.643	S	S	.	*	S	Bend	trans	107.5	57.4	170.9	-54.2	-61.1	0	0	0	121.1	D183 V184 R189	D183-N186 CarbonylContact O-C 3.59Å; V184-N186 PolarHBondContact O-N 3.26Å; N186-R189 HydrophobicContact CB-CG 4.38Å; N186-R189 WeakPolarHBondContact O-CD 3.08Å; N186-R189 WeakPolarHBondContact O-CG 3.36Å; N186-R189 PolarHBondContact O-NE 3.45Å; N186-R189 PolarHBondContact O-NH1 3.33Å
187	T	24.8	Very low	26.9	Very low	87 Å²	87	122.3 Å²	122.3	53%	0.534	65%	0.651	S	S	.	*			trans	-161.3	138.7	146.6	35.4	0	0	0	0	108.4	D183 R189	D183-T187 PolarHBondContact O-N 2.93Å; D183-T187 PolarHBondContact O-OG1 2.9Å; T187-R189 HydrophobicContact CG2-CB 4.49Å
188	Q	28.9	Very low	26.9	Very low	193 Å²	193	123.9 Å²	123.9	90%	0.902	66%	0.657	S	S	*	*	S	Bend	cis	-91.2	111.6	-8.9	-68	175.5	-6.6	0	0	108.3
189	R	25.8	Very low	27	Very low	100 Å²	100	125.2 Å²	125.2	38%	0.377	66%	0.661	S	S	.	*			cis	49.1	131	46.3	-77.8	-171.2	172.4	152.3	10.2	112.9	D183 N186 T187	D183-R189 IonicContact OD1-CZ 3.23Å; D183-R189 IonicContact OD1-NH1 2.71Å; D183-R189 PolarHBondContact OD1-NH1 3.08Å; D183-R189 VanDerWaalsContact OD1-NH1 3.14Å; D183-R189 IonicContact OD1-NH2 2.7Å; D183-R189 PolarHBondContact OD1-NH2 3.03Å; D183-R189 IonicContact OD2-CZ 2.84Å; D183-R189 IonicContact OD2-NH1 3.23Å; D183-R189 PolarHBondContact OD2-NH1 3.45Å; D183-R189 IonicContact OD2-NH2 3.14Å; N186-R189 HydrophobicContact CB-CG 4.38Å; N186-R189 WeakPolarHBondContact O-CD 3.08Å; N186-R189 WeakPolarHBondContact O-CG 3.36Å; N186-R189 PolarHBondContact O-NE 3.45Å; N186-R189 PolarHBondContact O-NH1 3.33Å; T187-R189 HydrophobicContact CG2-CB 4.49Å
190	F	25	Very low	26.9	Very low	130 Å²	130	129.3 Å²	129.3	57%	0.57	67%	0.666	S	S	*	*			cis	-141.7	-122.5	0.9	-133.4	-34	0	0	0	107.8	Y192	F190-Y192 HydrophobicContact CB-CD2 4.47Å; F190-Y192 HydrophobicContact CD1-CD2 4.32Å; F190-Y192 HydrophobicContact CD2-CD2 4.17Å; F190-Y192 AromaticContact CD2-CE2 3.89Å; F190-Y192 HydrophobicContact CD2-CE2 3.89Å; F190-Y192 HydrophobicContact CE2-CE2 4.22Å; F190-Y192 HydrophobicContact CG-CD2 4.06Å; F190-Y192 HydrophobicContact CG-CE2 4.24Å
191	P	25	Very low	26.9	Very low	27 Å²	27	131.7 Å²	131.7	18%	0.175	68%	0.678	C	S	.	*			cis	-110.1	-176.8	-43.5	-3.6	25.2	0	0	0	108.7	K11 P12 K13	K11-P191 CarbonylContact C-O 3.49Å; K11-P191 CarbonylContact O-C 3.59Å; P12-P191 CarbonylContact C-O 3.52Å; P12-P191 VanDerWaalsContact CA-O 3.3Å; P12-P191 WeakPolarHBondContact CA-O 3.12Å; P12-P191 CarbonylContact O-C 3.56Å; P12-P191 WeakPolarHBondContact O-CB 3.23Å; P12-P191 WeakPolarHBondContact O-CD 3.35Å; K13-P191 VanDerWaalsContact C-CD 3.4Å; K13-P191 HydrophobicContact CB-CB 4.29Å; K13-P191 HydrophobicContact CB-CG 3.74Å; K13-P191 WeakPolarHBondContact O-CD 3.38Å; K13-P191 WeakPolarHBondContact O-CG 3.3Å
192	Y	25.2	Very low	26.6	Very low	143 Å²	143	131.7 Å²	131.7	56%	0.561	68%	0.677	S	S	*	*			cis	-163.6	156.8	-19.2	-126.1	-139.1	0	0	0	107.6	K11 P12 F190	K11-Y192 PolarHBondContact O-N 2.78Å; P12-Y192 WeakPolarHBondContact CD-O 3.49Å; P12-Y192 PolarHBondContact O-N 3.08Å; F190-Y192 HydrophobicContact CB-CD2 4.47Å; F190-Y192 HydrophobicContact CD1-CD2 4.32Å; F190-Y192 HydrophobicContact CD2-CD2 4.17Å; F190-Y192 AromaticContact CD2-CE2 3.89Å; F190-Y192 HydrophobicContact CD2-CE2 3.89Å; F190-Y192 HydrophobicContact CE2-CE2 4.22Å; F190-Y192 HydrophobicContact CG-CD2 4.06Å; F190-Y192 HydrophobicContact CG-CE2 4.24Å
193	N	28.8	Very low	26.4	Very low	138 Å²	138	127.9 Å²	127.9	74%	0.738	67%	0.672	S	S	*	*			trans	75.9	115	170.3	-48.8	-15.5	0	0	0	115.9
194	G	28.5	Very low	26.4	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	70%	0.695	S	S	*	*			cis	165.8	162.6	-7.9	0	0	0	0	0	113.8
195	K	29.9	Very low	26.4	Very low	212 Å²	212	137.5 Å²	137.5	92%	0.922	70%	0.696	S	S	*	*			trans	69.2	103.6	165.4	-59.4	-172	175.4	-173.4	0	118.5
196	A	25.1	Very low	25.9	Very low	90 Å²	90	134.9 Å²	134.9	74%	0.744	70%	0.697	S	S	*	*			trans	-78.5	166.3	146.8	0	0	0	0	0	110.3
197	P	27.1	Very low	26.3	Very low	114 Å²	114	134.5 Å²	134.5	74%	0.74	70%	0.699	S	S	*	*				-127.3	152.1	93.6	36.7	-29.1	0	0	0	111.8
198	K	24.2	Very low	26.4	Very low	204 Å²	204	134.1 Å²	134.1	89%	0.887	71%	0.713	S	S	*	*				60.3	68.7	57.4	-87.6	-161.9	176.6	-173.7	0	114.6
199	V	26.6	Very low	26.2	Very low	123 Å²	123	130 Å²	130	75%	0.745	70%	0.704	S	S	*	*			trans	-144.9	125.2	150.9	-174.2	0	0	0	0	109.9
200	K	25.3	Very low	26.2	Very low	184 Å²	184	132.2 Å²	132.2	80%	0.8	72%	0.724	S	S	*	*			trans	41.1	134.1	159.2	-60.9	176.3	-179.4	-178.1	0	121.8
201	L	24.7	Very low	26.4	Very low	167 Å²	167	132.6 Å²	132.6	87%	0.874	73%	0.732	S	S	*	*	S	Bend	trans	-82.6	151.8	156.7	-99.5	67.7	0	0	0	108.5
202	I	23.5	Very low	26.6	Very low	148 Å²	148	138.5 Å²	138.5	76%	0.759	76%	0.762	S	S	*	*	S	Bend	trans	82.4	148.1	-160.9	-53.1	167.9	0	0	0	110.4
203	D	23.3	Very low	26.9	Very low	119 Å²	119	135.7 Å²	135.7	64%	0.636	77%	0.768	S	S	*	*			trans	71.3	147.2	-165.8	-33.9	-39.3	0	0	0	113.9
204	Y	23.3	Very low	26.9	Very low	192 Å²	192	137 Å²	137	75%	0.753	77%	0.767	S	S	*	*			cis	-144.9	145.1	17.7	-112.7	-73.6	0	0	0	111.9
205	F	26.7	Very low	26.9	Very low	200 Å²	200	140.6 Å²	140.6	88%	0.877	77%	0.765	S	S	*	*	S	Bend	trans	-60.5	178.7	151.8	-87.2	-124.4	0	0	0	109.7	P207	F205-P207 VanDerWaalsContact O-N 3.15Å
206	A	27.7	Very low	26.8	Very low	100 Å²	100	136.8 Å²	136.8	83%	0.826	76%	0.755	S	S	*	*	S	Bend	trans	-52.6	125.8	160.9	0	0	0	0	0	108.4
207	P	33.2	Very low	26.9	Very low	82 Å²	82	140.7 Å²	140.7	53%	0.532	76%	0.76	S	S	.	*				-145.5	156.4	76.5	37.6	-20.3	0	0	0	115.9	F205	F205-P207 VanDerWaalsContact O-N 3.15Å
208	G	26.6	Very low	26.8	Very low	80 Å²	80	139.2 Å²	139.2	83%	0.825	76%	0.757	S	S	*	*			trans	-98.9	112.5	139.7	0	0	0	0	0	106.2
209	C	24.6	Very low	26.8	Very low	106 Å²	106	139.3 Å²	139.3	72%	0.716	76%	0.758	S	S	*	*			trans	-66.4	136.6	168.6	-61.2	0	0	0	0	108.4
210	D	26.8	Very low	26.7	Very low	147 Å²	147	142.9 Å²	142.9	79%	0.786	77%	0.767	S	S	*	*				-138.6	147	114.7	-82.5	-36.9	0	0	0	106.6
211	D	29	Very low	27.2	Very low	138 Å²	138	138.4 Å²	138.4	74%	0.738	76%	0.764	S	S	*	*	S	Bend	trans	70.5	92.4	166	-49.2	-19.1	0	0	0	119.2
212	D	28.9	Very low	27.2	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	76%	0.762	S	S	*	*				83.9	97.9	122.7	-62.7	-14.5	0	0	0	122.5
213	A	30.3	Very low	27.3	Very low	84 Å²	84	143 Å²	143	69%	0.694	77%	0.767	S	S	*	*				105.9	127.6	107.6	0	0	0	0	0	119.7
214	K	29.4	Very low	27.4	Very low	165 Å²	165	141 Å²	141	72%	0.717	78%	0.775	S	S	*	*			trans	73.5	152.3	158.4	-60.2	168.9	158.1	-80.9	0	117.5
215	E	28	Very low	27.5	Very low	147 Å²	147	134.8 Å²	134.8	69%	0.687	77%	0.769	S	S	*	*			cis	-170.4	137.7	-16	-105.3	152.7	177.4	0	0	105.5
216	D	27.9	Very low	27.5	Very low	132 Å²	132	133 Å²	133	71%	0.706	76%	0.763	S	S	*	*			cis	-163	-167.6	-25.2	-144	-76.1	0	0	0	110
217	M	26.8	Very low	27.5	Very low	171 Å²	171	134.1 Å²	134.1	84%	0.842	76%	0.756	S	S	*	*			trans	65.4	105.4	174	-57.5	176.7	-81.3	0	0	116.4
218	A	26.1	Very low	27.3	Very low	84 Å²	84	134.8 Å²	134.8	69%	0.694	75%	0.753	S	S	*	*			cis	74.7	111.7	17	0	0	0	0	0	117.2
219	F	23.7	Very low	27.3	Very low	205 Å²	205	141.9 Å²	141.9	90%	0.899	76%	0.757	S	S	*	*			trans	50.8	114.8	154.2	-87	-101.2	0	0	0	120.4
220	E	24.4	Very low	27.3	Very low	199 Å²	199	143.8 Å²	143.8	93%	0.93	76%	0.759	S	S	*	*			trans	178.7	24.8	135.1	-103.5	176.7	-165.2	0	0	116
221	A	35.6	Very low	27.3	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	76%	0.757	S	S	*	*			trans	-151.5	127.6	-179.5	0	0	0	0	0	113.8
222	F	25.7	Very low	27.3	Very low	190 Å²	190	139.2 Å²	139.2	83%	0.833	76%	0.761	S	S	*	*	S	Bend	cis	56.5	105.5	-5.1	-87	-87.5	0	0	0	118.7
223	Y	25.4	Very low	27.1	Very low	221 Å²	221	141.1 Å²	141.1	87%	0.867	76%	0.758	S	S	*	*	S	Bend	trans	63.4	146.6	176.4	-76.9	-97.8	0	0	0	116.5
224	G	26	Very low	27	Very low	78 Å²	78	145.7 Å²	145.7	80%	0.804	77%	0.765	S	S	*	*			trans	83.7	121.1	147.2	0	0	0	0	0	118.2
225	G	25.5	Very low	26.8	Very low	61 Å²	61	148.8 Å²	148.8	63%	0.629	77%	0.772	S	S	*	*			trans	97.4	132	142.4	0	0	0	0	0	116.8
226	H	26.1	Very low	26.9	Very low	161 Å²	161	148.7 Å²	148.7	75%	0.745	78%	0.775	S	S	*	*				65	110.3	58.9	-72.5	-74.4	0	0	0	109.1
227	D	28.1	Very low	27.1	Very low	125 Å²	125	145.1 Å²	145.1	67%	0.668	76%	0.76	S	S	*	*			cis	-173.9	174.9	48.6	-88.3	-28.5	0	0	0	110.3
228	I	27.5	Very low	27.3	Very low	95 Å²	95	143 Å²	143	49%	0.487	75%	0.752	S	S	.	*			cis	-158.3	139	-14	-110	160.2	0	0	0	108.5	L230	I228-L230 HydrophobicContact CB-CD1 4.48Å; I228-L230 HydrophobicContact CD1-CD1 3.81Å; I228-L230 HydrophobicContact CD1-CG 4.43Å; I228-L230 HydrophobicContact CG1-CD1 3.8Å; I228-L230 HydrophobicContact CG1-CG 3.95Å; I228-L230 HydrophobicContact CG2-CB 4.27Å; I228-L230 HydrophobicContact CG2-CD1 3.82Å; I228-L230 HydrophobicContact CG2-CG 4.27Å
229	Y	28.3	Very low	28	Very low	229 Å²	229	144.1 Å²	144.1	90%	0.898	75%	0.746	S	S	*	*			trans	-178.4	54.8	142.1	-98.6	-66.9	0	0	0	105
230	L	24.1	Very low	28.6	Very low	146 Å²	146	137.4 Å²	137.4	76%	0.764	72%	0.72	S	S	*	*				58.9	116.5	90	-105.9	176.4	0	0	0	113.5	I228	I228-L230 HydrophobicContact CB-CD1 4.48Å; I228-L230 HydrophobicContact CD1-CD1 3.81Å; I228-L230 HydrophobicContact CD1-CG 4.43Å; I228-L230 HydrophobicContact CG1-CD1 3.8Å; I228-L230 HydrophobicContact CG1-CG 3.95Å; I228-L230 HydrophobicContact CG2-CB 4.27Å; I228-L230 HydrophobicContact CG2-CD1 3.82Å; I228-L230 HydrophobicContact CG2-CG 4.27Å
231	G	26.9	Very low	28.8	Very low	72 Å²	72	134 Å²	134	74%	0.742	71%	0.706	S	S	*	*			trans	103.3	109.9	-178.8	0	0	0	0	0	112.3
232	S	28.9	Very low	28.6	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	69%	0.693	S	S	*	*			cis	-158.3	138.3	-0.8	45.4	0	0	0	0	110.1
233	Y	23.3	Very low	28.9	Very low	192 Å²	192	133.7 Å²	133.7	75%	0.753	68%	0.683	S	S	*	*			trans	-69.6	146	175.2	-77.9	-110.4	0	0	0	111.7
234	H	28.3	Very low	29.1	Very low	179 Å²	179	127.4 Å²	127.4	83%	0.829	67%	0.67	S	S	*	*			trans	-153.7	109.6	133.9	-105.1	-68.7	0	0	0	112.1
235	W	26.6	Very low	29.3	Very low	231 Å²	231	129.8 Å²	129.8	88%	0.875	66%	0.664	S	S	*	*			trans	1.9	109.1	154.9	-61.4	74.9	0	0	0	118.2
236	I	29	Very low	29.5	Very low	145 Å²	145	136.5 Å²	136.5	74%	0.744	67%	0.67	S	S	*	*			trans	-96.5	145	155.4	-68.7	176.6	0	0	0	108.2	D240	I236-D240 HydrophobicContact CG2-CB 3.67Å
237	S	33.7	Very low	29.9	Very low	57 Å²	57	136.2 Å²	136.2	40%	0.399	67%	0.669	S	S	.	*			trans	-80.3	160.5	-161.5	82.4	0	0	0	0	114.4	D239 D240 M241	S237-D239 PolarHBondContact O-N 3.43Å; S237-D239 VanDerWaalsContact O-N 3.15Å; S237-D239 PolarHBondContact OG-N 2.73Å; S237-D240 WeakPolarHBondContact CB-OD2 3.44Å; S237-D240 PolarHBondContact N-OD2 2.84Å; S237-D240 PolarHBondContact O-N 2.89Å; S237-D240 PolarHBondContact OG-N 3.03Å; S237-D240 PolarHBondContact OG-OD2 3.43Å; S237-M241 PolarHBondContact O-N 2.86Å
238	N	30.4	Very low	29.9	Very low	127 Å²	127	134 Å²	134	68%	0.679	67%	0.668	S	S	*	*	H	α-helix	trans	-61.9	-16.6	172.3	-107.9	-33.3	0	0	0	113.5	K242	N238-K242 VanDerWaalsContact O-CG 3.3Å; N238-K242 WeakPolarHBondContact O-CG 3.33Å; N238-K242 PolarHBondContact O-N 3.26Å
239	D	40.7	Very low	29.9	Very low	106 Å²	106	135 Å²	135	57%	0.567	68%	0.678	S	S	*	*	H	α-helix	trans	-86.2	-27.2	177.9	-70.1	-37.6	0	0	0	112.4	S237 K242 R243	S237-D239 PolarHBondContact O-N 3.43Å; S237-D239 VanDerWaalsContact O-N 3.15Å; S237-D239 PolarHBondContact OG-N 2.73Å; D239-K242 CarbonylContact O-C 3.55Å; D239-K242 PolarHBondContact O-N 3.22Å; D239-K242 IonicContact OD1-NZ 2.81Å; D239-R243 PolarHBondContact O-N 3.03Å
240	D	36.8	Very low	30	Very low	65 Å²	65	131.7 Å²	131.7	35%	0.348	67%	0.674	S	S	.	*	H	α-helix	trans	-72.6	-38.5	173.5	-57.5	-59	0	0	0	111.3	I236 S237 K242 R243 C244	I236-D240 HydrophobicContact CG2-CB 3.67Å; S237-D240 WeakPolarHBondContact CB-OD2 3.44Å; S237-D240 PolarHBondContact N-OD2 2.84Å; S237-D240 PolarHBondContact O-N 2.89Å; S237-D240 PolarHBondContact OG-N 3.03Å; S237-D240 PolarHBondContact OG-OD2 3.43Å; D240-K242 VanDerWaalsContact C-N 3.3Å; D240-K242 PolarHBondContact O-N 3.42Å; D240-R243 WeakPolarHBondContact O-CA 3.44Å; D240-R243 VanDerWaalsContact O-CB 3.24Å; D240-R243 WeakPolarHBondContact O-CB 3.45Å; D240-R243 PolarHBondContact O-N 3.05Å; D240-C244 PolarHBondContact O-N 3.15Å
241	M	27.7	Very low	30.3	Very low	128 Å²	128	129.2 Å²	129.2	63%	0.631	67%	0.669	S	S	*	*	H	α-helix	trans	-65.6	-34.5	171.9	-153.1	179.2	-147.5	0	0	111.7	S237 R243 L245	S237-M241 PolarHBondContact O-N 2.86Å; M241-R243 PolarHBondContact O-N 3.11Å; M241-L245 HydrophobicContact CG-CD1 4.38Å; M241-L245 VanDerWaalsContact O-CB 3.3Å; M241-L245 WeakPolarHBondContact O-CB 3.31Å; M241-L245 WeakPolarHBondContact O-CG 3.38Å; M241-L245 PolarHBondContact O-N 3.48Å
242	K	30.7	Very low	30.3	Very low	108 Å²	108	133.4 Å²	133.4	47%	0.47	67%	0.67	S	S	.	*	H	α-helix	trans	-72.5	-10.4	169.4	-77	173.7	-172.9	164.5	0	114.1	N238 D239 D240 R246	N238-K242 VanDerWaalsContact O-CG 3.3Å; N238-K242 WeakPolarHBondContact O-CG 3.33Å; N238-K242 PolarHBondContact O-N 3.26Å; D239-K242 CarbonylContact O-C 3.55Å; D239-K242 PolarHBondContact O-N 3.22Å; D239-K242 IonicContact OD1-NZ 2.81Å; D240-K242 VanDerWaalsContact C-N 3.3Å; D240-K242 PolarHBondContact O-N 3.42Å; K242-R246 WeakPolarHBondContact O-CD 3.29Å; K242-R246 VanDerWaalsContact O-CG 3.25Å; K242-R246 WeakPolarHBondContact O-CG 3.48Å; K242-R246 PolarHBondContact O-NE 3.06Å
243	R	32.6	Very low	30.5	Very low	164 Å²	164	133.8 Å²	133.8	62%	0.619	66%	0.659	S	S	*	*	H	α-helix	trans	-87.3	-54.3	173.4	-139.5	170	-175.5	162.1	-0.3	109.4	D239 D240 M241 L245 R246 E247	D239-R243 PolarHBondContact O-N 3.03Å; D240-R243 WeakPolarHBondContact O-CA 3.44Å; D240-R243 VanDerWaalsContact O-CB 3.24Å; D240-R243 WeakPolarHBondContact O-CB 3.45Å; D240-R243 PolarHBondContact O-N 3.05Å; M241-R243 PolarHBondContact O-N 3.11Å; R243-L245 VanDerWaalsContact C-N 3.29Å; R243-L245 PolarHBondContact O-N 3.05Å; R243-R246 WeakPolarHBondContact O-CB 3.5Å; R243-R246 PolarHBondContact O-N 3.25Å; R243-E247 PolarHBondContact O-N 3.44Å
244	C	30.2	Very low	31	Very low	90 Å²	90	129.4 Å²	129.4	61%	0.608	64%	0.641	S	S	*	*	H	α-helix	trans	-59	-36.1	174	-65.6	0	0	0	0	113.3	D240 R246 E247 A248	D240-C244 PolarHBondContact O-N 3.15Å; C244-R246 VanDerWaalsContact C-N 3.28Å; C244-R246 PolarHBondContact O-N 3.21Å; C244-E247 PolarHBondContact O-N 3.34Å; C244-A248 WeakPolarHBondContact O-CB 3.03Å; C244-A248 PolarHBondContact O-N 2.96Å
245	L	29.1	Very low	31.1	Very low	127 Å²	127	127.3 Å²	127.3	67%	0.665	64%	0.636	S	S	*	*	H	α-helix	trans	-74.6	-10.4	174.4	-77.4	166.3	0	0	0	114.5	M241 R243	M241-L245 HydrophobicContact CG-CD1 4.38Å; M241-L245 VanDerWaalsContact O-CB 3.3Å; M241-L245 WeakPolarHBondContact O-CB 3.31Å; M241-L245 WeakPolarHBondContact O-CG 3.38Å; M241-L245 PolarHBondContact O-N 3.48Å; R243-L245 VanDerWaalsContact C-N 3.29Å; R243-L245 PolarHBondContact O-N 3.05Å
246	R	31.6	Very low	31.3	Very low	203 Å²	203	124.7 Å²	124.7	77%	0.766	63%	0.631	S	S	*	*	H	α-helix	trans	-89.3	-18.3	171	-79.6	-179	-137.8	-154.5	4.6	113.6	K242 R243 C244	K242-R246 WeakPolarHBondContact O-CD 3.29Å; K242-R246 VanDerWaalsContact O-CG 3.25Å; K242-R246 WeakPolarHBondContact O-CG 3.48Å; K242-R246 PolarHBondContact O-NE 3.06Å; R243-R246 WeakPolarHBondContact O-CB 3.5Å; R243-R246 PolarHBondContact O-N 3.25Å; C244-R246 VanDerWaalsContact C-N 3.28Å; C244-R246 PolarHBondContact O-N 3.21Å
247	E	32.7	Very low	31.5	Very low	154 Å²	154	119.6 Å²	119.6	72%	0.72	61%	0.608	S	S	*	*	H	α-helix	trans	-102	-8.8	-174.4	-71.1	163.3	-169.9	0	0	113	R243 C244	R243-E247 PolarHBondContact O-N 3.44Å; C244-E247 PolarHBondContact O-N 3.34Å
248	A	28.5	Very low	31.4	Very low	78 Å²	78	123.5 Å²	123.5	65%	0.645	62%	0.618	S	S	*	*	S	Bend	trans	-99.7	18.9	-169.6	0	0	0	0	0	116.6	C244	C244-A248 WeakPolarHBondContact O-CB 3.03Å; C244-A248 PolarHBondContact O-N 2.96Å
249	V	28.6	Very low	31.5	Very low	116 Å²	116	120.1 Å²	120.1	70%	0.703	61%	0.608	S	S	*	*			trans	-135.7	96.9	-178.1	-173.8	0	0	0	0	112.5
250	I	30.4	Very low	30.9	Very low	160 Å²	160	121.6 Å²	121.6	82%	0.821	61%	0.609	S	S	*	*			trans	-176.9	101.3	135.3	-88.1	146.3	0	0	0	108.6
251	S	30.4	Very low	30.8	Very low	94 Å²	94	123.1 Å²	123.1	66%	0.657	61%	0.614	S	S	*	*			trans	-154.3	117	146.7	58.2	0	0	0	0	107.6	E253	S251-E253 PolarHBondContact O-N 2.72Å
252	Q	27.2	Very low	30.9	Very low	161 Å²	161	120.7 Å²	120.7	75%	0.752	60%	0.603	S	S	*	*	H	α-helix	trans	-79.7	-14.4	-154.7	-75.2	-178.3	-40.2	0	0	115.6
253	E	32.4	Very low	31	Very low	125 Å²	125	119.5 Å²	119.5	58%	0.584	61%	0.609	S	S	*	*	H	α-helix	trans	-86.5	-14.8	-171.2	-73.2	179.1	95.7	0	0	115.8	S251 P1685	S251-E253 PolarHBondContact O-N 2.72Å; E253-P1685 HydrophobicContact CB-CB 4.43Å; E253-P1685 VanDerWaalsContact OE2-CD 3.25Å; E253-P1685 WeakPolarHBondContact OE2-CD 3.3Å; E253-P1685 WeakPolarHBondContact OE2-CG 3.2Å
254	Y	33.5	Very low	31	Very low	99 Å²	99	118.5 Å²	118.5	39%	0.388	61%	0.609	S	S	.	*	H	α-helix	trans	-84.3	-37.5	176.3	-94	-91.4	0	0	0	113	F256 S257 F258 P1685 W1686 K1687	Y254-F256 VanDerWaalsContact C-N 3.34Å; Y254-F256 PolarHBondContact O-N 3.25Å; Y254-S257 PolarHBondContact O-N 3.1Å; Y254-S257 VanDerWaalsContact O-N 3.13Å; Y254-F258 VanDerWaalsContact O-CB 3.3Å; Y254-F258 WeakPolarHBondContact O-CB 3.47Å; Y254-F258 PolarHBondContact O-N 3.42Å; Y254-P1685 HydrophobicContact CE2-CB 4.37Å; Y254-W1686 HydrophobicContact CE2-CB 4.15Å; Y254-K1687 HydrophobicContact CE2-CG 4.35Å
255	L	31.2	Very low	31.2	Very low	136 Å²	136	122.1 Å²	122.1	71%	0.712	62%	0.617	S	S	*	*	H	α-helix	trans	-62	-40.5	-177.5	-136.5	95.2	0	0	0	112.1	S257 F258 A259	L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 2.77Å; L255-F258 PolarHBondContact O-N 2.86Å; L255-A259 WeakPolarHBondContact O-CB 3.37Å; L255-A259 PolarHBondContact O-N 2.88Å
256	F	30.9	Very low	31.3	Very low	176 Å²	176	122 Å²	122	77%	0.772	62%	0.615	S	S	*	*	H	α-helix	trans	-71	-19.6	179.1	-119.7	-81.6	0	0	0	114.1	Y254 K260	Y254-F256 VanDerWaalsContact C-N 3.34Å; Y254-F256 PolarHBondContact O-N 3.25Å; F256-K260 WeakPolarHBondContact O-CB 3.15Å
257	S	32.5	Very low	31.2	Very low	38 Å²	38	119.6 Å²	119.6	27%	0.266	62%	0.617	S	S	.	*	H	α-helix	trans	-90	-39	172	-170.7	0	0	0	0	111.6	Y254 L255 K260 E261 K1687	Y254-S257 PolarHBondContact O-N 3.1Å; Y254-S257 VanDerWaalsContact O-N 3.13Å; L255-S257 VanDerWaalsContact C-N 3.28Å; L255-S257 PolarHBondContact O-N 2.77Å; S257-K260 PolarHBondContact O-N 3.45Å; S257-E261 PolarHBondContact O-N 3.29Å; S257-K1687 PolarHBondContact OG-NZ 2.97Å
258	F	31.2	Very low	31.2	Very low	138 Å²	138	117.7 Å²	117.7	61%	0.605	62%	0.618	S	S	*	*	H	α-helix	trans	-69.9	-42.6	-179.4	-162.9	-117.4	0	0	0	110.8	Y254 L255 K260 E261 I262	Y254-F258 VanDerWaalsContact O-CB 3.3Å; Y254-F258 WeakPolarHBondContact O-CB 3.47Å; Y254-F258 PolarHBondContact O-N 3.42Å; L255-F258 PolarHBondContact O-N 2.86Å; F258-K260 VanDerWaalsContact C-N 3.27Å; F258-K260 PolarHBondContact O-N 3.17Å; F258-E261 PolarHBondContact O-N 3.23Å; F258-I262 HydrophobicContact CD1-CD1 3.6Å; F258-I262 HydrophobicContact CE1-CD1 3.41Å; F258-I262 VanDerWaalsContact CE1-CD1 3.41Å; F258-I262 HydrophobicContact CE2-CD1 4.34Å; F258-I262 HydrophobicContact CG-CD1 4.16Å; F258-I262 HydrophobicContact CZ-CD1 3.81Å; F258-I262 WeakPolarHBondContact O-CB 3.36Å; F258-I262 WeakPolarHBondContact O-CG1 3.36Å; F258-I262 PolarHBondContact O-N 2.97Å
259	A	32.5	Very low	31.2	Very low	57 Å²	57	119.7 Å²	119.7	47%	0.471	63%	0.627	S	S	.	*	H	α-helix	trans	-63.5	-30.3	170.3	0	0	0	0	0	112.8	L255 S263	L255-A259 WeakPolarHBondContact O-CB 3.37Å; L255-A259 PolarHBondContact O-N 2.88Å; A259-S263 WeakPolarHBondContact O-CB 3.47Å; A259-S263 PolarHBondContact O-N 3.22Å; A259-S263 PolarHBondContact O-OG 2.99Å
260	K	29.1	Very low	31.5	Very low	137 Å²	137	119.4 Å²	119.4	60%	0.596	63%	0.63	S	S	*	*	H	α-helix	trans	-81.3	-17.8	178	-165.2	169.7	-171.3	170.8	0	114.1	F256 S257 F258 S263 K264	F256-K260 WeakPolarHBondContact O-CB 3.15Å; S257-K260 PolarHBondContact O-N 3.45Å; F258-K260 VanDerWaalsContact C-N 3.27Å; F258-K260 PolarHBondContact O-N 3.17Å; K260-S263 WeakPolarHBondContact CA-OG 3.32Å; K260-K264 WeakPolarHBondContact O-CG 3.43Å
261	E	33.8	Very low	31.6	Very low	96 Å²	96	118.4 Å²	118.4	45%	0.449	63%	0.626	S	S	.	*	H	α-helix	trans	-91.2	-38	168.9	-119.8	62.6	-116.2	0	0	111.6	S257 F258 K264	S257-E261 PolarHBondContact O-N 3.29Å; F258-E261 PolarHBondContact O-N 3.23Å; E261-K264 WeakPolarHBondContact O-CB 3.32Å; E261-K264 PolarHBondContact O-N 3.34Å; E261-K264 IonicContact OE1-NZ 3.56Å; E261-K264 PolarHBondContact OE1-NZ 2.94Å
262	I	31	Very low	31.6	Very low	77 Å²	77	119.4 Å²	119.4	40%	0.395	62%	0.624	S	S	.	*	H	α-helix	trans	-68.7	-41	176.2	-71.2	173.8	0	0	0	111.9	F258 K264 Q265 I266	F258-I262 HydrophobicContact CD1-CD1 3.6Å; F258-I262 HydrophobicContact CE1-CD1 3.41Å; F258-I262 VanDerWaalsContact CE1-CD1 3.41Å; F258-I262 HydrophobicContact CE2-CD1 4.34Å; F258-I262 HydrophobicContact CG-CD1 4.16Å; F258-I262 HydrophobicContact CZ-CD1 3.81Å; F258-I262 WeakPolarHBondContact O-CB 3.36Å; F258-I262 WeakPolarHBondContact O-CG1 3.36Å; F258-I262 PolarHBondContact O-N 2.97Å; I262-K264 PolarHBondContact O-N 3.26Å; I262-K264 VanDerWaalsContact O-N 3.1Å; I262-Q265 PolarHBondContact O-N 2.84Å; I262-Q265 VanDerWaalsContact O-N 3.08Å; I262-I266 HydrophobicContact CG2-CD1 4.45Å; I262-I266 PolarHBondContact O-N 3.2Å
263	S	32.4	Very low	31.7	Very low	84 Å²	84	121.4 Å²	121.4	59%	0.587	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-12.1	174.3	54.5	0	0	0	0	114.3	A259 K260	A259-S263 WeakPolarHBondContact O-CB 3.47Å; A259-S263 PolarHBondContact O-N 3.22Å; A259-S263 PolarHBondContact O-OG 2.99Å; K260-S263 WeakPolarHBondContact CA-OG 3.32Å
264	K	32.3	Very low	31.7	Very low	143 Å²	143	122.9 Å²	122.9	62%	0.622	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-9.1	173.5	-76.1	177.1	-175.6	166	0	114.9	K260 E261 I262	K260-K264 WeakPolarHBondContact O-CG 3.43Å; E261-K264 WeakPolarHBondContact O-CB 3.32Å; E261-K264 PolarHBondContact O-N 3.34Å; E261-K264 IonicContact OE1-NZ 3.56Å; E261-K264 PolarHBondContact OE1-NZ 2.94Å; I262-K264 PolarHBondContact O-N 3.26Å; I262-K264 VanDerWaalsContact O-N 3.1Å
265	Q	33.3	Very low	31.9	Very low	166 Å²	166	123.7 Å²	123.7	78%	0.776	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.8	-16.7	-168.8	-71.1	-167.6	-21.9	0	0	116.1	I262	I262-Q265 PolarHBondContact O-N 2.84Å; I262-Q265 VanDerWaalsContact O-N 3.08Å
266	I	32.5	Very low	32	Very low	123 Å²	123	121 Å²	121	63%	0.631	63%	0.629	S	S	*	*	S	Bend	trans	-123.6	-11.6	-164.3	-62.6	-174.8	0	0	0	116	I262	I262-I266 HydrophobicContact CG2-CD1 4.45Å; I262-I266 PolarHBondContact O-N 3.2Å
267	L	29.9	Very low	32.1	Very low	154 Å²	154	117.8 Å²	117.8	81%	0.806	62%	0.619	S	S	*	*			trans	-115.8	111.2	-176.9	-87.8	152.9	0	0	0	113.7
268	P	32.2	Very low	32.4	Very low	113 Å²	113	123 Å²	123	73%	0.734	64%	0.644	S	S	*	*			trans	-69.8	151.3	173.6	-17.8	31.9	0	0	0	113.4	S270	P268-S270 PolarHBondContact O-N 3.04Å
269	S	28.6	Very low	32.5	Very low	120 Å²	120	123.8 Å²	123.8	84%	0.839	65%	0.654	S	S	*	*	S	Bend	trans	-67.2	114.9	176.8	51.3	0	0	0	0	113.3
270	S	34.1	Very low	32.6	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	66%	0.656	S	S	*	*			trans	-179.8	-12.5	154.3	36.3	0	0	0	0	117.4	P268	P268-S270 PolarHBondContact O-N 3.04Å
271	L	32.3	Very low	32.7	Very low	139 Å²	139	124.1 Å²	124.1	73%	0.728	65%	0.654	S	S	*	*			trans	-93.6	132.2	-174.1	-82.7	149.7	0	0	0	114
272	N	31.2	Very low	32.6	Very low	114 Å²	114	125.6 Å²	125.6	61%	0.61	67%	0.671	S	S	*	*			trans	-82.2	146.6	-177.3	-84.1	-17.9	0	0	0	113	E274 Q275	N272-E274 VanDerWaalsContact C-N 3.27Å; N272-E274 PolarHBondContact O-N 2.76Å; N272-Q275 PolarHBondContact O-N 3.49Å; N272-Q275 VanDerWaalsContact O-N 3.16Å
273	Y	28.2	Very low	32.8	Very low	203 Å²	203	126.2 Å²	126.2	80%	0.796	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-29.6	-173.8	-159	-95.9	0	0	0	114.3
274	E	34.1	Very low	32.9	Very low	156 Å²	156	126.4 Å²	126.4	73%	0.729	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-38	177.7	-68.8	176.5	143	0	0	112.7	N272 V276 L277	N272-E274 VanDerWaalsContact C-N 3.27Å; N272-E274 PolarHBondContact O-N 2.76Å; E274-V276 PolarHBondContact O-N 3.07Å; E274-L277 WeakPolarHBondContact O-CB 3.41Å; E274-L277 PolarHBondContact O-N 3.47Å; E274-L277 VanDerWaalsContact O-N 3.08Å
275	Q	37.2	Very low	33	Very low	116 Å²	116	123.8 Å²	123.8	54%	0.542	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.7	-14.9	178.1	-69.1	178.4	-30.2	0	0	113.2	N272	N272-Q275 PolarHBondContact O-N 3.49Å; N272-Q275 VanDerWaalsContact O-N 3.16Å
276	V	33	Very low	33	Very low	80 Å²	80	121.7 Å²	121.7	49%	0.485	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.1	-20.7	173.2	179.3	0	0	0	0	111.4	E274	E274-V276 PolarHBondContact O-N 3.07Å
277	L	32.7	Very low	33	Very low	108 Å²	108	118.8 Å²	118.8	57%	0.565	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-32.3	177.8	-73	161.8	0	0	0	112.5	E274 L279 I280	E274-L277 WeakPolarHBondContact O-CB 3.41Å; E274-L277 PolarHBondContact O-N 3.47Å; E274-L277 VanDerWaalsContact O-N 3.08Å; L277-L279 PolarHBondContact O-N 3.06Å; L277-I280 PolarHBondContact O-N 2.9Å
278	D	38.4	Very low	33.1	Very low	148 Å²	148	120.1 Å²	120.1	79%	0.791	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-15.6	179.4	-71.6	-24.8	0	0	0	114.2
279	L	34.2	Very low	33.1	Very low	154 Å²	154	121.9 Å²	121.9	81%	0.806	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-0.5	179.1	-82.7	160.9	0	0	0	113.9	L277	L277-L279 PolarHBondContact O-N 3.06Å
280	I	34.9	Very low	33.4	Very low	101 Å²	101	119.9 Å²	119.9	52%	0.518	62%	0.622	S	S	.	*	S	Bend	trans	-104.5	89.9	-176.2	-55.8	179.4	0	0	0	109.5	L277	L277-I280 PolarHBondContact O-N 2.9Å
281	D	31.4	Very low	33.2	Very low	101 Å²	101	118.3 Å²	118.3	54%	0.54	61%	0.608	S	S	.	*			trans	-53.2	117	-177.7	-168.6	-32.1	0	0	0	112.2	S283	D281-S283 VanDerWaalsContact CG-OG 3.29Å; D281-S283 PolarHBondContact O-N 3.13Å; D281-S283 VanDerWaalsContact O-N 3.09Å; D281-S283 WeakPolarHBondContact OD1-CB 3.46Å; D281-S283 PolarHBondContact OD1-N 3.39Å; D281-S283 VanDerWaalsContact OD1-N 3.12Å; D281-S283 PolarHBondContact OD1-OG 2.89Å
282	P	31.4	Very low	33.1	Very low	126 Å²	126	116.1 Å²	116.1	82%	0.818	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-1.4	-172.7	29.5	-35.9	0	0	0	114.3
283	S	34.2	Very low	33.1	Very low	90 Å²	90	118.1 Å²	118.1	63%	0.629	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-16	-177.7	65.5	0	0	0	0	115	D281	D281-S283 VanDerWaalsContact CG-OG 3.29Å; D281-S283 PolarHBondContact O-N 3.13Å; D281-S283 VanDerWaalsContact O-N 3.09Å; D281-S283 WeakPolarHBondContact OD1-CB 3.46Å; D281-S283 PolarHBondContact OD1-N 3.39Å; D281-S283 VanDerWaalsContact OD1-N 3.12Å; D281-S283 PolarHBondContact OD1-OG 2.89Å
284	N	34.8	Very low	33.2	Very low	88 Å²	88	114.2 Å²	114.2	47%	0.471	59%	0.586	S	S	.	*			trans	-91.7	114.2	-166.6	-157.7	-26.9	0	0	0	113.8	I286 T287 R288	N284-I286 PolarHBondContact O-N 2.88Å; N284-I286 VanDerWaalsContact O-N 3.17Å; N284-I286 PolarHBondContact OD1-N 3.3Å; N284-T287 PolarHBondContact O-N 3.44Å; N284-T287 PolarHBondContact O-OG1 3.36Å; N284-R288 PolarHBondContact O-N 3.07Å
285	V	33.9	Very low	33	Very low	88 Å²	88	113 Å²	113	53%	0.533	58%	0.584	S	S	.	*	H	α-helix	trans	-62.2	-25.7	-175.1	177.8	0	0	0	0	113	R289	V285-R289 HydrophobicContact CG1-CG 4.45Å; V285-R289 WeakPolarHBondContact O-CB 3.38Å; V285-R289 WeakPolarHBondContact O-CG 3.48Å; V285-R289 PolarHBondContact O-N 3.34Å
286	I	33.1	Very low	32.7	Very low	122 Å²	122	112.8 Å²	112.8	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-72.8	-45.2	-178.1	-58.3	177.8	0	0	0	110.7	N284 R288 R289 V290	N284-I286 PolarHBondContact O-N 2.88Å; N284-I286 VanDerWaalsContact O-N 3.17Å; N284-I286 PolarHBondContact OD1-N 3.3Å; I286-R288 PolarHBondContact O-N 3.47Å; I286-R289 PolarHBondContact O-N 3.15Å; I286-V290 HydrophobicContact CG2-CG2 4.44Å; I286-V290 WeakPolarHBondContact O-CB 3.39Å; I286-V290 VanDerWaalsContact O-CG2 3.31Å; I286-V290 WeakPolarHBondContact O-CG2 3.23Å; I286-V290 PolarHBondContact O-N 2.94Å
287	T	32.3	Very low	32.6	Very low	63 Å²	63	114.7 Å²	114.7	39%	0.387	59%	0.586	S	S	.	*	H	α-helix	trans	-63.5	-41.8	176.4	20.2	0	0	0	0	111.3	N284 R289 V290 T291	N284-T287 PolarHBondContact O-N 3.44Å; N284-T287 PolarHBondContact O-OG1 3.36Å; T287-R289 PolarHBondContact O-N 3.03Å; T287-V290 PolarHBondContact O-N 3.44Å; T287-T291 PolarHBondContact O-N 3.46Å; T287-T291 PolarHBondContact O-OG1 2.84Å
288	R	31.9	Very low	32.4	Very low	182 Å²	182	113.5 Å²	113.5	69%	0.687	59%	0.587	S	S	*	*	H	α-helix	trans	-63.7	-39.3	175.7	-160.6	171.4	-174.6	162.8	1.1	112.4	N284 I286 T291 Q292	N284-R288 PolarHBondContact O-N 3.07Å; I286-R288 PolarHBondContact O-N 3.47Å; R288-T291 PolarHBondContact O-OG1 2.93Å; R288-Q292 WeakPolarHBondContact O-CB 3.3Å; R288-Q292 PolarHBondContact O-N 3.21Å
289	R	34.2	Very low	31.9	Very low	150 Å²	150	114.8 Å²	114.8	57%	0.566	59%	0.586	S	S	*	*	H	α-helix	trans	-69.7	-29.7	173.3	-79.1	-180	175	169.7	-0.6	113.6	V285 I286 T287 R293	V285-R289 HydrophobicContact CG1-CG 4.45Å; V285-R289 WeakPolarHBondContact O-CB 3.38Å; V285-R289 WeakPolarHBondContact O-CG 3.48Å; V285-R289 PolarHBondContact O-N 3.34Å; I286-R289 PolarHBondContact O-N 3.15Å; T287-R289 PolarHBondContact O-N 3.03Å; R289-R293 WeakPolarHBondContact O-CB 3.29Å; R289-R293 WeakPolarHBondContact O-CG 3.42Å; R289-R293 PolarHBondContact O-N 3.47Å
290	V	33.4	Very low	31.6	Very low	77 Å²	77	113.5 Å²	113.5	47%	0.467	57%	0.571	S	S	.	*	H	α-helix	trans	-77.5	-44.8	177.1	169.5	0	0	0	0	111	I286 T287 R293 L294	I286-V290 HydrophobicContact CG2-CG2 4.44Å; I286-V290 WeakPolarHBondContact O-CB 3.39Å; I286-V290 VanDerWaalsContact O-CG2 3.31Å; I286-V290 WeakPolarHBondContact O-CG2 3.23Å; I286-V290 PolarHBondContact O-N 2.94Å; T287-V290 PolarHBondContact O-N 3.44Å; V290-R293 PolarHBondContact O-N 3.45Å; V290-L294 HydrophobicContact CG1-CD1 3.87Å; V290-L294 VanDerWaalsContact O-CB 3.31Å; V290-L294 WeakPolarHBondContact O-CB 3.29Å; V290-L294 WeakPolarHBondContact O-CD1 2.9Å; V290-L294 WeakPolarHBondContact O-CG 3.49Å; V290-L294 PolarHBondContact O-N 3.45Å
291	T	30.4	Very low	31.2	Very low	79 Å²	79	112.4 Å²	112.4	49%	0.485	58%	0.577	S	S	.	*	H	α-helix	trans	-68.8	-37.8	175.5	52.3	0	0	0	0	112.5	T287 R288 L294 L295	T287-T291 PolarHBondContact O-N 3.46Å; T287-T291 PolarHBondContact O-OG1 2.84Å; R288-T291 PolarHBondContact O-OG1 2.93Å; T291-L294 PolarHBondContact O-N 3.28Å; T291-L295 PolarHBondContact O-N 2.78Å; T291-L295 VanDerWaalsContact O-N 3.11Å
292	Q	31.2	Very low	30.8	Very low	93 Å²	93	113.6 Å²	113.6	44%	0.435	59%	0.588	S	S	.	*	H	α-helix	trans	-69.4	-40.2	175.5	-169.1	165.7	-1.2	0	0	111.7	R288 L294 L295 E296	R288-Q292 WeakPolarHBondContact O-CB 3.3Å; R288-Q292 PolarHBondContact O-N 3.21Å; Q292-L294 VanDerWaalsContact C-N 3.33Å; Q292-L294 PolarHBondContact O-N 2.97Å; Q292-L295 PolarHBondContact O-N 3.26Å; Q292-E296 VanDerWaalsContact CG-CD 3.47Å; Q292-E296 HydrophobicContact CG-CG 4.29Å; Q292-E296 WeakPolarHBondContact CG-OE1 2.98Å; Q292-E296 PolarHBondContact NE2-OE1 3.27Å; Q292-E296 WeakPolarHBondContact O-CB 3.45Å; Q292-E296 WeakPolarHBondContact O-CG 3.22Å; Q292-E296 PolarHBondContact O-N 3.49Å
293	R	30.8	Very low	30.6	Very low	155 Å²	155	115.1 Å²	115.1	59%	0.585	59%	0.589	S	S	*	*	H	α-helix	trans	-65.6	-31.6	169.6	-77.9	176.2	170.4	-176.7	-6	113.4	R289 V290 L295 H297	R289-R293 WeakPolarHBondContact O-CB 3.29Å; R289-R293 WeakPolarHBondContact O-CG 3.42Å; R289-R293 PolarHBondContact O-N 3.47Å; V290-R293 PolarHBondContact O-N 3.45Å; R293-L295 VanDerWaalsContact C-N 3.27Å; R293-L295 PolarHBondContact O-N 2.95Å; R293-H297 WeakPolarHBondContact O-CB 3.34Å; R293-H297 PolarHBondContact O-CD2 3.21Å; R293-H297 PolarHBondContact O-N 3.3Å
294	L	30.6	Very low	30.2	Very low	122 Å²	122	121.2 Å²	121.2	64%	0.639	60%	0.6	S	S	*	*	H	α-helix	trans	-69.4	-22.8	174.1	-79.5	164.2	0	0	0	113.2	V290 T291 Q292 S298	V290-L294 HydrophobicContact CG1-CD1 3.87Å; V290-L294 VanDerWaalsContact O-CB 3.31Å; V290-L294 WeakPolarHBondContact O-CB 3.29Å; V290-L294 WeakPolarHBondContact O-CD1 2.9Å; V290-L294 WeakPolarHBondContact O-CG 3.49Å; V290-L294 PolarHBondContact O-N 3.45Å; T291-L294 PolarHBondContact O-N 3.28Å; Q292-L294 VanDerWaalsContact C-N 3.33Å; Q292-L294 PolarHBondContact O-N 2.97Å; L294-S298 PolarHBondContact O-OG 3.47Å
295	L	29.7	Very low	29.7	Very low	131 Å²	131	125.7 Å²	125.7	69%	0.686	62%	0.616	S	S	*	*	H	α-helix	trans	-96.8	-30.3	176.3	-82.4	156.8	0	0	0	113.4	T291 Q292 R293 S298	T291-L295 PolarHBondContact O-N 2.78Å; T291-L295 VanDerWaalsContact O-N 3.11Å; Q292-L295 PolarHBondContact O-N 3.26Å; R293-L295 VanDerWaalsContact C-N 3.27Å; R293-L295 PolarHBondContact O-N 2.95Å; L295-S298 PolarHBondContact O-OG 2.97Å
296	E	29.8	Very low	29.3	Very low	110 Å²	110	125 Å²	125	51%	0.514	62%	0.619	S	S	.	*	H	α-helix	trans	-84.2	-33.1	179.6	-71.3	169.7	178.7	0	0	112.4	Q292 S298 F299	Q292-E296 VanDerWaalsContact CG-CD 3.47Å; Q292-E296 HydrophobicContact CG-CG 4.29Å; Q292-E296 WeakPolarHBondContact CG-OE1 2.98Å; Q292-E296 PolarHBondContact NE2-OE1 3.27Å; Q292-E296 WeakPolarHBondContact O-CB 3.45Å; Q292-E296 WeakPolarHBondContact O-CG 3.22Å; Q292-E296 PolarHBondContact O-N 3.49Å; E296-S298 VanDerWaalsContact C-N 3.28Å; E296-S298 PolarHBondContact O-N 3.3Å; E296-F299 PolarHBondContact O-N 3.45Å
297	H	31.3	Very low	29.1	Very low	120 Å²	120	125.6 Å²	125.6	56%	0.556	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-75.1	-11.4	175.1	-79.5	-80.5	0	0	0	114.4	R293 F299	R293-H297 WeakPolarHBondContact O-CB 3.34Å; R293-H297 PolarHBondContact O-CD2 3.21Å; R293-H297 PolarHBondContact O-N 3.3Å; H297-F299 PolarHBondContact O-N 2.74Å
298	S	28.7	Very low	28.8	Very low	84 Å²	84	126.4 Å²	126.4	59%	0.587	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-71.8	-6	171.4	29.4	0	0	0	0	114.8	L294 L295 E296	L294-S298 PolarHBondContact O-OG 3.47Å; L295-S298 PolarHBondContact O-OG 2.97Å; E296-S298 VanDerWaalsContact C-N 3.28Å; E296-S298 PolarHBondContact O-N 3.3Å
299	F	27.1	Very low	28.5	Very low	174 Å²	174	127 Å²	127	76%	0.763	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-112.3	-2.3	-179	-104.7	-88.5	0	0	0	115.7	E296 H297	E296-F299 PolarHBondContact O-N 3.45Å; H297-F299 PolarHBondContact O-N 2.74Å
300	Y	28.7	Very low	28.2	Very low	127 Å²	127	126.3 Å²	126.3	50%	0.498	65%	0.654	S	S	.	*	S	Bend	trans	-125.9	10.6	-178.2	-94.4	-76.4	0	0	0	115.7	N439	Y300-N439 WeakPolarHBondContact CE1-ND2 3.46Å; Y300-N439 PolarHBondContact OH-ND2 3.1Å
301	A	25.9	Very low	27.9	Very low	79 Å²	79	128.5 Å²	128.5	65%	0.653	67%	0.67	S	S	*	*			trans	-105.9	57.1	175.6	0	0	0	0	0	112.2
302	T	24.3	Very low	27.6	Very low	126 Å²	126	127.8 Å²	127.8	77%	0.773	68%	0.678	S	S	*	*			trans	-137.5	43.7	177.5	42.1	0	0	0	0	113
303	N	27	Very low	27.4	Very low	157 Å²	157	131.3 Å²	131.3	84%	0.84	70%	0.699	S	S	*	*	S	Bend	trans	-144.6	128.5	153.3	-93	-31.1	0	0	0	106.9
304	Y	25.4	Very low	27.1	Very low	219 Å²	219	132 Å²	132	86%	0.859	71%	0.708	S	S	*	*	S	Bend	trans	74.4	114.3	-164.5	-70.8	-90.7	0	0	0	116.9
305	F	24.7	Very low	27	Very low	181 Å²	181	131.6 Å²	131.6	79%	0.794	72%	0.715	S	S	*	*	S	Bend	trans	70.1	102	167.6	-74.2	-81.2	0	0	0	122.5
306	A	25.7	Very low	26.8	Very low	74 Å²	74	131.7 Å²	131.7	61%	0.612	72%	0.716	S	S	*	*			trans	73.2	110.4	135.9	0	0	0	0	0	121.8
307	T	27.1	Very low	26.6	Very low	135 Å²	135	132 Å²	132	83%	0.828	73%	0.726	S	S	*	*			trans	-138.6	111.5	146.1	46.7	0	0	0	0	113.2
308	T	26.6	Very low	26.4	Very low	79 Å²	79	132.3 Å²	132.3	49%	0.485	74%	0.735	S	S	.	*			trans	-75.3	133.7	152.6	14	0	0	0	0	110.5	H111	H111-T308 PolarHBondContact NE2-OG1 3.22Å
309	F	25.7	Very low	26.4	Very low	195 Å²	195	131.8 Å²	131.8	86%	0.855	73%	0.73	S	S	*	*			trans	11.7	123.2	143.7	-84.8	-94.5	0	0	0	118.7
310	V	27.5	Very low	26.3	Very low	136 Å²	136	129.7 Å²	129.7	82%	0.824	74%	0.737	S	S	*	*				-172.9	147.4	99.1	148.8	0	0	0	0	108.6
311	P	27.8	Very low	26.3	Very low	122 Å²	122	129.3 Å²	129.3	79%	0.792	74%	0.743	S	S	*	*			trans	-111.4	170.5	-149	40.8	-33	0	0	0	116
312	G	25.1	Very low	26.3	Very low	64 Å²	64	133.7 Å²	133.7	66%	0.66	75%	0.747	S	S	*	*			trans	167.2	124.3	160.5	0	0	0	0	0	115.5
313	L	26.8	Very low	26.5	Very low	167 Å²	167	136.8 Å²	136.8	87%	0.874	75%	0.745	S	S	*	*			trans	60	99.5	168	-60.8	118.7	0	0	0	117.1
314	H	24.7	Very low	26.5	Very low	170 Å²	170	131.7 Å²	131.7	79%	0.787	73%	0.729	S	S	*	*				67.5	96	74.7	-79.5	-47.3	0	0	0	116.9
315	C	27.3	Very low	26.6	Very low	114 Å²	114	123.5 Å²	123.5	77%	0.77	71%	0.706	S	S	*	*				177.7	111.8	112.7	-94.4	0	0	0	0	108
316	N	25.3	Very low	26.8	Very low	132 Å²	132	119 Å²	119	71%	0.706	69%	0.694	S	S	*	*				57.8	120.9	86.2	-75.2	0.7	0	0	0	112.2
317	T	25.4	Very low	26.9	Very low	118 Å²	118	122.1 Å²	122.1	72%	0.724	70%	0.695	S	S	*	*			cis	-165.8	142.5	22.1	11.8	0	0	0	0	113.4
318	V	27.4	Very low	26.9	Very low	125 Å²	125	125.2 Å²	125.2	76%	0.758	69%	0.692	S	S	*	*			trans	72.7	138.4	136.5	171.6	0	0	0	0	119.5
319	P	28.7	Very low	26.8	Very low	74 Å²	74	127.4 Å²	127.4	48%	0.481	70%	0.698	S	S	.	*			cis	-140.4	129.1	-32	38.8	-19.4	0	0	0	113.9	I321	P319-I321 HydrophobicContact CB-CD1 4.32Å; P319-I321 HydrophobicContact CB-CG1 4.2Å; P319-I321 HydrophobicContact CG-CD1 4.03Å; P319-I321 HydrophobicContact CG-CG1 4.27Å; P319-I321 PolarHBondContact O-N 2.81Å
320	S	25.3	Very low	27	Very low	130 Å²	130	125.5 Å²	125.5	91%	0.909	69%	0.692	S	S	*	*				46.1	17.3	87.7	78.1	0	0	0	0	119.9
321	I	28.1	Very low	27.2	Very low	119 Å²	119	123.2 Å²	123.2	61%	0.61	68%	0.678	S	S	*	*			trans	-111.5	-34.6	178.2	-67.4	175	0	0	0	114	P319	P319-I321 HydrophobicContact CB-CD1 4.32Å; P319-I321 HydrophobicContact CB-CG1 4.2Å; P319-I321 HydrophobicContact CG-CD1 4.03Å; P319-I321 HydrophobicContact CG-CG1 4.27Å; P319-I321 PolarHBondContact O-N 2.81Å
322	F	27	Very low	27.1	Very low	171 Å²	171	127.6 Å²	127.6	75%	0.75	68%	0.68	S	S	*	*	H	α-helix	trans	-78.2	-39.1	-167.1	-105.5	-103.9	0	0	0	116.8	G324 A325	F322-G324 VanDerWaalsContact C-N 3.32Å; F322-G324 PolarHBondContact O-N 3.47Å; F322-A325 PolarHBondContact O-N 3.42Å
323	R	27.7	Very low	27.2	Very low	191 Å²	191	134.1 Å²	134.1	72%	0.721	69%	0.686	S	S	*	*	H	α-helix	trans	-71.4	-18.9	-172.9	-76.5	-169.8	-172.6	166.6	7.9	115.2	T410	R323-T410 PolarHBondContact NH2-OG1 3.48Å
324	G	28.2	Very low	27.4	Very low	50 Å²	50	132.8 Å²	132.8	52%	0.515	68%	0.679	S	S	.	*	H	α-helix	trans	-87.7	-23.2	175.4	0	0	0	0	0	114.3	F322 R328	F322-G324 VanDerWaalsContact C-N 3.32Å; F322-G324 PolarHBondContact O-N 3.47Å; G324-R328 WeakPolarHBondContact O-CG 3.04Å
325	A	26.4	Very low	27.5	Very low	46 Å²	46	127.2 Å²	127.2	38%	0.38	67%	0.667	S	S	.	*	H	α-helix	trans	-82	-46.6	-175.4	0	0	0	0	0	112.2	F322 H327 R328 M329	F322-A325 PolarHBondContact O-N 3.42Å; A325-H327 VanDerWaalsContact C-N 3.33Å; A325-H327 PolarHBondContact O-N 3.34Å; A325-R328 PolarHBondContact O-N 3.07Å; A325-R328 VanDerWaalsContact O-N 3.11Å; A325-M329 PolarHBondContact O-N 2.93Å
326	V	28.6	Very low	27.4	Very low	87 Å²	87	130 Å²	130	53%	0.527	67%	0.669	S	S	.	*	H	α-helix	trans	-61.6	-41	-178.5	-179.3	0	0	0	0	111.5	R328 M329 H330	V326-R328 VanDerWaalsContact C-N 3.27Å; V326-R328 PolarHBondContact O-N 2.81Å; V326-M329 PolarHBondContact O-N 2.91Å; V326-H330 PolarHBondContact O-N 3.17Å
327	H	29	Very low	27.5	Very low	140 Å²	140	135.9 Å²	135.9	65%	0.648	68%	0.681	S	S	*	*	H	α-helix	trans	-74.1	-14.8	179.5	-132	-44.8	0	0	0	114.1	A325	A325-H327 VanDerWaalsContact C-N 3.33Å; A325-H327 PolarHBondContact O-N 3.34Å
328	R	26	Very low	27.7	Very low	200 Å²	200	135.3 Å²	135.3	76%	0.755	68%	0.682	S	S	*	*	H	α-helix	trans	-95.4	-34.1	171.9	-72.5	-177.4	-178.6	-176.4	2.4	112.6	G324 A325 V326 V331 Y332	G324-R328 WeakPolarHBondContact O-CG 3.04Å; A325-R328 PolarHBondContact O-N 3.07Å; A325-R328 VanDerWaalsContact O-N 3.11Å; V326-R328 VanDerWaalsContact C-N 3.27Å; V326-R328 PolarHBondContact O-N 2.81Å; R328-V331 PolarHBondContact O-N 2.96Å; R328-Y332 PolarHBondContact O-N 3.41Å
329	M	25.7	Very low	27.6	Very low	125 Å²	125	140.2 Å²	140.2	62%	0.616	69%	0.687	S	S	*	*	H	α-helix	trans	-61.5	-42.9	175.9	-85.9	-174.2	161	0	0	112.5	A325 V326 V331 Y332	A325-M329 PolarHBondContact O-N 2.93Å; V326-M329 PolarHBondContact O-N 2.91Å; M329-V331 PolarHBondContact O-N 3.35Å; M329-Y332 PolarHBondContact O-N 3.27Å
330	H	29.5	Very low	27.4	Very low	155 Å²	155	147.6 Å²	147.6	72%	0.718	71%	0.705	S	S	*	*	H	α-helix	trans	-66.9	-19	178.5	-105.2	-101.3	0	0	0	114.6	V326	V326-H330 PolarHBondContact O-N 3.17Å
331	V	30.6	Very low	27.4	Very low	87 Å²	87	147.6 Å²	147.6	53%	0.527	70%	0.7	S	S	.	*	H	α-helix	trans	-94.4	-21.6	-179.3	-179.5	0	0	0	0	111.9	R328 M329	R328-V331 PolarHBondContact O-N 2.96Å; M329-V331 PolarHBondContact O-N 3.35Å
332	Y	25.6	Very low	27.4	Very low	214 Å²	214	148.9 Å²	148.9	84%	0.839	71%	0.709	S	S	*	*	H	α-helix	trans	-82.3	-14.4	-178.9	-131	-92.2	0	0	0	114.3	R328 M329	R328-Y332 PolarHBondContact O-N 3.41Å; M329-Y332 PolarHBondContact O-N 3.27Å
333	Y	28.2	Very low	27.4	Very low	201 Å²	201	153 Å²	153	79%	0.788	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-1.7	-170.2	-122.9	-88.3	0	0	0	116
334	L	30	Very low	27.5	Very low	140 Å²	140	151.4 Å²	151.4	73%	0.733	72%	0.724	S	S	*	*	S	Bend	trans	-128.8	23	-166.4	-84	167.7	0	0	0	115.6
335	G	27.2	Very low	27.6	Very low	52 Å²	52	158.1 Å²	158.1	54%	0.536	74%	0.739	S	S	.	*	S	Bend	trans	-149.1	30.3	-163	0	0	0	0	0	121.3
336	Q	26.5	Very low	27.7	Very low	174 Å²	174	166.3 Å²	166.3	81%	0.813	76%	0.76	S	S	*	*			trans	-154.8	117.2	153.8	-84.4	-152.4	-9.3	0	0	112.8
337	R	26.9	Very low	27.9	Very low	255 Å²	255	167.7 Å²	167.7	96%	0.962	76%	0.761	S	S	*	*			trans	-151.9	79.6	163.4	-145.9	179.9	-166.8	-175.8	4.3	111.3
338	S	29	Very low	28.1	Very low	106 Å²	106	170.9 Å²	170.9	74%	0.741	77%	0.767	S	S	*	*			trans	-121.8	106.8	170.7	54.9	0	0	0	0	111.3
339	R	26.3	Very low	28.6	Very low	227 Å²	227	167.5 Å²	167.5	86%	0.857	76%	0.763	S	S	*	*			trans	43.8	105.7	149.7	-75.1	-173	172.1	175.9	-3.2	120.6
340	W	24	Very low	29	Very low	229 Å²	229	166.6 Å²	166.6	87%	0.867	76%	0.76	S	S	*	*			trans	72.4	134.7	143.5	-63.9	82	0	0	0	121.1
341	T	24.9	Very low	29.3	Very low	131 Å²	131	163.4 Å²	163.4	80%	0.804	75%	0.748	S	S	*	*			trans	79.6	146.5	168.7	59.2	0	0	0	0	120.4
342	D	28	Very low	29.4	Very low	146 Å²	146	164.5 Å²	164.5	78%	0.781	75%	0.75	S	S	*	*			trans	73	58.8	164.6	-64.6	3.9	0	0	0	123.9	L344	D342-L344 VanDerWaalsContact C-N 3.26Å; D342-L344 PolarHBondContact O-N 3.3Å
343	R	26.5	Very low	29.9	Very low	258 Å²	258	156.6 Å²	156.6	97%	0.974	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn		17	2.3	126.2	-133.4	177.5	-171.9	169.2	2.9	125.3
344	L	30.9	Very low	30.2	Very low	157 Å²	157	153.5 Å²	153.5	82%	0.822	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.1	-7.7	-169	-96	165.4	0	0	0	118.9	D342	D342-L344 VanDerWaalsContact C-N 3.26Å; D342-L344 PolarHBondContact O-N 3.3Å
345	F	29.5	Very low	30.4	Very low	191 Å²	191	148.7 Å²	148.7	84%	0.838	70%	0.704	S	S	*	*	S	Bend	trans	-107.9	4.2	-168.9	-119.7	-93.1	0	0	0	117.1
346	R	29.1	Very low	30.8	Very low	217 Å²	217	153.7 Å²	153.7	82%	0.819	72%	0.719	S	S	*	*	S	Bend	trans	-95.6	-3.7	-172.5	-108.7	-175.8	-169.3	-148.6	0.5	116.6
347	E	32.4	Very low	31.2	Very low	117 Å²	117	150.9 Å²	150.9	55%	0.547	71%	0.713	S	S	.	*	S	Bend	trans	-95.1	-16.4	-170.9	-66	-174.1	157.1	0	0	115.1	I351 L364	E347-I351 WeakPolarHBondContact O-CD1 3.5Å; E347-I351 VanDerWaalsContact O-CG1 3.28Å; E347-I351 WeakPolarHBondContact O-CG1 3.39Å; E347-L364 HydrophobicContact CB-CD1 4.43Å
348	R	33.4	Very low	31.7	Very low	206 Å²	206	142.1 Å²	142.1	78%	0.777	69%	0.688	S	S	*	*	S	Bend	trans	-83.4	-41.6	-178.3	-97.1	-178.8	173.7	176.4	-2.5	115.3	L350 I351 D352	R348-L350 VanDerWaalsContact C-N 3.31Å; R348-L350 PolarHBondContact O-N 2.97Å; R348-I351 WeakPolarHBondContact O-CB 3.5Å; R348-I351 PolarHBondContact O-N 3.29Å; R348-D352 PolarHBondContact O-N 3.09Å
349	I	35.7	Very low	31.7	Very low	130 Å²	130	140.5 Å²	140.5	67%	0.667	69%	0.688	S	S	*	*	H	α-helix	trans	-72.4	-25.4	-169.3	-62.9	166.5	0	0	0	112.4	A353	I349-A353 PolarHBondContact O-N 2.81Å
350	L	34.7	Very low	32.1	Very low	105 Å²	105	137.5 Å²	137.5	55%	0.55	68%	0.682	S	S	.	*	H	α-helix	trans	-76.7	-22.1	171.9	-96.6	155.9	0	0	0	113.1	R348 F354	R348-L350 VanDerWaalsContact C-N 3.31Å; R348-L350 PolarHBondContact O-N 2.97Å; L350-F354 PolarHBondContact O-N 3.12Å
351	I	36	Very low	32.5	Very low	89 Å²	89	135.2 Å²	135.2	46%	0.456	69%	0.686	S	S	.	*	H	α-helix	trans	-76.8	-46.4	178.1	-66.6	171.9	0	0	0	110	E347 R348 A353 F354 G355 L364	E347-I351 WeakPolarHBondContact O-CD1 3.5Å; E347-I351 VanDerWaalsContact O-CG1 3.28Å; E347-I351 WeakPolarHBondContact O-CG1 3.39Å; R348-I351 WeakPolarHBondContact O-CB 3.5Å; R348-I351 PolarHBondContact O-N 3.29Å; I351-A353 VanDerWaalsContact C-N 3.32Å; I351-A353 PolarHBondContact O-N 3.19Å; I351-F354 PolarHBondContact O-N 3.3Å; I351-G355 PolarHBondContact O-N 2.87Å; I351-L364 HydrophobicContact CD1-CD1 3.93Å
352	D	33	Very low	33.3	Very low	110 Å²	110	134.6 Å²	134.6	59%	0.588	68%	0.678	S	S	*	*	H	α-helix	trans	-62.3	-40.4	178	-61.2	-27.1	0	0	0	111.3	R348 F354 D356	R348-D352 PolarHBondContact O-N 3.09Å; D352-F354 PolarHBondContact O-N 3.2Å; D352-D356 PolarHBondContact O-N 3.34Å
353	A	35.6	Very low	33.8	Very low	48 Å²	48	130.2 Å²	130.2	40%	0.397	66%	0.659	S	S	.	*	H	α-helix	trans	-72.6	-22	-179.7	0	0	0	0	0	115.2	I349 I351 V357	I349-A353 PolarHBondContact O-N 2.81Å; I351-A353 VanDerWaalsContact C-N 3.32Å; I351-A353 PolarHBondContact O-N 3.19Å; A353-V357 WeakPolarHBondContact O-CG2 3.35Å
354	F	34.1	Very low	34.2	Very low	136 Å²	136	121.1 Å²	121.1	60%	0.596	63%	0.629	S	S	*	*	H	α-helix	trans	-94.2	-29.8	173.9	-106.1	-95.5	0	0	0	112.8	L350 I351 D352 V357 T358	L350-F354 PolarHBondContact O-N 3.12Å; I351-F354 PolarHBondContact O-N 3.3Å; D352-F354 PolarHBondContact O-N 3.2Å; F354-V357 PolarHBondContact O-N 2.82Å; F354-T358 HydrophobicContact CD1-CG2 4.47Å; F354-T358 PolarHBondContact O-N 2.93Å; F354-T358 PolarHBondContact O-OG1 3.38Å
355	G	34.9	Very low	35.1	Very low	39 Å²	39	117.8 Å²	117.8	40%	0.402	62%	0.615	S	S	.	*	H	α-helix	trans	-62.2	-45.5	175.9	0	0	0	0	0	112.4	I351 V357 G359	I351-G355 PolarHBondContact O-N 2.87Å; G355-V357 PolarHBondContact O-N 2.8Å; G355-V357 VanDerWaalsContact O-N 3.16Å; G355-G359 PolarHBondContact O-N 2.85Å
356	D	36.1	Very low	35.8	Very low	156 Å²	156	111.6 Å²	111.6	83%	0.834	59%	0.59	S	S	*	*	H	α-helix	trans	-65.1	-15.3	178.9	-82.9	-7.9	0	0	0	114.3	D352	D352-D356 PolarHBondContact O-N 3.34Å
357	V	34.9	Very low	36.3	Very low	116 Å²	116	105.1 Å²	105.1	70%	0.703	57%	0.571	S	S	*	*	H	α-helix	trans	-109.1	-18.8	-172.9	-178.5	0	0	0	0	113	A353 F354 G355	A353-V357 WeakPolarHBondContact O-CG2 3.35Å; F354-V357 PolarHBondContact O-N 2.82Å; G355-V357 PolarHBondContact O-N 2.8Å; G355-V357 VanDerWaalsContact O-N 3.16Å
358	T	36.2	Very low	36.7	Very low	71 Å²	71	103.6 Å²	103.6	44%	0.436	57%	0.566	S	S	.	*	H	α-helix	trans	-132	-16.1	-169.6	61.9	0	0	0	0	116.6	F354 F360	F354-T358 HydrophobicContact CD1-CG2 4.47Å; F354-T358 PolarHBondContact O-N 2.93Å; F354-T358 PolarHBondContact O-OG1 3.38Å; T358-F360 VanDerWaalsContact O-CD2 3.27Å; T358-F360 WeakPolarHBondContact O-CD2 3.28Å; T358-F360 PolarHBondContact O-N 3.17Å; T358-F360 VanDerWaalsContact O-N 3.12Å
359	G	30.9	Very low	37.1	Very low	72 Å²	72	99.9 Å²	99.9	74%	0.742	56%	0.556	S	S	*	*			trans	67.6	7.8	172.6	0	0	0	0	0	117	G355	G355-G359 PolarHBondContact O-N 2.85Å
360	F	34.6	Very low	37.2	Very low	163 Å²	163	101.9 Å²	101.9	72%	0.715	56%	0.555	S	S	*	*			trans	-110.4	123.1	179.2	-78.3	-79.6	0	0	0	112.5	T358 L362	T358-F360 VanDerWaalsContact O-CD2 3.27Å; T358-F360 WeakPolarHBondContact O-CD2 3.28Å; T358-F360 PolarHBondContact O-N 3.17Å; T358-F360 VanDerWaalsContact O-N 3.12Å; F360-L362 HydrophobicContact CB-CD1 4.32Å; F360-L362 PolarHBondContact O-N 2.76Å; F360-L362 VanDerWaalsContact O-N 3.14Å
361	N	31.4	Very low	37.3	Very low	181 Å²	181	102.3 Å²	102.3	97%	0.968	56%	0.556	S	S	*	*			trans	-76.7	91.8	170.7	-80.2	-26.7	0	0	0	110.8
362	L	42.3	Very low	37.5	Very low	119 Å²	119	103.6 Å²	103.6	62%	0.623	56%	0.56	S	S	*	*			trans	-105.3	142	173.8	-88.1	150.1	0	0	0	111.4	F360 D366	F360-L362 HydrophobicContact CB-CD1 4.32Å; F360-L362 PolarHBondContact O-N 2.76Å; F360-L362 VanDerWaalsContact O-N 3.14Å; L362-D366 HydrophobicContact CD2-CB 4.41Å
363	S	38.8	Very low	37.8	Very low	54 Å²	54	103 Å²	103	38%	0.378	56%	0.556	S	S	.	*			trans	-79.9	150.3	-174.7	91.5	0	0	0	0	112.4	V365 D366 I367	S363-V365 PolarHBondContact O-N 3.41Å; S363-V365 VanDerWaalsContact O-N 3.12Å; S363-V365 PolarHBondContact OG-N 2.98Å; S363-D366 WeakPolarHBondContact CB-OD2 3.23Å; S363-D366 PolarHBondContact O-N 3Å; S363-D366 VanDerWaalsContact OG-CG 3.27Å; S363-D366 PolarHBondContact OG-N 3.47Å; S363-D366 PolarHBondContact OG-OD2 3.15Å; S363-I367 PolarHBondContact O-N 3.04Å
364	L	33.9	Very low	37.9	Very low	67 Å²	67	104.7 Å²	104.7	35%	0.351	56%	0.558	S	S	.	*	H	α-helix	trans	-56.4	-30.9	178.1	-159.1	98.9	0	0	0	112.5	E347 I351 L368	E347-L364 HydrophobicContact CB-CD1 4.43Å; I351-L364 HydrophobicContact CD1-CD1 3.93Å; L364-L368 HydrophobicContact CD2-CD1 4.02Å; L364-L368 HydrophobicContact CG-CD1 4.34Å; L364-L368 WeakPolarHBondContact O-CB 3.35Å; L364-L368 WeakPolarHBondContact O-CG 3.3Å; L364-L368 PolarHBondContact O-N 3.09Å
365	V	48.9	Very low	37.9	Very low	86 Å²	86	103.1 Å²	103.1	52%	0.521	56%	0.555	S	S	.	*	H	α-helix	trans	-69.4	-35.5	178.3	179.5	0	0	0	0	111.4	S363 K369	S363-V365 PolarHBondContact O-N 3.41Å; S363-V365 VanDerWaalsContact O-N 3.12Å; S363-V365 PolarHBondContact OG-N 2.98Å; V365-K369 HydrophobicContact CG1-CD 4.4Å; V365-K369 WeakPolarHBondContact O-CB 3.33Å; V365-K369 VanDerWaalsContact O-CG 3.29Å; V365-K369 WeakPolarHBondContact O-CG 3.46Å; V365-K369 PolarHBondContact O-N 3.33Å
366	D	44.8	Very low	38.1	Very low	61 Å²	61	109.7 Å²	109.7	33%	0.326	57%	0.568	S	S	.	*	H	α-helix	trans	-75.9	-36.7	-180	-56.2	-48.5	0	0	0	111.2	L362 S363 K369 W370	L362-D366 HydrophobicContact CD2-CB 4.41Å; S363-D366 WeakPolarHBondContact CB-OD2 3.23Å; S363-D366 PolarHBondContact O-N 3Å; S363-D366 VanDerWaalsContact OG-CG 3.27Å; S363-D366 PolarHBondContact OG-N 3.47Å; S363-D366 PolarHBondContact OG-OD2 3.15Å; D366-K369 PolarHBondContact O-N 2.81Å; D366-W370 WeakPolarHBondContact O-CB 3.41Å; D366-W370 PolarHBondContact O-N 3.14Å
367	I	40.9	Very low	37.9	Very low	82 Å²	82	106.7 Å²	106.7	42%	0.421	55%	0.551	S	S	.	*	H	α-helix	trans	-67.3	-42.6	174.3	-60.8	171.2	0	0	0	110.7	S363 W370 M371	S363-I367 PolarHBondContact O-N 3.04Å; I367-W370 PolarHBondContact O-N 3.16Å; I367-M371 HydrophobicContact CG2-SD 4.44Å; I367-M371 WeakPolarHBondContact O-CG 3.43Å; I367-M371 PolarHBondContact O-N 3.44Å
368	L	39	Very low	37.9	Very low	84 Å²	84	107.4 Å²	107.4	44%	0.44	55%	0.547	S	S	.	.	H	α-helix	trans	-66	-37.3	175.2	-79.3	166.1	0	0	0	112.5	L364 Q372	L364-L368 HydrophobicContact CD2-CD1 4.02Å; L364-L368 HydrophobicContact CG-CD1 4.34Å; L364-L368 WeakPolarHBondContact O-CB 3.35Å; L364-L368 WeakPolarHBondContact O-CG 3.3Å; L364-L368 PolarHBondContact O-N 3.09Å; L368-Q372 WeakPolarHBondContact O-CB 3.47Å; L368-Q372 WeakPolarHBondContact O-CG 3.48Å; L368-Q372 PolarHBondContact O-N 3.45Å
369	K	43.1	Very low	37.9	Very low	129 Å²	129	111.5 Å²	111.5	56%	0.561	56%	0.561	S	S	*	*	H	α-helix	trans	-62.9	-44.6	170	-77.9	171.5	-178	171.4	0	111.5	V365 D366 Q372 L373	V365-K369 HydrophobicContact CG1-CD 4.4Å; V365-K369 WeakPolarHBondContact O-CB 3.33Å; V365-K369 VanDerWaalsContact O-CG 3.29Å; V365-K369 WeakPolarHBondContact O-CG 3.46Å; V365-K369 PolarHBondContact O-N 3.33Å; D366-K369 PolarHBondContact O-N 2.81Å; K369-Q372 PolarHBondContact O-N 3Å; K369-L373 WeakPolarHBondContact O-CB 3.2Å; K369-L373 PolarHBondContact O-N 2.03Å
370	W	38.2	Very low	38.1	Very low	172 Å²	172	111.7 Å²	111.7	65%	0.652	56%	0.555	S	S	*	*	H	α-helix	trans	-63.2	-41.9	176.7	-102.3	87.6	0	0	0	112.7	D366 I367 L373 I374	D366-W370 WeakPolarHBondContact O-CB 3.41Å; D366-W370 PolarHBondContact O-N 3.14Å; I367-W370 PolarHBondContact O-N 3.16Å; W370-L373 WeakPolarHBondContact O-CB 3.5Å; W370-L373 PolarHBondContact O-N 3.33Å; W370-I374 HydrophobicContact CE3-CD1 3.88Å; W370-I374 HydrophobicContact CE3-CG1 4.27Å; W370-I374 HydrophobicContact CZ3-CD1 4.4Å; W370-I374 WeakPolarHBondContact O-CB 3.39Å; W370-I374 VanDerWaalsContact O-CG1 3.29Å; W370-I374 WeakPolarHBondContact O-CG1 3.4Å; W370-I374 PolarHBondContact O-N 2.99Å
371	M	35.5	Very low	38	Very low	113 Å²	113	107.2 Å²	107.2	56%	0.557	54%	0.541	S	S	*	.	H	α-helix	trans	-70.1	-35.8	176.1	-72.6	-172.8	70.4	0	0	112.7	I367 L373 I374 N375	I367-M371 HydrophobicContact CG2-SD 4.44Å; I367-M371 WeakPolarHBondContact O-CG 3.43Å; I367-M371 PolarHBondContact O-N 3.44Å; M371-L373 VanDerWaalsContact C-N 3.34Å; M371-I374 PolarHBondContact O-N 3.37Å; M371-N375 PolarHBondContact O-N 3.33Å
372	Q	39.6	Very low	38.1	Very low	116 Å²	116	106.1 Å²	106.1	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-68.6	-33.6	170.5	-75.7	-174.6	-8.4	0	0	112.1	L368 K369 R376	L368-Q372 WeakPolarHBondContact O-CB 3.47Å; L368-Q372 WeakPolarHBondContact O-CG 3.48Å; L368-Q372 PolarHBondContact O-N 3.45Å; K369-Q372 PolarHBondContact O-N 3Å; Q372-R376 VanDerWaalsContact O-CB 3.3Å; Q372-R376 WeakPolarHBondContact O-CB 3.41Å; Q372-R376 VanDerWaalsContact O-CG 3.23Å; Q372-R376 WeakPolarHBondContact O-CG 3.35Å; Q372-R376 PolarHBondContact O-N 3.26Å
373	L	39.9	Very low	37.6	Very low	98 Å²	98	109.2 Å²	109.2	51%	0.513	54%	0.542	S	S	.	.	H	α-helix	trans	-66.8	-45.1	172.4	-157.9	86.8	0	0	0	110.6	K369 W370 M371 R376 L377	K369-L373 WeakPolarHBondContact O-CB 3.2Å; K369-L373 PolarHBondContact O-N 2.03Å; W370-L373 WeakPolarHBondContact O-CB 3.5Å; W370-L373 PolarHBondContact O-N 3.33Å; M371-L373 VanDerWaalsContact C-N 3.34Å; L373-R376 PolarHBondContact O-N 3.39Å; L373-L377 HydrophobicContact CD2-CD1 4.07Å; L373-L377 HydrophobicContact CG-CD1 4.02Å; L373-L377 VanDerWaalsContact O-CB 3.26Å; L373-L377 WeakPolarHBondContact O-CB 3.15Å; L373-L377 WeakPolarHBondContact O-CD1 3.2Å; L373-L377 VanDerWaalsContact O-CG 3.27Å; L373-L377 WeakPolarHBondContact O-CG 3.49Å; L373-L377 PolarHBondContact O-N 3.19Å
374	I	37.8	Very low	37.2	Very low	84 Å²	84	110.6 Å²	110.6	43%	0.431	55%	0.547	S	S	.	.	H	α-helix	trans	-63.8	-44.7	177.5	-73.2	166.6	0	0	0	111.1	W370 M371 L377 H378	W370-I374 HydrophobicContact CE3-CD1 3.88Å; W370-I374 HydrophobicContact CE3-CG1 4.27Å; W370-I374 HydrophobicContact CZ3-CD1 4.4Å; W370-I374 WeakPolarHBondContact O-CB 3.39Å; W370-I374 VanDerWaalsContact O-CG1 3.29Å; W370-I374 WeakPolarHBondContact O-CG1 3.4Å; W370-I374 PolarHBondContact O-N 2.99Å; M371-I374 PolarHBondContact O-N 3.37Å; I374-L377 PolarHBondContact O-N 3.12Å; I374-H378 VanDerWaalsContact O-CB 3.28Å; I374-H378 WeakPolarHBondContact O-CB 3.33Å; I374-H378 PolarHBondContact O-N 3.1Å
375	N	34.7	Very low	37.2	Very low	103 Å²	103	112.1 Å²	112.1	55%	0.551	56%	0.561	S	S	*	*	H	α-helix	trans	-67.1	-39.3	176.2	-86	11.4	0	0	0	112.1	M371 L377 H378 E379	M371-N375 PolarHBondContact O-N 3.33Å; N375-L377 VanDerWaalsContact C-N 3.33Å; N375-L377 PolarHBondContact O-N 3.01Å; N375-H378 PolarHBondContact O-N 3.07Å; N375-E379 WeakPolarHBondContact O-CG 3.37Å; N375-E379 PolarHBondContact O-N 3.36Å
376	R	37.9	Very low	36.5	Very low	177 Å²	177	114.9 Å²	114.9	67%	0.668	57%	0.572	S	S	*	*	H	α-helix	trans	-67.2	-32.3	173.5	-72.9	177.7	-173.6	-176	4.5	112.8	Q372 L373 A380	Q372-R376 VanDerWaalsContact O-CB 3.3Å; Q372-R376 WeakPolarHBondContact O-CB 3.41Å; Q372-R376 VanDerWaalsContact O-CG 3.23Å; Q372-R376 WeakPolarHBondContact O-CG 3.35Å; Q372-R376 PolarHBondContact O-N 3.26Å; L373-R376 PolarHBondContact O-N 3.39Å; R376-A380 WeakPolarHBondContact O-CB 3.3Å; R376-A380 PolarHBondContact O-N 2.87Å
377	L	33.7	Very low	36	Very low	92 Å²	92	116.8 Å²	116.8	48%	0.482	58%	0.582	S	S	.	*	H	α-helix	trans	-70.1	-40.6	171.4	-79.9	161	0	0	0	111.1	L373 I374 N375 E379 A380 V381	L373-L377 HydrophobicContact CD2-CD1 4.07Å; L373-L377 HydrophobicContact CG-CD1 4.02Å; L373-L377 VanDerWaalsContact O-CB 3.26Å; L373-L377 WeakPolarHBondContact O-CB 3.15Å; L373-L377 WeakPolarHBondContact O-CD1 3.2Å; L373-L377 VanDerWaalsContact O-CG 3.27Å; L373-L377 WeakPolarHBondContact O-CG 3.49Å; L373-L377 PolarHBondContact O-N 3.19Å; I374-L377 PolarHBondContact O-N 3.12Å; N375-L377 VanDerWaalsContact C-N 3.33Å; N375-L377 PolarHBondContact O-N 3.01Å; L377-E379 VanDerWaalsContact C-N 3.31Å; L377-E379 PolarHBondContact O-N 3.28Å; L377-A380 PolarHBondContact O-N 2.92Å; L377-V381 VanDerWaalsContact O-CB 3.27Å; L377-V381 WeakPolarHBondContact O-CB 3.49Å; L377-V381 WeakPolarHBondContact O-CG2 3.16Å; L377-V381 PolarHBondContact O-N 2.74Å
378	H	33.9	Very low	35.6	Very low	132 Å²	132	117 Å²	117	61%	0.611	59%	0.586	S	S	*	*	H	α-helix	trans	-68.2	-30.1	177.9	-162.4	-54.9	0	0	0	112.4	I374 N375	I374-H378 VanDerWaalsContact O-CB 3.28Å; I374-H378 WeakPolarHBondContact O-CB 3.33Å; I374-H378 PolarHBondContact O-N 3.1Å; N375-H378 PolarHBondContact O-N 3.07Å
379	E	35.7	Very low	35.4	Very low	157 Å²	157	116.3 Å²	116.3	73%	0.734	59%	0.589	S	S	*	*	H	α-helix	trans	-80.6	-24.7	171.2	-71.5	176	161.5	0	0	112.9	N375 L377	N375-E379 WeakPolarHBondContact O-CG 3.37Å; N375-E379 PolarHBondContact O-N 3.36Å; L377-E379 VanDerWaalsContact C-N 3.31Å; L377-E379 PolarHBondContact O-N 3.28Å
380	A	35.7	Very low	35	Very low	75 Å²	75	113.1 Å²	113.1	62%	0.62	59%	0.587	S	S	*	*	H	α-helix	trans	-92.9	-15.1	-179.4	0	0	0	0	0	115.5	R376 L377 H382	R376-A380 WeakPolarHBondContact O-CB 3.3Å; R376-A380 PolarHBondContact O-N 2.87Å; L377-A380 PolarHBondContact O-N 2.92Å; A380-H382 VanDerWaalsContact C-N 3.33Å; A380-H382 PolarHBondContact O-N 3Å
381	V	33.3	Very low	34.7	Very low	70 Å²	70	109.6 Å²	109.6	42%	0.424	58%	0.58	S	S	.	*			trans	-88.9	4.9	-174.5	167.2	0	0	0	0	113.4	L377 E383 V388	L377-V381 VanDerWaalsContact O-CB 3.27Å; L377-V381 WeakPolarHBondContact O-CB 3.49Å; L377-V381 WeakPolarHBondContact O-CG2 3.16Å; L377-V381 PolarHBondContact O-N 2.74Å; V381-E383 PolarHBondContact O-N 3.22Å; V381-E383 VanDerWaalsContact O-N 3.08Å; V381-V388 HydrophobicContact CG1-CG2 3.88Å
382	H	31.9	Very low	34.7	Very low	158 Å²	158	106.8 Å²	106.8	73%	0.731	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-0.1	-173.4	-109.2	-76	0	0	0	116.8	A380	A380-H382 VanDerWaalsContact C-N 3.33Å; A380-H382 PolarHBondContact O-N 3Å
383	E	32.8	Very low	34.5	Very low	184 Å²	184	105.1 Å²	105.1	86%	0.86	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	-7.5	-173.6	-67.3	-165.3	148.9	0	0	117	V381	V381-E383 PolarHBondContact O-N 3.22Å; V381-E383 VanDerWaalsContact O-N 3.08Å
384	T	29.7	Very low	34.2	Very low	82 Å²	82	108 Å²	108	50%	0.503	57%	0.573	S	S	.	*			trans	-139.3	105.3	-179.1	48	0	0	0	0	115.5	L386	T384-L386 VanDerWaalsContact C-N 3.32Å; T384-L386 PolarHBondContact O-N 3.36Å
385	P	33.5	Very low	33.9	Very low	99 Å²	99	109.1 Å²	109.1	64%	0.643	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	0.5	-173.3	30.9	-35.9	0	0	0	116
386	L	34.6	Very low	33.9	Very low	144 Å²	144	109.5 Å²	109.5	75%	0.754	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-17.3	-175.3	-101.5	112.1	0	0	0	115.4	T384 S389	T384-L386 VanDerWaalsContact C-N 3.32Å; T384-L386 PolarHBondContact O-N 3.36Å; L386-S389 PolarHBondContact O-OG 2.67Å
387	I	35.1	Very low	33.7	Very low	101 Å²	101	106.3 Å²	106.3	52%	0.518	58%	0.577	S	S	.	*	H	α-helix	trans	-93.5	-32.9	-170.1	-66.2	172.6	0	0	0	111.9	S389 A390 L391	I387-S389 PolarHBondContact O-N 2.86Å; I387-A390 PolarHBondContact O-N 3.37Å; I387-L391 HydrophobicContact CG2-CD1 3.75Å; I387-L391 PolarHBondContact O-N 3.46Å; I387-L391 VanDerWaalsContact O-N 3.15Å
388	V	32.6	Very low	33.7	Very low	86 Å²	86	105.3 Å²	105.3	52%	0.521	58%	0.577	S	S	.	*	H	α-helix	trans	-70.3	-30.8	-179.1	-177.5	0	0	0	0	112.6	V381 S392	V381-V388 HydrophobicContact CG1-CG2 3.88Å; V388-S392 WeakPolarHBondContact O-CB 3.12Å; V388-S392 PolarHBondContact O-N 3.01Å; V388-S392 PolarHBondContact O-OG 2.93Å
389	S	34.6	Very low	33.6	Very low	70 Å²	70	101 Å²	101	49%	0.49	57%	0.568	S	S	.	*	H	α-helix	trans	-73.4	-31.5	174.7	51.6	0	0	0	0	113.1	L386 I387 S392 V393	L386-S389 PolarHBondContact O-OG 2.67Å; I387-S389 PolarHBondContact O-N 2.86Å; S389-S392 PolarHBondContact O-OG 3.11Å; S389-V393 WeakPolarHBondContact O-CG2 3.43Å; S389-V393 PolarHBondContact O-N 3.36Å
390	A	35	Very low	33.4	Very low	63 Å²	63	97.1 Å²	97.1	52%	0.521	56%	0.558	S	S	.	*	H	α-helix	trans	-77.1	-43.2	177.7	0	0	0	0	0	112.6	I387 V393 W394	I387-A390 PolarHBondContact O-N 3.37Å; A390-V393 PolarHBondContact O-N 3.17Å; A390-W394 PolarHBondContact O-N 2.81Å
391	L	32.3	Very low	33.1	Very low	98 Å²	98	104.2 Å²	104.2	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-73.4	-32.8	-179	-88.3	153.9	0	0	0	113.6	I387 W394 N395	I387-L391 HydrophobicContact CG2-CD1 3.75Å; I387-L391 PolarHBondContact O-N 3.46Å; I387-L391 VanDerWaalsContact O-N 3.15Å; L391-W394 PolarHBondContact O-N 3.06Å; L391-N395 WeakPolarHBondContact O-CB 3.25Å; L391-N395 PolarHBondContact O-N 3.3Å; L391-N395 VanDerWaalsContact O-N 3.08Å
392	S	34.6	Very low	33	Very low	54 Å²	54	110 Å²	110	38%	0.378	59%	0.591	S	S	.	*	H	α-helix	trans	-63.8	-45.3	170.7	49.4	0	0	0	0	111.2	V388 S389 W394 N395 I396	V388-S392 WeakPolarHBondContact O-CB 3.12Å; V388-S392 PolarHBondContact O-N 3.01Å; V388-S392 PolarHBondContact O-OG 2.93Å; S389-S392 PolarHBondContact O-OG 3.11Å; S392-W394 PolarHBondContact O-N 2.87Å; S392-N395 PolarHBondContact O-N 3.43Å; S392-I396 WeakPolarHBondContact O-CB 3.47Å; S392-I396 WeakPolarHBondContact O-CD1 3.23Å; S392-I396 WeakPolarHBondContact O-CG1 3.39Å; S392-I396 PolarHBondContact O-N 3.06Å
393	V	36.1	Very low	33	Very low	80 Å²	80	108.6 Å²	108.6	49%	0.485	59%	0.588	S	S	.	*	H	α-helix	trans	-63.6	-38.5	176.7	170.4	0	0	0	0	112.2	S389 A390 L397	S389-V393 WeakPolarHBondContact O-CG2 3.43Å; S389-V393 PolarHBondContact O-N 3.36Å; A390-V393 PolarHBondContact O-N 3.17Å; V393-L397 HydrophobicContact CG1-CD1 3.65Å; V393-L397 HydrophobicContact CG1-CG 4.35Å; V393-L397 VanDerWaalsContact O-CB 3.31Å; V393-L397 WeakPolarHBondContact O-CB 3.47Å; V393-L397 VanDerWaalsContact O-CG 3.23Å; V393-L397 WeakPolarHBondContact O-CG 3.11Å; V393-L397 PolarHBondContact O-N 3.46Å
394	W	31.9	Very low	33.2	Very low	158 Å²	158	105.5 Å²	105.5	60%	0.598	58%	0.582	S	S	*	*	H	α-helix	trans	-70.2	-39	178.2	-164.4	-94.2	0	0	0	113.4	A390 L391 S392 L397 S398 L532	A390-W394 PolarHBondContact O-N 2.81Å; L391-W394 PolarHBondContact O-N 3.06Å; S392-W394 PolarHBondContact O-N 2.87Å; W394-L397 PolarHBondContact O-N 3.35Å; W394-S398 WeakPolarHBondContact O-CB 3.39Å; W394-S398 PolarHBondContact O-N 2.97Å; W394-S398 PolarHBondContact O-OG 3.47Å; W394-L532 HydrophobicContact CE3-CD2 4.22Å; W394-L532 HydrophobicContact CH2-CD2 3.68Å; W394-L532 HydrophobicContact CZ3-CD2 3.39Å
395	N	32.4	Very low	33.4	Very low	108 Å²	108	110.9 Å²	110.9	58%	0.578	60%	0.601	S	S	*	*	H	α-helix	trans	-71.6	-33.4	175.7	-73.3	-15.5	0	0	0	112.3	L391 S392 S398 G399	L391-N395 WeakPolarHBondContact O-CB 3.25Å; L391-N395 PolarHBondContact O-N 3.3Å; L391-N395 VanDerWaalsContact O-N 3.08Å; S392-N395 PolarHBondContact O-N 3.43Å; N395-S398 PolarHBondContact O-OG 3.18Å; N395-G399 PolarHBondContact O-N 3.19Å
396	I	35.7	Very low	33.1	Very low	111 Å²	111	109.5 Å²	109.5	57%	0.569	59%	0.594	S	S	*	*	H	α-helix	trans	-66.9	-43.7	171.4	-69.4	165.3	0	0	0	110.8	S392 C400	S392-I396 WeakPolarHBondContact O-CB 3.47Å; S392-I396 WeakPolarHBondContact O-CD1 3.23Å; S392-I396 WeakPolarHBondContact O-CG1 3.39Å; S392-I396 PolarHBondContact O-N 3.06Å; I396-C400 PolarHBondContact O-N 3.41Å; I396-C400 PolarHBondContact O-SG 3.46Å
397	L	33	Very low	33	Very low	110 Å²	110	111.3 Å²	111.3	58%	0.576	60%	0.598	S	S	*	*	H	α-helix	trans	-72.7	-30	-178	-75.2	170.2	0	0	0	114.4	V393 W394	V393-L397 HydrophobicContact CG1-CD1 3.65Å; V393-L397 HydrophobicContact CG1-CG 4.35Å; V393-L397 VanDerWaalsContact O-CB 3.31Å; V393-L397 WeakPolarHBondContact O-CB 3.47Å; V393-L397 VanDerWaalsContact O-CG 3.23Å; V393-L397 WeakPolarHBondContact O-CG 3.11Å; V393-L397 PolarHBondContact O-N 3.46Å; W394-L397 PolarHBondContact O-N 3.35Å
398	S	33.8	Very low	32.8	Very low	71 Å²	71	110.9 Å²	110.9	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-78.8	-35.5	178.3	48.3	0	0	0	0	113	W394 N395 C400	W394-S398 WeakPolarHBondContact O-CB 3.39Å; W394-S398 PolarHBondContact O-N 2.97Å; W394-S398 PolarHBondContact O-OG 3.47Å; N395-S398 PolarHBondContact O-OG 3.18Å; S398-C400 VanDerWaalsContact C-N 3.34Å; S398-C400 PolarHBondContact O-N 2.99Å
399	G	31.8	Very low	32.8	Very low	41 Å²	41	110.5 Å²	110.5	42%	0.423	60%	0.603	S	S	.	*	H	α-helix	trans	-67.3	-30.1	173.8	0	0	0	0	0	114	N395 R401	N395-G399 PolarHBondContact O-N 3.19Å; G399-R401 PolarHBondContact O-N 2.99Å; G399-R401 VanDerWaalsContact O-N 3.17Å
400	C	31.9	Very low	32.7	Very low	76 Å²	76	109.7 Å²	109.7	51%	0.514	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-9.8	-175.8	-73.2	0	0	0	0	115.4	I396 S398 V404	I396-C400 PolarHBondContact O-N 3.41Å; I396-C400 PolarHBondContact O-SG 3.46Å; S398-C400 VanDerWaalsContact C-N 3.34Å; S398-C400 PolarHBondContact O-N 2.99Å; C400-V404 WeakPolarHBondContact O-CG2 3.46Å
401	R	29	Very low	32.8	Very low	225 Å²	225	112.1 Å²	112.1	85%	0.849	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-11.5	-172.2	-149.1	175.1	-171.5	178.1	3	115.3	G399	G399-R401 PolarHBondContact O-N 2.99Å; G399-R401 VanDerWaalsContact O-N 3.17Å
402	Q	31.2	Very low	33	Very low	192 Å²	192	113.4 Å²	113.4	90%	0.897	61%	0.612	S	S	*	*	S	Bend	trans	-108.4	-3	177.8	-77.5	-179	-35.9	0	0	114
403	L	32.3	Very low	33.2	Very low	128 Å²	128	117.5 Å²	117.5	67%	0.67	62%	0.62	S	S	*	*	S	Bend	trans	-99.5	8.8	-175.6	-93.5	154.6	0	0	0	114.4
404	V	36.5	Very low	33.4	Very low	119 Å²	119	118.1 Å²	118.1	72%	0.721	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-14.8	-166.6	178.6	0	0	0	0	114	C400	C400-V404 WeakPolarHBondContact O-CG2 3.46Å
405	E	32.7	Very low	33.6	Very low	195 Å²	195	119.1 Å²	119.1	91%	0.911	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	2.6	-171.4	-65.3	-172.9	155.5	0	0	115
406	S	28.2	Very low	33.8	Very low	70 Å²	70	116.4 Å²	116.4	49%	0.49	62%	0.622	S	S	.	*			trans	-151.7	149.1	178.4	61.4	0	0	0	0	115.7
407	H	31.4	Very low	34.1	Very low	181 Å²	181	114.7 Å²	114.7	84%	0.838	61%	0.614	S	S	*	*			trans	100.7	151.6	158.9	-59.9	-60.3	0	0	0	121.7
408	S	31.6	Very low	34.4	Very low	93 Å²	93	113.7 Å²	113.7	65%	0.65	62%	0.616	S	S	*	*			trans	-90.5	156.4	-161.2	51	0	0	0	0	114.3	T410	S408-T410 PolarHBondContact O-N 3.05Å
409	P	32.2	Very low	34.5	Very low	77 Å²	77	115.6 Å²	115.6	50%	0.5	63%	0.625	S	S	.	*			trans	-78.7	104.6	-173.3	32.1	-35	0	0	0	112.9	Y413	P409-Y413 HydrophobicContact CB-CD2 4.24Å; P409-Y413 HydrophobicContact CB-CE2 4.17Å
410	T	33	Very low	34.9	Very low	54 Å²	54	117.7 Å²	117.7	33%	0.331	63%	0.629	S	S	.	*	S	Bend	trans	-158.2	154.2	146.1	30.3	0	0	0	0	111.6	R323 S408 D412	R323-T410 PolarHBondContact NH2-OG1 3.48Å; S408-T410 PolarHBondContact O-N 3.05Å; T410-D412 VanDerWaalsContact C-N 3.28Å; T410-D412 PolarHBondContact O-N 3.23Å
411	T	37.9	Very low	35.5	Very low	114 Å²	114	115.3 Å²	115.3	70%	0.699	61%	0.611	S	S	*	*	S	Bend	trans	62.2	-52.1	174.5	42.3	0	0	0	0	117.7	Y413 L414	T411-Y413 VanDerWaalsContact C-N 3.26Å; T411-Y413 PolarHBondContact O-N 2.91Å; T411-L414 PolarHBondContact O-N 3.17Å
412	D	35	Very low	35.8	Very low	125 Å²	125	108.5 Å²	108.5	67%	0.668	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-75.6	-16.5	-175.6	-61.4	-29.2	0	0	0	113.4	T410 L414 M415 S416	T410-D412 VanDerWaalsContact C-N 3.28Å; T410-D412 PolarHBondContact O-N 3.23Å; D412-L414 VanDerWaalsContact C-N 3.27Å; D412-L414 PolarHBondContact O-N 3.22Å; D412-M415 PolarHBondContact O-N 3.39Å; D412-S416 PolarHBondContact O-N 3.29Å; D412-S416 PolarHBondContact O-OG 3.16Å
413	Y	40.3	Very low	35.8	Very low	139 Å²	139	106.4 Å²	106.4	55%	0.545	59%	0.593	S	S	.	*	G	3₁₀ helix	trans	-61.7	-27.8	175.3	-112.2	-100.6	0	0	0	113.9	P409 T411 S416 V420	P409-Y413 HydrophobicContact CB-CD2 4.24Å; P409-Y413 HydrophobicContact CB-CE2 4.17Å; T411-Y413 VanDerWaalsContact C-N 3.26Å; T411-Y413 PolarHBondContact O-N 2.91Å; Y413-S416 WeakPolarHBondContact CA-OG 3.48Å; Y413-S416 PolarHBondContact O-OG 3.46Å; Y413-V420 HydrophobicContact CD1-CG2 4.16Å; Y413-V420 HydrophobicContact CE1-CG1 4.19Å; Y413-V420 HydrophobicContact CE1-CG2 3.73Å
414	L	40.2	Very low	36.1	Very low	93 Å²	93	101.9 Å²	101.9	49%	0.487	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-83.1	-23	179.6	-78.1	166.4	0	0	0	112.9	T411 D412 L417	T411-L414 PolarHBondContact O-N 3.17Å; D412-L414 VanDerWaalsContact C-N 3.27Å; D412-L414 PolarHBondContact O-N 3.22Å; L414-L417 HydrophobicContact CD2-CD1 3.93Å
415	M	35.4	Very low	36.3	Very low	180 Å²	180	102.4 Å²	102.4	89%	0.887	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-8.9	175.2	-70.1	-75.1	-81.3	0	0	112.9	D412	D412-M415 PolarHBondContact O-N 3.39Å
416	S	36.9	Very low	37.1	Very low	50 Å²	50	95.8 Å²	95.8	35%	0.35	55%	0.545	S	S	.	.			trans	-114.7	21.7	-177.3	50.8	0	0	0	0	113.4	D412 Y413 S418 T419	D412-S416 PolarHBondContact O-N 3.29Å; D412-S416 PolarHBondContact O-OG 3.16Å; Y413-S416 WeakPolarHBondContact CA-OG 3.48Å; Y413-S416 PolarHBondContact O-OG 3.46Å; S416-S418 PolarHBondContact O-N 2.74Å; S416-T419 PolarHBondContact O-OG1 3.47Å
417	L	40.9	Very low	38.4	Very low	76 Å²	76	97.7 Å²	97.7	40%	0.398	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.6	5.7	-166.3	-134.8	154.9	0	0	0	116.6	L414 F438	L414-L417 HydrophobicContact CD2-CD1 3.93Å; L417-F438 HydrophobicContact CD2-CD1 4.45Å; L417-F438 HydrophobicContact CD2-CE1 3.62Å; L417-F438 HydrophobicContact CD2-CZ 4.17Å; L417-F438 HydrophobicContact CG-CE1 4.22Å
418	S	39.4	Very low	39.5	Very low	88 Å²	88	93.8 Å²	93.8	62%	0.615	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.9	179.5	58.6	0	0	0	0	115.2	S416	S416-S418 PolarHBondContact O-N 2.74Å
419	T	36.9	Very low	40.9	Very low	111 Å²	111	95 Å²	95	68%	0.681	54%	0.539	S	S	*	.	S	Bend	trans	-114.7	-9.2	-168.5	50.5	0	0	0	0	116.5	S416	S416-T419 PolarHBondContact O-OG1 3.47Å
420	V	40.7	Very low	42.4	Very low	85 Å²	85	93.7 Å²	93.7	52%	0.515	53%	0.526	S	S	.	.			trans	-95.4	-4.1	-167	-176.7	0	0	0	0	113.9	Y413 C422	Y413-V420 HydrophobicContact CD1-CG2 4.16Å; Y413-V420 HydrophobicContact CE1-CG1 4.19Å; Y413-V420 HydrophobicContact CE1-CG2 3.73Å; V420-C422 PolarHBondContact O-N 3.16Å
421	L	43.6	Very low	44.2	Very low	26 Å²	26	91.3 Å²	91.3	14%	0.136	51%	0.512	C	S	.	.			trans	-88.1	85.4	-170.5	-86	130.7	0	0	0	113.1	W434 P555	L421-W434 HydrophobicContact CD2-CZ2 3.73Å; L421-P555 HydrophobicContact CB-CB 3.29Å; L421-P555 HydrophobicContact CB-CG 3.46Å; L421-P555 VanDerWaalsContact CB-CG 3.46Å; L421-P555 HydrophobicContact CD1-CB 3.85Å; L421-P555 HydrophobicContact CD2-CB 4.01Å; L421-P555 HydrophobicContact CG-CB 3.9Å; L421-P555 WeakPolarHBondContact O-CG 3.4Å
422	C	35.5	Very low	45.7	Very low	82 Å²	82	88.4 Å²	88.4	55%	0.554	49%	0.489	S	S	*	.			trans	-139.2	139.2	171.2	-90.6	0	0	0	0	114	V420	V420-C422 PolarHBondContact O-N 3.16Å
423	N	31.9	Very low	47.4	Very low	149 Å²	149	84.7 Å²	84.7	80%	0.797	48%	0.476	S	S	*	.	S	Bend	trans	62.4	65	167.7	-69.4	-15.2	0	0	0	120
424	A	38.1	Very low	48.8	Very low	32 Å²	32	79.9 Å²	79.9	26%	0.264	46%	0.457	S	S	.	.			trans	-148.9	136.2	144.1	0	0	0	0	0	112.8	F426	A424-F426 HydrophobicContact CB-CD2 4.43Å; A424-F426 HydrophobicContact CB-CE1 4.07Å; A424-F426 HydrophobicContact CB-CE2 3.83Å; A424-F426 HydrophobicContact CB-CZ 3.6Å; A424-F426 WeakPolarHBondContact O-CD2 3.31Å; A424-F426 WeakPolarHBondContact O-CE2 3.18Å; A424-F426 PolarHBondContact O-N 3.29Å
425	T	41.7	Very low	50.2	Low	130 Å²	130	75.5 Å²	75.5	80%	0.798	43%	0.434	S	S	*	.			trans	-88.2	100.1	167.7	36.5	0	0	0	0	109.3	N427 Q430	T425-N427 PolarHBondContact O-N 3.28Å; T425-Q430 PolarHBondContact O-NE2 2.76Å; T425-Q430 VanDerWaalsContact O-NE2 3.09Å; T425-Q430 PolarHBondContact O-OE1 3.39Å; T425-Q430 VanDerWaalsContact O-OE1 3.09Å
426	F	49	Very low	51.7	Low	56 Å²	56	71.6 Å²	71.6	25%	0.246	41%	0.412	C	S	.	.			trans	-68	96.4	-169	-75.2	-74.5	0	0	0	113.8	A424 Q430 W434 Q558	A424-F426 HydrophobicContact CB-CD2 4.43Å; A424-F426 HydrophobicContact CB-CE1 4.07Å; A424-F426 HydrophobicContact CB-CE2 3.83Å; A424-F426 HydrophobicContact CB-CZ 3.6Å; A424-F426 WeakPolarHBondContact O-CD2 3.31Å; A424-F426 WeakPolarHBondContact O-CE2 3.18Å; A424-F426 PolarHBondContact O-N 3.29Å; F426-Q430 HydrophobicContact CB-CB 4.49Å; F426-Q430 VanDerWaalsContact CD1-C 3.47Å; F426-Q430 HydrophobicContact CD1-CB 3.33Å; F426-Q430 WeakPolarHBondContact CD1-O 3.44Å; F426-Q430 HydrophobicContact CE1-CB 3.8Å; F426-Q430 WeakPolarHBondContact CE1-O 3.44Å; F426-Q430 HydrophobicContact CG-CB 4.33Å; F426-W434 HydrophobicContact CD1-CB 4.15Å; F426-W434 HydrophobicContact CE1-CB 3.47Å; F426-W434 VanDerWaalsContact CE1-CB 3.47Å; F426-W434 AromaticContact CE1-CG 3.84Å; F426-W434 HydrophobicContact CE1-CG 3.84Å; F426-W434 HydrophobicContact CE2-CG 4.29Å; F426-W434 HydrophobicContact CZ-CB 3.8Å; F426-W434 AromaticContact CZ-CD1 3.38Å; F426-W434 AromaticContact CZ-CG 3.62Å; F426-W434 HydrophobicContact CZ-CG 3.62Å; F426-Q558 HydrophobicContact CD2-CB 4.22Å; F426-Q558 HydrophobicContact CE2-CB 4.39Å
427	N	54.7	Low	53.2	Low	111 Å²	111	73 Å²	73	59%	0.594	42%	0.422	S	S	*	.			trans	-75.3	162.5	162.8	-150.3	-11.7	0	0	0	110	T425 T429 Q430	T425-N427 PolarHBondContact O-N 3.28Å; N427-T429 VanDerWaalsContact C-N 3.28Å; N427-T429 PolarHBondContact O-N 3.16Å; N427-Q430 HydrophobicContact CB-CG 4.45Å; N427-Q430 WeakPolarHBondContact O-CB 3Å; N427-Q430 PolarHBondContact O-N 2.89Å
428	N	55.7	Low	54.3	Low	99 Å²	99	71.5 Å²	71.5	53%	0.529	41%	0.412	S	S	.	.	H	α-helix	trans	-43.1	-46.9	-170.5	-79.8	-5.1	0	0	0	115.3	Q430 R453	N428-Q430 VanDerWaalsContact C-N 3.33Å; N428-Q430 PolarHBondContact O-N 3.42Å; N428-R453 PolarHBondContact OD1-NH2 3.35Å
429	T	59.3	Low	55.2	Low	119 Å²	119	72 Å²	72	73%	0.73	41%	0.408	S	S	*	.	H	α-helix	trans	-72.4	-21.8	-178.3	53.2	0	0	0	0	114.4	N427	N427-T429 VanDerWaalsContact C-N 3.28Å; N427-T429 PolarHBondContact O-N 3.16Å
430	Q	64.9	Low	56.5	Low	48 Å²	48	70.3 Å²	70.3	22%	0.224	39%	0.392	C	S	.	.	H	α-helix	trans	-79.4	-29.7	-177.9	-58.9	-179.3	34	0	0	111.6	T425 F426 N427 N428 F432 A433 W434	T425-Q430 PolarHBondContact O-NE2 2.76Å; T425-Q430 VanDerWaalsContact O-NE2 3.09Å; T425-Q430 PolarHBondContact O-OE1 3.39Å; T425-Q430 VanDerWaalsContact O-OE1 3.09Å; F426-Q430 HydrophobicContact CB-CB 4.49Å; F426-Q430 VanDerWaalsContact CD1-C 3.47Å; F426-Q430 HydrophobicContact CD1-CB 3.33Å; F426-Q430 WeakPolarHBondContact CD1-O 3.44Å; F426-Q430 HydrophobicContact CE1-CB 3.8Å; F426-Q430 WeakPolarHBondContact CE1-O 3.44Å; F426-Q430 HydrophobicContact CG-CB 4.33Å; N427-Q430 HydrophobicContact CB-CG 4.45Å; N427-Q430 WeakPolarHBondContact O-CB 3Å; N427-Q430 PolarHBondContact O-N 2.89Å; N428-Q430 VanDerWaalsContact C-N 3.33Å; N428-Q430 PolarHBondContact O-N 3.42Å; Q430-F432 PolarHBondContact O-N 3.35Å; Q430-A433 CarbonylContact O-C 3.55Å; Q430-A433 PolarHBondContact O-N 2.94Å; Q430-W434 WeakPolarHBondContact O-CB 3.44Å; Q430-W434 PolarHBondContact O-N 3.29Å
431	C	69.8	Low	57.3	Low	4 Å²	4	69 Å²	69	3%	0.027	39%	0.386	C	S	.	.	H	α-helix	trans	-63.8	-43.3	-177.2	-175.9	0	0	0	0	112.2	W434 I435 C562	C431-W434 WeakPolarHBondContact O-CB 3.25Å; C431-W434 PolarHBondContact O-N 3.01Å; C431-I435 PolarHBondContact O-N 3.38Å; C431-C562 VanDerWaalsContact CA-SG 3.57Å; C431-C562 HydrophobicContact CB-CB 4.37Å; C431-C562 WeakPolarHBondContact CB-SG 3.24Å; C431-C562 WeakPolarHBondContact SG-CB 3.44Å; C431-C562 CovalentContact SG-SG 2.04Å; C431-C562 PolarHBondContact SG-SG 3.41Å
432	F	70.7	Confident	58.1	Low	53 Å²	53	72.9 Å²	72.9	23%	0.232	40%	0.403	C	S	.	.	H	α-helix	trans	-63.5	-42.4	173.6	-174	-91.7	0	0	0	111.8	Q430 W434 I435 K436 T445 I446 Y449	Q430-F432 PolarHBondContact O-N 3.35Å; F432-W434 PolarHBondContact O-N 3.3Å; F432-I435 PolarHBondContact O-N 2.99Å; F432-K436 HydrophobicContact CE1-CD 4.22Å; F432-K436 WeakPolarHBondContact O-CB 3.38Å; F432-K436 PolarHBondContact O-N 2.92Å; F432-T445 HydrophobicContact CD2-CG2 4.24Å; F432-T445 HydrophobicContact CE1-CG2 4.38Å; F432-T445 HydrophobicContact CE2-CG2 3.78Å; F432-T445 HydrophobicContact CZ-CG2 3.85Å; F432-I446 HydrophobicContact CE2-CG1 4.09Å; F432-I446 HydrophobicContact CZ-CG1 4.36Å; F432-Y449 HydrophobicContact CB-CD2 4.22Å; F432-Y449 HydrophobicContact CB-CE2 4.25Å; F432-Y449 HydrophobicContact CD2-CD1 4.31Å; F432-Y449 HydrophobicContact CD2-CD2 4.06Å; F432-Y449 AromaticContact CD2-CG 3.93Å; F432-Y449 HydrophobicContact CD2-CG 3.93Å
433	A	69.4	Low	59.2	Low	47 Å²	47	70.5 Å²	70.5	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-63.4	-29.3	175.2	0	0	0	0	0	113	Q430 S437	Q430-A433 CarbonylContact O-C 3.55Å; Q430-A433 PolarHBondContact O-N 2.94Å; A433-S437 PolarHBondContact O-N 3.22Å
434	W	70.4	Confident	60.7	Low	38 Å²	38	68 Å²	68	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-73.1	-45.8	175.1	-175.7	69.3	0	0	0	112.2	L421 F426 Q430 C431 F432 K436 S437 F438 L559	L421-W434 HydrophobicContact CD2-CZ2 3.73Å; F426-W434 HydrophobicContact CD1-CB 4.15Å; F426-W434 HydrophobicContact CE1-CB 3.47Å; F426-W434 VanDerWaalsContact CE1-CB 3.47Å; F426-W434 AromaticContact CE1-CG 3.84Å; F426-W434 HydrophobicContact CE1-CG 3.84Å; F426-W434 HydrophobicContact CE2-CG 4.29Å; F426-W434 HydrophobicContact CZ-CB 3.8Å; F426-W434 AromaticContact CZ-CD1 3.38Å; F426-W434 AromaticContact CZ-CG 3.62Å; F426-W434 HydrophobicContact CZ-CG 3.62Å; Q430-W434 WeakPolarHBondContact O-CB 3.44Å; Q430-W434 PolarHBondContact O-N 3.29Å; C431-W434 WeakPolarHBondContact O-CB 3.25Å; C431-W434 PolarHBondContact O-N 3.01Å; F432-W434 PolarHBondContact O-N 3.3Å; W434-K436 VanDerWaalsContact C-N 3.28Å; W434-K436 PolarHBondContact O-N 2.97Å; W434-S437 WeakPolarHBondContact O-CB 3.36Å; W434-S437 PolarHBondContact O-N 2.81Å; W434-S437 PolarHBondContact O-OG 3.49Å; W434-F438 AromaticContact CD2-CE2 3.94Å; W434-F438 HydrophobicContact CD2-CE2 3.94Å; W434-F438 AromaticContact CE2-CE2 3.61Å; W434-F438 AromaticContact CE2-CZ 3.8Å; W434-F438 HydrophobicContact CE3-CE2 4.08Å; W434-F438 AromaticContact CH2-CE2 3.5Å; W434-F438 HydrophobicContact CH2-CE2 3.5Å; W434-F438 VanDerWaalsContact CH2-CE2 3.5Å; W434-F438 AromaticContact CH2-CZ 3.74Å; W434-F438 HydrophobicContact CH2-CZ 3.74Å; W434-F438 AromaticContact CZ2-CE2 3.4Å; W434-F438 HydrophobicContact CZ2-CE2 3.4Å; W434-F438 VanDerWaalsContact CZ2-CE2 3.4Å; W434-F438 AromaticContact CZ2-CZ 3.34Å; W434-F438 HydrophobicContact CZ2-CZ 3.34Å; W434-F438 AromaticContact CZ3-CE2 3.88Å; W434-F438 HydrophobicContact CZ3-CE2 3.88Å; W434-F438 WeakPolarHBondContact O-CD2 3.29Å; W434-L559 HydrophobicContact CH2-CB 4.3Å; W434-L559 HydrophobicContact CH2-CD1 3.89Å; W434-L559 HydrophobicContact CH2-CG 4.38Å
435	I	70	Confident	62	Low	1 Å²	1	66.5 Å²	66.5	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-59.3	-43.7	172.6	-60.1	171.1	0	0	0	109.8	C431 F432 S437 F438 F440 T445 L448 Y449 L452	C431-I435 PolarHBondContact O-N 3.38Å; F432-I435 PolarHBondContact O-N 2.99Å; I435-S437 PolarHBondContact O-N 2.97Å; I435-F438 PolarHBondContact O-N 3.17Å; I435-F438 VanDerWaalsContact O-N 3.15Å; I435-F440 HydrophobicContact CG2-CD2 3.96Å; I435-F440 HydrophobicContact CG2-CE2 4.46Å; I435-T445 HydrophobicContact CB-CG2 4.2Å; I435-T445 HydrophobicContact CG2-CG2 3.85Å; I435-L448 HydrophobicContact CD1-CD2 4.38Å; I435-L448 HydrophobicContact CG1-CD2 4.38Å; I435-L448 HydrophobicContact CG2-CB 4.32Å; I435-L448 HydrophobicContact CG2-CD2 3.78Å; I435-Y449 HydrophobicContact CD1-CD2 4.13Å; I435-L452 HydrophobicContact CD1-CD1 4.15Å
436	K	67	Low	63.2	Low	98 Å²	98	61.2 Å²	61.2	43%	0.426	33%	0.331	S	S	.	.	H	α-helix	trans	-63.2	-23.1	175.9	-164	159.2	-174.1	163.1	0	113.5	F432 W434 F438 N439 E442 T445	F432-K436 HydrophobicContact CE1-CD 4.22Å; F432-K436 WeakPolarHBondContact O-CB 3.38Å; F432-K436 PolarHBondContact O-N 2.92Å; W434-K436 VanDerWaalsContact C-N 3.28Å; W434-K436 PolarHBondContact O-N 2.97Å; K436-F438 VanDerWaalsContact C-N 3.25Å; K436-F438 PolarHBondContact O-N 3.49Å; K436-N439 PolarHBondContact O-N 2.75Å; K436-E442 IonicContact NZ-OE1 3.65Å; K436-E442 PolarHBondContact NZ-OE1 3.13Å; K436-T445 HydrophobicContact CB-CG2 4.21Å
437	S	67.5	Low	64	Low	79 Å²	79	59.5 Å²	59.5	55%	0.552	33%	0.327	S	S	*	.	H	α-helix	trans	-70.9	-16.9	176.3	78.3	0	0	0	0	114.1	A433 W434 I435 N439	A433-S437 PolarHBondContact O-N 3.22Å; W434-S437 WeakPolarHBondContact O-CB 3.36Å; W434-S437 PolarHBondContact O-N 2.81Å; W434-S437 PolarHBondContact O-OG 3.49Å; I435-S437 PolarHBondContact O-N 2.97Å; S437-N439 PolarHBondContact O-N 3.41Å
438	F	63.9	Low	64.8	Low	46 Å²	46	57.6 Å²	57.6	20%	0.202	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	2.2	173.2	-67.9	-71.5	0	0	0	114.4	L417 W434 I435 K436 F440	L417-F438 HydrophobicContact CD2-CD1 4.45Å; L417-F438 HydrophobicContact CD2-CE1 3.62Å; L417-F438 HydrophobicContact CD2-CZ 4.17Å; L417-F438 HydrophobicContact CG-CE1 4.22Å; W434-F438 AromaticContact CD2-CE2 3.94Å; W434-F438 HydrophobicContact CD2-CE2 3.94Å; W434-F438 AromaticContact CE2-CE2 3.61Å; W434-F438 AromaticContact CE2-CZ 3.8Å; W434-F438 HydrophobicContact CE3-CE2 4.08Å; W434-F438 AromaticContact CH2-CE2 3.5Å; W434-F438 HydrophobicContact CH2-CE2 3.5Å; W434-F438 VanDerWaalsContact CH2-CE2 3.5Å; W434-F438 AromaticContact CH2-CZ 3.74Å; W434-F438 HydrophobicContact CH2-CZ 3.74Å; W434-F438 AromaticContact CZ2-CE2 3.4Å; W434-F438 HydrophobicContact CZ2-CE2 3.4Å; W434-F438 VanDerWaalsContact CZ2-CE2 3.4Å; W434-F438 AromaticContact CZ2-CZ 3.34Å; W434-F438 HydrophobicContact CZ2-CZ 3.34Å; W434-F438 AromaticContact CZ3-CE2 3.88Å; W434-F438 HydrophobicContact CZ3-CE2 3.88Å; W434-F438 WeakPolarHBondContact O-CD2 3.29Å; I435-F438 PolarHBondContact O-N 3.17Å; I435-F438 VanDerWaalsContact O-N 3.15Å; K436-F438 VanDerWaalsContact C-N 3.25Å; K436-F438 PolarHBondContact O-N 3.49Å; F438-F440 HydrophobicContact CB-CD2 3.64Å; F438-F440 HydrophobicContact CB-CE2 3.44Å; F438-F440 VanDerWaalsContact CB-CE2 3.44Å; F438-F440 HydrophobicContact CB-CG 4.32Å; F438-F440 HydrophobicContact CB-CZ 3.96Å; F438-F440 HydrophobicContact CD2-CE2 4.04Å; F438-F440 HydrophobicContact CG-CD2 4.49Å; F438-F440 AromaticContact CG-CE2 3.93Å; F438-F440 HydrophobicContact CG-CE2 3.93Å; F438-F440 HydrophobicContact CG-CZ 4.47Å; F438-F440 PolarHBondContact O-N 3.46Å
439	N	58.6	Low	65.7	Low	99 Å²	99	53.7 Å²	53.7	53%	0.529	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	22.8	-177.4	-101.3	-31.8	0	0	0	114.7	Y300 K436 S437	Y300-N439 WeakPolarHBondContact CE1-ND2 3.46Å; Y300-N439 PolarHBondContact OH-ND2 3.1Å; K436-N439 PolarHBondContact O-N 2.75Å; S437-N439 PolarHBondContact O-N 3.41Å
440	F	63.7	Low	66.4	Low	75 Å²	75	48 Å²	48	33%	0.329	26%	0.259	S	S	.	.			trans	-59.6	151.5	165.2	-64.1	-51.4	0	0	0	110.4	I435 F438 E444 L448	I435-F440 HydrophobicContact CG2-CD2 3.96Å; I435-F440 HydrophobicContact CG2-CE2 4.46Å; F438-F440 HydrophobicContact CB-CD2 3.64Å; F438-F440 HydrophobicContact CB-CE2 3.44Å; F438-F440 VanDerWaalsContact CB-CE2 3.44Å; F438-F440 HydrophobicContact CB-CG 4.32Å; F438-F440 HydrophobicContact CB-CZ 3.96Å; F438-F440 HydrophobicContact CD2-CE2 4.04Å; F438-F440 HydrophobicContact CG-CD2 4.49Å; F438-F440 AromaticContact CG-CE2 3.93Å; F438-F440 HydrophobicContact CG-CE2 3.93Å; F438-F440 HydrophobicContact CG-CZ 4.47Å; F438-F440 PolarHBondContact O-N 3.46Å; F440-E444 HydrophobicContact CB-CB 4.03Å; F440-L448 HydrophobicContact CE2-CD2 4.28Å
441	S	57.8	Low	66.8	Low	56 Å²	56	48.9 Å²	48.9	39%	0.392	27%	0.265	S	S	.	.			trans	-59.9	159.7	168.5	66.3	0	0	0	0	110.5	G443 E444 T445	S441-G443 VanDerWaalsContact C-N 3.27Å; S441-G443 PolarHBondContact O-N 3.32Å; S441-E444 VanDerWaalsContact CB-OE2 3.25Å; S441-E444 WeakPolarHBondContact CB-OE2 3.41Å; S441-E444 PolarHBondContact N-OE2 3.16Å; S441-E444 PolarHBondContact O-N 3.22Å; S441-E444 WeakPolarHBondContact OG-CB 3.4Å; S441-E444 WeakPolarHBondContact OG-CG 3.48Å; S441-E444 PolarHBondContact OG-N 2.98Å; S441-E444 PolarHBondContact OG-OE2 3.19Å; S441-T445 WeakPolarHBondContact O-CB 3.45Å; S441-T445 PolarHBondContact O-N 3.14Å; S441-T445 PolarHBondContact O-OG1 3.4Å
442	E	60.4	Low	67.1	Low	108 Å²	108	50.6 Å²	50.6	51%	0.505	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-36.4	-178.8	-167	136.2	-119.4	0	0	111.7	K436 T445 I446	K436-E442 IonicContact NZ-OE1 3.65Å; K436-E442 PolarHBondContact NZ-OE1 3.13Å; E442-T445 WeakPolarHBondContact O-CB 3.48Å; E442-T445 PolarHBondContact O-N 2.99Å; E442-I446 HydrophobicContact CG-CD1 4.07Å; E442-I446 WeakPolarHBondContact O-CB 3.38Å; E442-I446 WeakPolarHBondContact O-CD1 3.31Å; E442-I446 VanDerWaalsContact O-CG1 3.25Å; E442-I446 WeakPolarHBondContact O-CG1 3.42Å; E442-I446 PolarHBondContact O-N 2.92Å
443	G	58.8	Low	67.4	Low	32 Å²	32	49.8 Å²	49.8	33%	0.33	27%	0.269	S	S	.	.	H	α-helix	trans	-63	-47.8	172.6	0	0	0	0	0	113.1	S441 T445 I446 A447	S441-G443 VanDerWaalsContact C-N 3.27Å; S441-G443 PolarHBondContact O-N 3.32Å; G443-T445 VanDerWaalsContact C-N 3.32Å; G443-T445 PolarHBondContact O-N 3.49Å; G443-I446 PolarHBondContact O-N 2.98Å; G443-A447 VanDerWaalsContact O-CB 3.3Å; G443-A447 WeakPolarHBondContact O-CB 3.16Å; G443-A447 PolarHBondContact O-N 3.26Å
444	E	62.5	Low	67.7	Low	97 Å²	97	47.5 Å²	47.5	45%	0.453	25%	0.25	S	S	.	.	H	α-helix	trans	-63.1	-37.9	174.5	-71	162	144.2	0	0	112	F440 S441 A447 L448	F440-E444 HydrophobicContact CB-CB 4.03Å; S441-E444 VanDerWaalsContact CB-OE2 3.25Å; S441-E444 WeakPolarHBondContact CB-OE2 3.41Å; S441-E444 PolarHBondContact N-OE2 3.16Å; S441-E444 PolarHBondContact O-N 3.22Å; S441-E444 WeakPolarHBondContact OG-CB 3.4Å; S441-E444 WeakPolarHBondContact OG-CG 3.48Å; S441-E444 PolarHBondContact OG-N 2.98Å; S441-E444 PolarHBondContact OG-OE2 3.19Å; E444-A447 PolarHBondContact O-N 3.1Å; E444-L448 VanDerWaalsContact O-CB 3.25Å; E444-L448 WeakPolarHBondContact O-CB 3.23Å; E444-L448 PolarHBondContact O-N 3.41Å
445	T	66.2	Low	68.2	Low	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-46	176.1	-60.4	0	0	0	0	111	F432 I435 K436 S441 E442 G443 Y449	F432-T445 HydrophobicContact CD2-CG2 4.24Å; F432-T445 HydrophobicContact CE1-CG2 4.38Å; F432-T445 HydrophobicContact CE2-CG2 3.78Å; F432-T445 HydrophobicContact CZ-CG2 3.85Å; I435-T445 HydrophobicContact CB-CG2 4.2Å; I435-T445 HydrophobicContact CG2-CG2 3.85Å; K436-T445 HydrophobicContact CB-CG2 4.21Å; S441-T445 WeakPolarHBondContact O-CB 3.45Å; S441-T445 PolarHBondContact O-N 3.14Å; S441-T445 PolarHBondContact O-OG1 3.4Å; E442-T445 WeakPolarHBondContact O-CB 3.48Å; E442-T445 PolarHBondContact O-N 2.99Å; G443-T445 VanDerWaalsContact C-N 3.32Å; G443-T445 PolarHBondContact O-N 3.49Å; T445-Y449 WeakPolarHBondContact O-CB 3.26Å; T445-Y449 PolarHBondContact O-N 2.99Å
446	I	66.9	Low	68.6	Low	20 Å²	20	48 Å²	48	10%	0.103	25%	0.254	C	S	.	.	H	α-helix	trans	-68.4	-44.4	177.5	-68.3	163.5	0	0	0	110.7	F432 E442 G443 L448 Y449 T450 Y588 Y619	F432-I446 HydrophobicContact CE2-CG1 4.09Å; F432-I446 HydrophobicContact CZ-CG1 4.36Å; E442-I446 HydrophobicContact CG-CD1 4.07Å; E442-I446 WeakPolarHBondContact O-CB 3.38Å; E442-I446 WeakPolarHBondContact O-CD1 3.31Å; E442-I446 VanDerWaalsContact O-CG1 3.25Å; E442-I446 WeakPolarHBondContact O-CG1 3.42Å; E442-I446 PolarHBondContact O-N 2.92Å; G443-I446 PolarHBondContact O-N 2.98Å; I446-L448 PolarHBondContact O-N 3.12Å; I446-Y449 PolarHBondContact O-N 3.06Å; I446-T450 HydrophobicContact CG2-CG2 4.16Å; I446-T450 WeakPolarHBondContact O-CB 3.21Å; I446-T450 WeakPolarHBondContact O-CG2 3.42Å; I446-T450 PolarHBondContact O-N 3.09Å; I446-T450 PolarHBondContact O-OG1 3.48Å; I446-Y588 HydrophobicContact CD1-CD1 4.43Å; I446-Y588 HydrophobicContact CD1-CE1 4.11Å; I446-Y588 HydrophobicContact CG2-CD1 3.82Å; I446-Y588 HydrophobicContact CG2-CE1 4.44Å; I446-Y588 HydrophobicContact CG2-CG 4.32Å; I446-Y619 HydrophobicContact CG2-CD2 3.74Å; I446-Y619 HydrophobicContact CG2-CE2 4.22Å; I446-Y619 HydrophobicContact CG2-CG 4.07Å
447	A	65.2	Low	69.2	Low	20 Å²	20	43.3 Å²	43.3	17%	0.165	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-41.9	177.7	0	0	0	0	0	112.1	G443 E444 T450 L451 L620 Y639	G443-A447 VanDerWaalsContact O-CB 3.3Å; G443-A447 WeakPolarHBondContact O-CB 3.16Å; G443-A447 PolarHBondContact O-N 3.26Å; E444-A447 PolarHBondContact O-N 3.1Å; A447-T450 WeakPolarHBondContact CA-OG1 3.42Å; A447-T450 PolarHBondContact O-OG1 2.93Å; A447-L451 WeakPolarHBondContact O-CB 3.42Å; A447-L451 PolarHBondContact O-N 3.14Å; A447-L620 HydrophobicContact CB-CD2 4.29Å; A447-Y639 HydrophobicContact CB-CE1 4.34Å
448	L	71.9	Confident	69.8	Low	71 Å²	71	40.1 Å²	40.1	37%	0.372	21%	0.211	S	C	.	.	H	α-helix	trans	-69.3	-43.4	175.4	-157.8	87.3	0	0	0	111.5	I435 F440 E444 I446 L451 L452	I435-L448 HydrophobicContact CD1-CD2 4.38Å; I435-L448 HydrophobicContact CG1-CD2 4.38Å; I435-L448 HydrophobicContact CG2-CB 4.32Å; I435-L448 HydrophobicContact CG2-CD2 3.78Å; F440-L448 HydrophobicContact CE2-CD2 4.28Å; E444-L448 VanDerWaalsContact O-CB 3.25Å; E444-L448 WeakPolarHBondContact O-CB 3.23Å; E444-L448 PolarHBondContact O-N 3.41Å; I446-L448 PolarHBondContact O-N 3.12Å; L448-L451 PolarHBondContact O-N 3.33Å; L448-L452 HydrophobicContact CD2-CD1 4.08Å; L448-L452 HydrophobicContact CG-CD1 4Å; L448-L452 HydrophobicContact CG-CG 4.5Å; L448-L452 WeakPolarHBondContact O-CB 3.39Å; L448-L452 WeakPolarHBondContact O-CG 3.5Å; L448-L452 PolarHBondContact O-N 2.87Å
449	Y	75	Confident	70.2	Confident	17 Å²	17	38 Å²	38	7%	0.067	20%	0.201	C	C	.	.	H	α-helix	trans	-60.9	-47.5	177.9	177.8	-98	0	0	0	111.8	F432 I435 T445 I446 L452 R453 Y588 N589	F432-Y449 HydrophobicContact CB-CD2 4.22Å; F432-Y449 HydrophobicContact CB-CE2 4.25Å; F432-Y449 HydrophobicContact CD2-CD1 4.31Å; F432-Y449 HydrophobicContact CD2-CD2 4.06Å; F432-Y449 AromaticContact CD2-CG 3.93Å; F432-Y449 HydrophobicContact CD2-CG 3.93Å; I435-Y449 HydrophobicContact CD1-CD2 4.13Å; T445-Y449 WeakPolarHBondContact O-CB 3.26Å; T445-Y449 PolarHBondContact O-N 2.99Å; I446-Y449 PolarHBondContact O-N 3.06Å; Y449-L452 PolarHBondContact O-N 2.88Å; Y449-R453 HydrophobicContact CE2-CB 4.47Å; Y449-R453 WeakPolarHBondContact O-CB 3.23Å; Y449-R453 PolarHBondContact O-N 3.37Å; Y449-R453 WeakPolarHBondContact OH-CD 3.37Å; Y449-R453 PolarHBondContact OH-NH1 3.04Å; Y449-Y588 WeakPolarHBondContact CE1-O 3.37Å; Y449-N589 WeakPolarHBondContact CE1-OD1 3.41Å; Y449-N589 PolarHBondContact OH-OD1 3.02Å; Y449-N589 VanDerWaalsContact OH-OD1 3.11Å
450	T	74.6	Confident	70.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.6	-36.6	177.5	53.6	0	0	0	0	112.1	I446 A447 G454 Y588 Y619	I446-T450 HydrophobicContact CG2-CG2 4.16Å; I446-T450 WeakPolarHBondContact O-CB 3.21Å; I446-T450 WeakPolarHBondContact O-CG2 3.42Å; I446-T450 PolarHBondContact O-N 3.09Å; I446-T450 PolarHBondContact O-OG1 3.48Å; A447-T450 WeakPolarHBondContact CA-OG1 3.42Å; A447-T450 PolarHBondContact O-OG1 2.93Å; T450-G454 VanDerWaalsContact O-CA 3.23Å; T450-G454 WeakPolarHBondContact O-CA 3.11Å; T450-G454 PolarHBondContact O-N 2.84Å; T450-Y588 WeakPolarHBondContact CG2-O 3.08Å; T450-Y619 HydrophobicContact CG2-CD2 4.33Å; T450-Y619 HydrophobicContact CG2-CE2 3.45Å; T450-Y619 VanDerWaalsContact CG2-CE2 3.45Å
451	L	73.1	Confident	70.7	Confident	65 Å²	65	34.3 Å²	34.3	34%	0.34	19%	0.191	S	C	.	.	H	α-helix	trans	-69.7	-32.2	174.2	-174.9	140.6	0	0	0	113.2	A447 L448 R568 P642 I645	A447-L451 WeakPolarHBondContact O-CB 3.42Å; A447-L451 PolarHBondContact O-N 3.14Å; L448-L451 PolarHBondContact O-N 3.33Å; L451-R568 PolarHBondContact O-NH1 3.04Å; L451-R568 PolarHBondContact O-NH2 3.38Å; L451-P642 HydrophobicContact CD1-CG 4.37Å; L451-I645 HydrophobicContact CD1-CD1 4.31Å
452	L	74.7	Confident	71	Confident	40 Å²	40	34.5 Å²	34.5	21%	0.209	19%	0.189	C	C	.	.	H	α-helix	trans	-83	-26.4	177.3	-67.2	171.2	0	0	0	113.5	I435 L448 Y449 I563 R564	I435-L452 HydrophobicContact CD1-CD1 4.15Å; L448-L452 HydrophobicContact CD2-CD1 4.08Å; L448-L452 HydrophobicContact CG-CD1 4Å; L448-L452 HydrophobicContact CG-CG 4.5Å; L448-L452 WeakPolarHBondContact O-CB 3.39Å; L448-L452 WeakPolarHBondContact O-CG 3.5Å; L448-L452 PolarHBondContact O-N 2.87Å; Y449-L452 PolarHBondContact O-N 2.88Å; L452-I563 HydrophobicContact CD2-CD1 4.34Å; L452-I563 HydrophobicContact CD2-CG1 4.16Å; L452-R564 PolarHBondContact O-N 2.88Å; L452-R564 VanDerWaalsContact O-N 3.13Å
453	R	76.9	Confident	71	Confident	36 Å²	36	33.3 Å²	33.3	14%	0.136	20%	0.198	C	C	.	.	H	α-helix	trans	-133	-15.3	-164.8	-137.4	178.2	-168	-127.5	-9.1	116.4	N428 Y449 R564	N428-R453 PolarHBondContact OD1-NH2 3.35Å; Y449-R453 HydrophobicContact CE2-CB 4.47Å; Y449-R453 WeakPolarHBondContact O-CB 3.23Å; Y449-R453 PolarHBondContact O-N 3.37Å; Y449-R453 WeakPolarHBondContact OH-CD 3.37Å; Y449-R453 PolarHBondContact OH-NH1 3.04Å; R453-R564 HydrophobicContact CG-CB 3.98Å
454	G	77.2	Confident	71	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.206	C	C	.	.			trans	-73.3	148.3	-172.7	0	0	0	0	0	114.4	T450 N589	T450-G454 VanDerWaalsContact O-CA 3.23Å; T450-G454 WeakPolarHBondContact O-CA 3.11Å; T450-G454 PolarHBondContact O-N 2.84Å; G454-N589 CarbonylContact C-O 3.57Å; G454-N589 WeakPolarHBondContact CA-O 3.23Å
455	Y	80.2	Confident	70.8	Confident	30 Å²	30	32 Å²	32	12%	0.118	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	147.8	178.3	-61.5	-86.4	0	0	0	112.4	R564 G567 R568 Q570 L584 N589 L591 S592	Y455-R564 PolarHBondContact OH-NH1 3.45Å; Y455-R564 PolarHBondContact OH-NH2 2.93Å; Y455-G567 VanDerWaalsContact CD1-O 3.24Å; Y455-G567 WeakPolarHBondContact CD1-O 3.46Å; Y455-G567 WeakPolarHBondContact CE1-O 3.42Å; Y455-R568 CarbonylContact C-O 3.59Å; Y455-R568 VanDerWaalsContact CA-O 3.26Å; Y455-R568 WeakPolarHBondContact CA-O 3.36Å; Y455-Q570 HydrophobicContact CD1-CG 4.2Å; Y455-Q570 HydrophobicContact CE1-CG 4.48Å; Y455-L584 HydrophobicContact CD2-CD1 3.74Å; Y455-L584 HydrophobicContact CD2-CD2 3.5Å; Y455-L584 VanDerWaalsContact CD2-CD2 3.5Å; Y455-L584 HydrophobicContact CD2-CG 4.22Å; Y455-L584 HydrophobicContact CE2-CD1 4.35Å; Y455-L584 HydrophobicContact CE2-CD2 3.39Å; Y455-L584 HydrophobicContact CG-CD1 4.14Å; Y455-N589 HydrophobicContact CD2-CB 4.14Å; Y455-N589 VanDerWaalsContact CD2-O 3.29Å; Y455-N589 WeakPolarHBondContact CD2-O 3.38Å; Y455-N589 HydrophobicContact CE2-CB 4.22Å; Y455-N589 PolarHBondContact N-O 2.88Å; Y455-L591 WeakPolarHBondContact O-CB 3.36Å; Y455-L591 PolarHBondContact O-N 3.38Å; Y455-S592 PolarHBondContact O-N 2.97Å
456	V	79.4	Confident	70.5	Confident	18 Å²	18	35.6 Å²	35.6	11%	0.109	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.9	164.9	177.1	0	0	0	0	108.1	R568 I569 Q570 L591 S592 V594	V456-R568 PolarHBondContact N-O 2.8Å; V456-I569 HydrophobicContact CB-CG1 4.44Å; V456-I569 WeakPolarHBondContact O-CA 3.44Å; V456-Q570 PolarHBondContact O-N 2.94Å; V456-L591 HydrophobicContact CG2-CB 4.37Å; V456-L591 HydrophobicContact CG2-CD2 3.97Å; V456-L591 HydrophobicContact CG2-CG 4.48Å; V456-S592 WeakPolarHBondContact CA-O 3.32Å; V456-V594 HydrophobicContact CG1-CG2 4.18Å
457	L	79.6	Confident	70.1	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.7	176.7	-52.8	-175.5	0	0	0	110.7	Q570 V572 L577 V581 L584 L590 S592 T593 V594	L457-Q570 CarbonylContact C-O 3.47Å; L457-Q570 WeakPolarHBondContact CA-O 3.46Å; L457-Q570 HydrophobicContact CD2-CB 3.9Å; L457-V572 HydrophobicContact CD2-CG2 4.12Å; L457-L577 HydrophobicContact CB-CD1 3.7Å; L457-L577 HydrophobicContact CD1-CD1 3.88Å; L457-L577 HydrophobicContact CG-CD1 4.47Å; L457-V581 HydrophobicContact CD1-CG2 3.84Å; L457-L584 HydrophobicContact CD1-CD1 4.18Å; L457-L584 HydrophobicContact CD2-CD1 3.93Å; L457-L584 HydrophobicContact CG-CD1 4.34Å; L457-L590 HydrophobicContact CD1-CD1 4.12Å; L457-L590 HydrophobicContact CG-CD1 4.01Å; L457-S592 PolarHBondContact N-O 3.31Å; L457-T593 HydrophobicContact CB-CG2 4.12Å; L457-T593 HydrophobicContact CD1-CG2 4.19Å; L457-T593 HydrophobicContact CG-CG2 4.42Å; L457-T593 CarbonylContact O-C 3.53Å; L457-T593 WeakPolarHBondContact O-CA 3.11Å; L457-V594 PolarHBondContact O-N 3.37Å
458	L	78.2	Confident	69.5	Low	13 Å²	13	44 Å²	44	7%	0.068	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.5	178.5	-70.4	140.7	0	0	0	111.2	L469 I569 Q570 V571 V572 V594 F596	L458-L469 HydrophobicContact CD1-CD1 3.77Å; L458-L469 HydrophobicContact CD1-CD2 3.54Å; L458-L469 HydrophobicContact CD1-CG 4.35Å; L458-I569 HydrophobicContact CD1-CG2 3.2Å; L458-I569 HydrophobicContact CG-CG2 4.48Å; L458-Q570 PolarHBondContact N-O 3.27Å; L458-V571 HydrophobicContact CB-CG2 4.33Å; L458-V571 HydrophobicContact CD1-CG2 4.41Å; L458-V571 WeakPolarHBondContact O-CA 3.44Å; L458-V572 PolarHBondContact O-N 2.64Å; L458-V594 CarbonylContact C-O 3.59Å; L458-V594 WeakPolarHBondContact CA-O 3.42Å; L458-V594 HydrophobicContact CD2-CB 3.7Å; L458-V594 HydrophobicContact CD2-CG1 3.84Å; L458-V594 HydrophobicContact CD2-CG2 4.28Å; L458-V594 HydrophobicContact CG-CB 4.32Å; L458-F596 HydrophobicContact CD2-CE2 3.7Å; L458-F596 HydrophobicContact CD2-CZ 4.4Å
459	S	73.9	Confident	68.8	Low	1 Å²	1	42 Å²	42	1%	0.007	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	149	179.1	-172.5	0	0	0	0	110.7	V572 S574 V594 E595 F596	S459-V572 WeakPolarHBondContact CA-O 3.22Å; S459-V572 WeakPolarHBondContact CB-O 3.26Å; S459-V572 PolarHBondContact OG-O 3.06Å; S459-S574 WeakPolarHBondContact OG-CA 3.45Å; S459-S574 PolarHBondContact OG-N 2.81Å; S459-S574 PolarHBondContact OG-OG 2.87Å; S459-V594 PolarHBondContact N-O 3.48Å; S459-E595 CarbonylContact O-C 3.59Å; S459-E595 WeakPolarHBondContact O-CA 3.33Å; S459-F596 PolarHBondContact O-N 2.76Å
460	P	66.4	Low	67.9	Low	33 Å²	33	49 Å²	49	21%	0.214	27%	0.267	C	S	.	.	S	Bend	cis	-79	163.6	-14.7	34.4	-35.2	0	0	0	112.1	T462 F596	P460-T462 PolarHBondContact O-N 2.92Å; P460-F596 VanDerWaalsContact CD-O 3.3Å; P460-F596 WeakPolarHBondContact CD-O 3.15Å
461	P	65.3	Low	66.9	Low	64 Å²	64	53.4 Å²	53.4	42%	0.416	29%	0.287	S	S	.	.			trans	-67	101.9	174.9	26.1	-34.2	0	0	0	112.4	V571 T573	P461-V571 HydrophobicContact CB-CG1 3.73Å; P461-T573 HydrophobicContact CG-CG2 4.07Å
462	T	64	Low	66	Low	59 Å²	59	52.3 Å²	52.3	36%	0.362	28%	0.281	S	S	.	.			trans	-101.4	143.3	168.8	57.7	0	0	0	0	111.1	P460 T464 A465 N466	P460-T462 PolarHBondContact O-N 2.92Å; T462-T464 VanDerWaalsContact C-N 3.32Å; T462-T464 PolarHBondContact O-N 3.34Å; T462-A465 PolarHBondContact O-N 2.76Å; T462-A465 WeakPolarHBondContact OG1-CB 3.25Å; T462-A465 PolarHBondContact OG1-N 3.42Å; T462-N466 PolarHBondContact O-N 3.13Å
463	A	61.7	Low	65.1	Low	84 Å²	84	52.3 Å²	52.3	69%	0.694	29%	0.285	S	S	*	.	H	α-helix	trans	-61.1	-41.1	-177.8	0	0	0	0	0	112.2	N466 E467	A463-N466 PolarHBondContact O-N 3.23Å; A463-E467 PolarHBondContact O-N 2.84Å
464	T	58.4	Low	64.1	Low	80 Å²	80	54.8 Å²	54.8	49%	0.491	30%	0.301	S	S	.	.	H	α-helix	trans	-63.3	-40.6	175.8	47.8	0	0	0	0	112.5	T462 K468	T462-T464 VanDerWaalsContact C-N 3.32Å; T462-T464 PolarHBondContact O-N 3.34Å; T464-K468 WeakPolarHBondContact O-CB 3.44Å; T464-K468 PolarHBondContact O-N 3.39Å
465	A	58	Low	62.9	Low	22 Å²	22	59.5 Å²	59.5	18%	0.182	33%	0.326	C	S	.	.	H	α-helix	trans	-64.6	-50.2	173	0	0	0	0	0	110.8	T462 E467 K468 L469	T462-A465 PolarHBondContact O-N 2.76Å; T462-A465 WeakPolarHBondContact OG1-CB 3.25Å; T462-A465 PolarHBondContact OG1-N 3.42Å; A465-E467 VanDerWaalsContact C-N 3.33Å; A465-E467 PolarHBondContact O-N 2.87Å; A465-K468 PolarHBondContact O-N 2.84Å; A465-L469 HydrophobicContact CB-CD1 3.96Å; A465-L469 WeakPolarHBondContact O-CB 3.26Å; A465-L469 WeakPolarHBondContact O-CD1 3.34Å; A465-L469 WeakPolarHBondContact O-CG 3.41Å; A465-L469 PolarHBondContact O-N 3.42Å
466	N	59.3	Low	61.9	Low	75 Å²	75	59.3 Å²	59.3	40%	0.401	33%	0.326	S	S	.	.	H	α-helix	trans	-57.2	-41.3	-178.2	-87.7	-31.5	0	0	0	113.6	T462 A463 V571	T462-N466 PolarHBondContact O-N 3.13Å; A463-N466 PolarHBondContact O-N 3.23Å; N466-V571 WeakPolarHBondContact OD1-CG2 3.29Å
467	E	59.1	Low	61	Low	154 Å²	154	61.6 Å²	61.6	72%	0.72	34%	0.338	S	S	*	.	H	α-helix	trans	-73.2	-31.5	-178.5	-160.3	173.6	-135	0	0	112.7	A463 A465	A463-E467 PolarHBondContact O-N 2.84Å; A465-E467 VanDerWaalsContact C-N 3.33Å; A465-E467 PolarHBondContact O-N 2.87Å
468	K	52	Low	60.3	Low	62 Å²	62	64.6 Å²	64.6	27%	0.27	35%	0.351	S	S	.	.	H	α-helix	trans	-90.7	-24.9	178.6	-81.2	-92.8	-179.9	179.7	0	114.2	T464 A465 K470 Q471 L472 L657	T464-K468 WeakPolarHBondContact O-CB 3.44Å; T464-K468 PolarHBondContact O-N 3.39Å; A465-K468 PolarHBondContact O-N 2.84Å; K468-K470 PolarHBondContact O-N 2.92Å; K468-Q471 WeakPolarHBondContact O-CA 3.16Å; K468-Q471 WeakPolarHBondContact O-CB 3.11Å; K468-Q471 PolarHBondContact O-N 3.31Å; K468-L472 PolarHBondContact O-N 2.97Å; K468-L657 HydrophobicContact CB-CD2 4.09Å; K468-L657 HydrophobicContact CD-CD2 3.75Å; K468-L657 HydrophobicContact CD-CG 4.47Å; K468-L657 HydrophobicContact CG-CD2 3.64Å
469	L	58.8	Low	59.7	Low	28 Å²	28	66.5 Å²	66.5	15%	0.147	36%	0.359	C	S	.	.	H	α-helix	trans	-63	-26.4	168.4	-80.1	160.6	0	0	0	111.9	L458 A465 Q471 L472 S473 I569 V571	L458-L469 HydrophobicContact CD1-CD1 3.77Å; L458-L469 HydrophobicContact CD1-CD2 3.54Å; L458-L469 HydrophobicContact CD1-CG 4.35Å; A465-L469 HydrophobicContact CB-CD1 3.96Å; A465-L469 WeakPolarHBondContact O-CB 3.26Å; A465-L469 WeakPolarHBondContact O-CD1 3.34Å; A465-L469 WeakPolarHBondContact O-CG 3.41Å; A465-L469 PolarHBondContact O-N 3.42Å; L469-Q471 PolarHBondContact O-N 3.21Å; L469-L472 HydrophobicContact CD2-CD1 3.62Å; L469-L472 WeakPolarHBondContact O-CB 3.12Å; L469-L472 PolarHBondContact O-N 3.04Å; L469-S473 PolarHBondContact O-N 3.41Å; L469-I569 HydrophobicContact CD2-CG2 4.1Å; L469-V571 HydrophobicContact CD1-CG2 3.79Å
470	K	55.7	Low	59.2	Low	166 Å²	166	68.4 Å²	68.4	72%	0.722	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.2	166.1	-86.3	179.3	174.2	173.9	0	114	K468 S473	K468-K470 PolarHBondContact O-N 2.92Å; K470-S473 PolarHBondContact O-OG 3.29Å
471	Q	53.3	Low	59.2	Low	91 Å²	91	67.9 Å²	67.9	43%	0.425	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-34.6	171.6	-54	-164.2	-46.6	0	0	110.8	K468 L469 S473 D474	K468-Q471 WeakPolarHBondContact O-CA 3.16Å; K468-Q471 WeakPolarHBondContact O-CB 3.11Å; K468-Q471 PolarHBondContact O-N 3.31Å; L469-Q471 PolarHBondContact O-N 3.21Å; Q471-S473 PolarHBondContact O-N 3.32Å; Q471-D474 PolarHBondContact O-N 3.26Å
472	L	53.7	Low	59.4	Low	42 Å²	42	67.1 Å²	67.1	22%	0.22	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-10.4	168.9	-86.9	169.4	0	0	0	114.4	K468 L469 D474 V649 A653	K468-L472 PolarHBondContact O-N 2.97Å; L469-L472 HydrophobicContact CD2-CD1 3.62Å; L469-L472 WeakPolarHBondContact O-CB 3.12Å; L469-L472 PolarHBondContact O-N 3.04Å; L472-D474 PolarHBondContact O-N 3.29Å; L472-V649 HydrophobicContact CD2-CG1 3.4Å; L472-A653 HydrophobicContact CD1-CB 3.64Å; L472-A653 HydrophobicContact CD2-CB 4.08Å; L472-A653 HydrophobicContact CG-CB 3.95Å
473	S	56.3	Low	59.6	Low	40 Å²	40	65.1 Å²	65.1	28%	0.28	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-7.6	168.2	74.2	0	0	0	0	114.1	L469 K470 Q471 L475 N476 N477	L469-S473 PolarHBondContact O-N 3.41Å; K470-S473 PolarHBondContact O-OG 3.29Å; Q471-S473 PolarHBondContact O-N 3.32Å; S473-L475 PolarHBondContact O-N 3.48Å; S473-N476 CarbonylContact O-C 3.53Å; S473-N476 WeakPolarHBondContact O-CA 3.26Å; S473-N476 VanDerWaalsContact O-CB 3.32Å; S473-N476 WeakPolarHBondContact O-CB 3.41Å; S473-N476 PolarHBondContact O-N 2.88Å; S473-N477 PolarHBondContact O-N 2.93Å
474	D	54.9	Low	59.9	Low	88 Å²	88	62.6 Å²	62.6	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-26.4	-179.6	-81.4	-16.7	0	0	0	114.4	Q471 L472 N477 F478	Q471-D474 PolarHBondContact O-N 3.26Å; L472-D474 PolarHBondContact O-N 3.29Å; D474-N477 WeakPolarHBondContact O-CB 3.25Å; D474-N477 PolarHBondContact O-N 3.5Å; D474-N477 PolarHBondContact OD1-ND2 3.44Å; D474-F478 PolarHBondContact O-N 2.95Å; D474-F478 VanDerWaalsContact O-N 3.15Å
475	L	53.9	Low	60.4	Low	100 Å²	100	59.2 Å²	59.2	52%	0.524	31%	0.307	S	S	.	.	H	α-helix	trans	-73.7	-31.8	171.9	-134.2	158.6	0	0	0	111.8	S473 F479 V649	S473-L475 PolarHBondContact O-N 3.48Å; L475-F479 HydrophobicContact CD2-CE2 4.11Å; L475-F479 WeakPolarHBondContact O-CD2 3.38Å; L475-V649 HydrophobicContact CD1-CG2 4.1Å
476	N	58.3	Low	60.8	Low	25 Å²	25	58.3 Å²	58.3	13%	0.134	30%	0.3	C	S	.	.	H	α-helix	trans	-72	-32.6	167.6	-66.6	-37.6	0	0	0	111.4	S473 F478 F479 A480 T565	S473-N476 CarbonylContact O-C 3.53Å; S473-N476 WeakPolarHBondContact O-CA 3.26Å; S473-N476 VanDerWaalsContact O-CB 3.32Å; S473-N476 WeakPolarHBondContact O-CB 3.41Å; S473-N476 PolarHBondContact O-N 2.88Å; N476-F478 VanDerWaalsContact C-N 3.34Å; N476-F478 PolarHBondContact O-N 2.94Å; N476-F479 PolarHBondContact O-N 2.87Å; N476-A480 WeakPolarHBondContact O-CB 3.16Å; N476-A480 PolarHBondContact O-N 2.93Å; N476-T565 WeakPolarHBondContact CB-O 3.38Å; N476-T565 PolarHBondContact ND2-O 3.23Å; N476-T565 PolarHBondContact OD1-O 3.07Å
477	N	61	Low	61.2	Low	66 Å²	66	61.3 Å²	61.3	35%	0.353	31%	0.306	S	S	.	.	H	α-helix	trans	-60	-43	175	-70.6	-29.4	0	0	0	110.6	S473 D474 F479 A480 I481	S473-N477 PolarHBondContact O-N 2.93Å; D474-N477 WeakPolarHBondContact O-CB 3.25Å; D474-N477 PolarHBondContact O-N 3.5Å; D474-N477 PolarHBondContact OD1-ND2 3.44Å; N477-F479 PolarHBondContact O-N 2.88Å; N477-A480 PolarHBondContact O-N 2.65Å; N477-I481 HydrophobicContact CB-CD1 4.3Å; N477-I481 WeakPolarHBondContact O-CB 3.48Å; N477-I481 VanDerWaalsContact O-CD1 3.29Å; N477-I481 WeakPolarHBondContact O-CD1 3.34Å; N477-I481 WeakPolarHBondContact O-CG1 3.44Å; N477-I481 PolarHBondContact O-N 3.18Å
478	F	64.1	Low	61.6	Low	63 Å²	63	55 Å²	55	28%	0.276	28%	0.277	S	S	.	.	H	α-helix	trans	-53.6	-52.4	175	177.9	-94.4	0	0	0	113	D474 N476 I481 L482 L1552	D474-F478 PolarHBondContact O-N 2.95Å; D474-F478 VanDerWaalsContact O-N 3.15Å; N476-F478 VanDerWaalsContact C-N 3.34Å; N476-F478 PolarHBondContact O-N 2.94Å; F478-I481 PolarHBondContact O-N 3.36Å; F478-L482 HydrophobicContact CD1-CD1 3.82Å; F478-L482 HydrophobicContact CE1-CD1 3.34Å; F478-L482 HydrophobicContact CE2-CD1 4.36Å; F478-L482 HydrophobicContact CG-CD1 4.5Å; F478-L482 HydrophobicContact CZ-CD1 3.65Å; F478-L482 PolarHBondContact O-N 2.86Å; F478-L1552 HydrophobicContact CD2-CD2 3.66Å; F478-L1552 HydrophobicContact CE2-CD2 3.35Å; F478-L1552 HydrophobicContact CZ-CD2 4.29Å
479	F	65.6	Low	62.3	Low	54 Å²	54	54 Å²	54	24%	0.237	27%	0.274	C	S	.	.	H	α-helix	trans	-71.5	-34	179.4	-71.7	-69.9	0	0	0	113.2	L475 N476 N477 L482 N483 L560 I563 T565	L475-F479 HydrophobicContact CD2-CE2 4.11Å; L475-F479 WeakPolarHBondContact O-CD2 3.38Å; N476-F479 PolarHBondContact O-N 2.87Å; N477-F479 PolarHBondContact O-N 2.88Å; F479-L482 PolarHBondContact O-N 3.48Å; F479-N483 WeakPolarHBondContact O-CB 3.28Å; F479-N483 PolarHBondContact O-N 2.91Å; F479-L560 HydrophobicContact CD1-CD2 4.31Å; F479-I563 HydrophobicContact CD1-CD1 3.7Å; F479-I563 HydrophobicContact CD1-CG2 4.47Å; F479-I563 HydrophobicContact CE1-CD1 3.73Å; F479-I563 HydrophobicContact CG-CD1 4.5Å; F479-I563 HydrophobicContact CG-CG2 4.29Å; F479-T565 HydrophobicContact CB-CG2 3.73Å
480	A	64.3	Low	62.6	Low	40 Å²	40	53.9 Å²	53.9	33%	0.331	28%	0.275	S	S	.	.	H	α-helix	trans	-66.6	-41.2	174.8	0	0	0	0	0	111.8	N476 N477 N483 A484	N476-A480 WeakPolarHBondContact O-CB 3.16Å; N476-A480 PolarHBondContact O-N 2.93Å; N477-A480 PolarHBondContact O-N 2.65Å; A480-N483 PolarHBondContact O-N 3.46Å; A480-A484 WeakPolarHBondContact O-CB 3.3Å; A480-A484 PolarHBondContact O-N 2.71Å
481	I	66.4	Low	63.1	Low	22 Å²	22	48.3 Å²	48.3	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-45.6	173.9	-71.4	164.2	0	0	0	110	N477 F478 N483 A484 T485 N1548 L1551 L1552	N477-I481 HydrophobicContact CB-CD1 4.3Å; N477-I481 WeakPolarHBondContact O-CB 3.48Å; N477-I481 VanDerWaalsContact O-CD1 3.29Å; N477-I481 WeakPolarHBondContact O-CD1 3.34Å; N477-I481 WeakPolarHBondContact O-CG1 3.44Å; N477-I481 PolarHBondContact O-N 3.18Å; F478-I481 PolarHBondContact O-N 3.36Å; I481-N483 PolarHBondContact O-N 3.17Å; I481-A484 PolarHBondContact O-N 3.13Å; I481-T485 PolarHBondContact O-N 3.24Å; I481-T485 PolarHBondContact O-OG1 3.43Å; I481-N1548 HydrophobicContact CG2-CB 3.83Å; I481-N1548 VanDerWaalsContact CG2-O 3.22Å; I481-N1548 WeakPolarHBondContact CG2-O 3.36Å; I481-L1551 HydrophobicContact CD1-CB 3.64Å; I481-L1551 HydrophobicContact CD1-CD1 4.21Å; I481-L1552 HydrophobicContact CG2-CD1 3.67Å; I481-L1552 HydrophobicContact CG2-CG 3.98Å
482	L	68.4	Low	63.5	Low	49 Å²	49	46.4 Å²	46.4	26%	0.257	25%	0.253	S	S	.	.	H	α-helix	trans	-61.2	-41	174	-85.9	164.3	0	0	0	113.1	F478 F479 A484 T485 A486 L560 L1552	F478-L482 HydrophobicContact CD1-CD1 3.82Å; F478-L482 HydrophobicContact CE1-CD1 3.34Å; F478-L482 HydrophobicContact CE2-CD1 4.36Å; F478-L482 HydrophobicContact CG-CD1 4.5Å; F478-L482 HydrophobicContact CZ-CD1 3.65Å; F478-L482 PolarHBondContact O-N 2.86Å; F479-L482 PolarHBondContact O-N 3.48Å; L482-A484 VanDerWaalsContact C-N 3.35Å; L482-T485 WeakPolarHBondContact CA-OG1 3.48Å; L482-T485 PolarHBondContact O-OG1 3.42Å; L482-A486 WeakPolarHBondContact O-CB 3.48Å; L482-A486 PolarHBondContact O-N 3.3Å; L482-L560 HydrophobicContact CB-CD1 4.1Å; L482-L560 HydrophobicContact CB-CD2 4.1Å; L482-L1552 HydrophobicContact CD2-CD1 4.49Å; L482-L1552 HydrophobicContact CG-CD1 4.43Å
483	N	68.9	Low	63.7	Low	17 Å²	17	48.8 Å²	48.8	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-39.7	176.1	-165	-28.7	0	0	0	110.6	F479 A480 I481 A486 R487 L560	F479-N483 WeakPolarHBondContact O-CB 3.28Å; F479-N483 PolarHBondContact O-N 2.91Å; A480-N483 PolarHBondContact O-N 3.46Å; I481-N483 PolarHBondContact O-N 3.17Å; N483-A486 PolarHBondContact O-N 3.19Å; N483-R487 PolarHBondContact ND2-NH2 2.94Å; N483-R487 VanDerWaalsContact O-CG 3.27Å; N483-R487 WeakPolarHBondContact O-CG 3.37Å; N483-R487 PolarHBondContact O-N 2.76Å; N483-R487 PolarHBondContact OD1-NE 3.06Å; N483-R487 PolarHBondContact OD1-NH2 3.28Å; N483-L560 HydrophobicContact CB-CB 4.35Å; N483-L560 PolarHBondContact ND2-O 2.85Å
484	A	67.6	Low	63.7	Low	30 Å²	30	50.6 Å²	50.6	25%	0.248	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-42	175.1	0	0	0	0	0	113.1	A480 I481 L482 R487 N488 N1548	A480-A484 WeakPolarHBondContact O-CB 3.3Å; A480-A484 PolarHBondContact O-N 2.71Å; I481-A484 PolarHBondContact O-N 3.13Å; L482-A484 VanDerWaalsContact C-N 3.35Å; A484-R487 PolarHBondContact O-N 2.96Å; A484-N488 PolarHBondContact O-N 3.43Å; A484-N488 PolarHBondContact O-OD1 3.38Å; A484-N1548 WeakPolarHBondContact CB-ND2 3.4Å
485	T	68.1	Low	63.5	Low	9 Å²	9	50.5 Å²	50.5	6%	0.055	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-44.3	173.7	54.4	0	0	0	0	111.4	I481 L482 R487 N488 I489 N1548 F1549	I481-T485 PolarHBondContact O-N 3.24Å; I481-T485 PolarHBondContact O-OG1 3.43Å; L482-T485 WeakPolarHBondContact CA-OG1 3.48Å; L482-T485 PolarHBondContact O-OG1 3.42Å; T485-R487 VanDerWaalsContact C-N 3.31Å; T485-R487 PolarHBondContact O-N 3.08Å; T485-N488 PolarHBondContact O-N 2.87Å; T485-I489 VanDerWaalsContact O-CG1 3.26Å; T485-I489 WeakPolarHBondContact O-CG1 3.36Å; T485-I489 PolarHBondContact O-N 3.24Å; T485-N1548 HydrophobicContact CG2-CB 3.49Å; T485-N1548 VanDerWaalsContact CG2-CB 3.49Å; T485-F1549 HydrophobicContact CG2-CD2 4.23Å; T485-F1549 HydrophobicContact CG2-CE2 4.41Å
486	A	67.4	Low	63.3	Low	4 Å²	4	50.1 Å²	50.1	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-59.5	-39.6	175.9	0	0	0	0	0	112.3	L482 N483 T490 K557 L560	L482-A486 WeakPolarHBondContact O-CB 3.48Å; L482-A486 PolarHBondContact O-N 3.3Å; N483-A486 PolarHBondContact O-N 3.19Å; A486-T490 WeakPolarHBondContact O-CG2 3.37Å; A486-T490 PolarHBondContact O-N 3.35Å; A486-T490 VanDerWaalsContact O-N 3.16Å; A486-T490 PolarHBondContact O-OG1 3.42Å; A486-K557 HydrophobicContact CB-CB 4.34Å; A486-L560 HydrophobicContact CB-CD1 3.97Å
487	R	68.1	Low	63	Low	138 Å²	138	51.8 Å²	51.8	52%	0.521	30%	0.303	S	S	.	.	H	α-helix	trans	-61	-53	173.1	-73.5	174.2	-153.7	-172.1	8.5	111.8	N483 A484 T485 I489 T490 S491	N483-R487 PolarHBondContact ND2-NH2 2.94Å; N483-R487 VanDerWaalsContact O-CG 3.27Å; N483-R487 WeakPolarHBondContact O-CG 3.37Å; N483-R487 PolarHBondContact O-N 2.76Å; N483-R487 PolarHBondContact OD1-NE 3.06Å; N483-R487 PolarHBondContact OD1-NH2 3.28Å; A484-R487 PolarHBondContact O-N 2.96Å; T485-R487 VanDerWaalsContact C-N 3.31Å; T485-R487 PolarHBondContact O-N 3.08Å; R487-I489 VanDerWaalsContact C-N 3.31Å; R487-I489 PolarHBondContact O-N 3.01Å; R487-T490 PolarHBondContact O-N 2.65Å; R487-T490 PolarHBondContact O-OG1 2.95Å; R487-S491 PolarHBondContact O-N 3.13Å; R487-S491 VanDerWaalsContact O-N 3.09Å
488	N	66.4	Low	62.5	Low	20 Å²	20	50.2 Å²	50.2	11%	0.107	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-30.8	-176.8	-70	25.5	0	0	0	112.9	A484 T485 S491 S492 E1541 Q1544 L1545	A484-N488 PolarHBondContact O-N 3.43Å; A484-N488 PolarHBondContact O-OD1 3.38Å; T485-N488 PolarHBondContact O-N 2.87Å; N488-S491 PolarHBondContact O-OG 2.92Å; N488-S492 WeakPolarHBondContact O-CB 3.48Å; N488-S492 PolarHBondContact O-N 2.85Å; N488-S492 PolarHBondContact O-OG 2.84Å; N488-E1541 PolarHBondContact ND2-O 3.07Å; N488-Q1544 WeakPolarHBondContact ND2-CB 3.27Å; N488-Q1544 PolarHBondContact ND2-OE1 2.85Å; N488-Q1544 VanDerWaalsContact ND2-OE1 3.15Å; N488-L1545 HydrophobicContact CB-CD1 4.41Å
489	I	66.4	Low	61.9	Low	42 Å²	42	52.1 Å²	52.1	22%	0.215	32%	0.317	C	S	.	.	H	α-helix	trans	-66.5	-42.6	171.3	-64.9	163.8	0	0	0	110.1	T485 R487 S491 S492 F493 I549 V553 L1545	T485-I489 VanDerWaalsContact O-CG1 3.26Å; T485-I489 WeakPolarHBondContact O-CG1 3.36Å; T485-I489 PolarHBondContact O-N 3.24Å; R487-I489 VanDerWaalsContact C-N 3.31Å; R487-I489 PolarHBondContact O-N 3.01Å; I489-S491 PolarHBondContact O-N 3.07Å; I489-S492 PolarHBondContact O-N 3.16Å; I489-F493 HydrophobicContact CG2-CD2 4.21Å; I489-I549 HydrophobicContact CG2-CG2 4.38Å; I489-V553 HydrophobicContact CB-CG1 4.2Å; I489-V553 HydrophobicContact CG2-CB 4.39Å; I489-V553 HydrophobicContact CG2-CG1 3.97Å; I489-V553 HydrophobicContact CG2-CG2 4.03Å; I489-L1545 HydrophobicContact CD1-CD1 4.39Å; I489-L1545 HydrophobicContact CG1-CD1 3.59Å
490	T	66.6	Low	61.3	Low	26 Å²	26	56 Å²	56	16%	0.16	34%	0.336	C	S	.	.	H	α-helix	trans	-69.5	-26.2	178.7	57.2	0	0	0	0	115	A486 R487 V553 K557	A486-T490 WeakPolarHBondContact O-CG2 3.37Å; A486-T490 PolarHBondContact O-N 3.35Å; A486-T490 VanDerWaalsContact O-N 3.16Å; A486-T490 PolarHBondContact O-OG1 3.42Å; R487-T490 PolarHBondContact O-N 2.65Å; R487-T490 PolarHBondContact O-OG1 2.95Å; T490-V553 HydrophobicContact CG2-CG1 3.89Å; T490-K557 HydrophobicContact CG2-CD 3.84Å; T490-K557 PolarHBondContact OG1-NZ 3.1Å
491	S	65	Low	60.8	Low	49 Å²	49	57.3 Å²	57.3	34%	0.343	34%	0.337	S	S	.	.	H	α-helix	trans	-74.2	-40.9	172.3	54.1	0	0	0	0	111.9	R487 N488 I489 F493 E1541	R487-S491 PolarHBondContact O-N 3.13Å; R487-S491 VanDerWaalsContact O-N 3.09Å; N488-S491 PolarHBondContact O-OG 2.92Å; I489-S491 PolarHBondContact O-N 3.07Å; S491-F493 VanDerWaalsContact C-N 3.34Å; S491-F493 PolarHBondContact O-N 2.87Å; S491-E1541 VanDerWaalsContact CB-OE2 3.31Å; S491-E1541 WeakPolarHBondContact CB-OE2 3.4Å; S491-E1541 PolarHBondContact OG-OE2 2.99Å
492	S	62.4	Low	60.1	Low	51 Å²	51	57.5 Å²	57.5	36%	0.357	34%	0.339	S	S	.	.	H	α-helix	trans	-67.5	-25.4	-172.2	-62.6	0	0	0	0	115.1	N488 I489	N488-S492 WeakPolarHBondContact O-CB 3.48Å; N488-S492 PolarHBondContact O-N 2.85Å; N488-S492 PolarHBondContact O-OG 2.84Å; I489-S492 PolarHBondContact O-N 3.16Å
493	F	58.2	Low	59.3	Low	92 Å²	92	64 Å²	64	40%	0.404	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	11.2	-167.6	-84.5	-81.3	0	0	0	116.4	I489 S491 A495 I550	I489-F493 HydrophobicContact CG2-CD2 4.21Å; S491-F493 VanDerWaalsContact C-N 3.34Å; S491-F493 PolarHBondContact O-N 2.87Å; F493-A495 PolarHBondContact O-N 3.02Å; F493-I550 HydrophobicContact CB-CD1 4.33Å; F493-I550 HydrophobicContact CB-CG1 4.16Å; F493-I550 WeakPolarHBondContact O-CD1 3.29Å
494	T	56.4	Low	58.7	Low	78 Å²	78	67 Å²	67	48%	0.479	38%	0.38	S	S	.	.			trans	-53.1	135.5	-176.2	52.7	0	0	0	0	114.1	A496 N497	T494-A496 PolarHBondContact O-N 3.23Å; T494-N497 PolarHBondContact O-N 2.8Å
495	A	49.2	Very low	58	Low	86 Å²	86	70.3 Å²	70.3	71%	0.711	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-60.9	-11.3	-160.7	0	0	0	0	0	117.3	F493	F493-A495 PolarHBondContact O-N 3.02Å
496	A	49.7	Very low	57.2	Low	91 Å²	91	72.5 Å²	72.5	75%	0.752	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-77.2	-19.5	-177	0	0	0	0	0	114.7	T494	T494-A496 PolarHBondContact O-N 3.23Å
497	N	51.9	Low	56.6	Low	60 Å²	60	78.4 Å²	78.4	32%	0.321	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-108.2	7.8	-167.5	-70.9	-32.6	0	0	0	115.2	T494 N501 R1538	T494-N497 PolarHBondContact O-N 2.8Å; N497-N501 PolarHBondContact O-N 3.03Å; N497-N501 PolarHBondContact O-ND2 2.92Å; N497-R1538 PolarHBondContact ND2-NH2 3.47Å
498	V	50.5	Low	56	Low	33 Å²	33	76.6 Å²	76.6	20%	0.2	43%	0.429	C	S	.	.	H	α-helix	trans	-69.7	-39.8	-166.1	-176.2	0	0	0	0	113.1	E500 T502 W542	V498-E500 VanDerWaalsContact C-N 3.31Å; V498-E500 PolarHBondContact O-N 3.29Å; V498-T502 WeakPolarHBondContact O-CG2 3.32Å; V498-T502 PolarHBondContact O-N 3.44Å; V498-T502 PolarHBondContact O-OG1 3.44Å; V498-W542 HydrophobicContact CG1-CB 3.86Å
499	S	51.7	Low	55.3	Low	103 Å²	103	79.4 Å²	79.4	72%	0.72	44%	0.444	S	S	*	.	H	α-helix	trans	-70.6	-20.6	-174.6	53.5	0	0	0	0	115.2	T502	S499-T502 PolarHBondContact O-OG1 3.19Å
500	E	53.6	Low	54.5	Low	137 Å²	137	84.2 Å²	84.2	64%	0.64	46%	0.463	S	S	*	.	H	α-helix	trans	-91.3	-42.2	-179.2	-151.9	167.5	-134.4	0	0	110.3	V498 T502 R503 T504	V498-E500 VanDerWaalsContact C-N 3.31Å; V498-E500 PolarHBondContact O-N 3.29Å; E500-T502 VanDerWaalsContact C-N 3.29Å; E500-T502 PolarHBondContact O-N 3.48Å; E500-R503 PolarHBondContact O-N 3.33Å; E500-T504 PolarHBondContact O-N 3.13Å
501	N	54.2	Low	54.1	Low	67 Å²	67	86.6 Å²	86.6	36%	0.358	48%	0.477	S	S	.	.	H	α-helix	trans	-61.9	-31.2	176.1	-72.6	-17.9	0	0	0	113.3	N497 R503 T504 F505	N497-N501 PolarHBondContact O-N 3.03Å; N497-N501 PolarHBondContact O-ND2 2.92Å; N501-R503 VanDerWaalsContact C-N 3.31Å; N501-R503 PolarHBondContact O-N 3.46Å; N501-T504 WeakPolarHBondContact CA-OG1 3.15Å; N501-T504 PolarHBondContact O-OG1 3.26Å; N501-F505 VanDerWaalsContact O-CB 3.26Å; N501-F505 WeakPolarHBondContact O-CB 3.45Å; N501-F505 PolarHBondContact O-N 2.94Å
502	T	52.5	Low	53.4	Low	25 Å²	25	88.5 Å²	88.5	15%	0.153	48%	0.482	C	S	.	.	H	α-helix	trans	-65.3	-31.9	177.1	44.6	0	0	0	0	113.5	V498 S499 E500 T506 W542	V498-T502 WeakPolarHBondContact O-CG2 3.32Å; V498-T502 PolarHBondContact O-N 3.44Å; V498-T502 PolarHBondContact O-OG1 3.44Å; S499-T502 PolarHBondContact O-OG1 3.19Å; E500-T502 VanDerWaalsContact C-N 3.29Å; E500-T502 PolarHBondContact O-N 3.48Å; T502-T506 PolarHBondContact O-N 2.83Å; T502-T506 VanDerWaalsContact O-N 3.14Å; T502-T506 PolarHBondContact O-OG1 3.39Å; T502-W542 HydrophobicContact CG2-CB 3.38Å; T502-W542 VanDerWaalsContact CG2-CD1 3.44Å; T502-W542 HydrophobicContact CG2-CD2 3.86Å; T502-W542 HydrophobicContact CG2-CG 3.25Å
503	R	50.9	Low	52.9	Low	187 Å²	187	90.9 Å²	90.9	71%	0.706	49%	0.49	S	S	*	.	H	α-helix	trans	-78.1	-42.1	179.8	-164.3	173.8	-177.2	164.8	1.2	111.4	E500 N501 F505 T506 E507	E500-R503 PolarHBondContact O-N 3.33Å; N501-R503 VanDerWaalsContact C-N 3.31Å; N501-R503 PolarHBondContact O-N 3.46Å; R503-F505 VanDerWaalsContact C-N 3.34Å; R503-F505 PolarHBondContact O-N 2.85Å; R503-T506 PolarHBondContact O-OG1 2.76Å; R503-T506 VanDerWaalsContact O-OG1 3.07Å; R503-E507 PolarHBondContact O-N 3.4Å
504	T	56.4	Low	52.5	Low	80 Å²	80	96.9 Å²	96.9	49%	0.491	51%	0.51	S	S	.	.	H	α-helix	trans	-65.9	-36.4	173.2	49.6	0	0	0	0	112.3	E500 N501 L508	E500-T504 PolarHBondContact O-N 3.13Å; N501-T504 WeakPolarHBondContact CA-OG1 3.15Å; N501-T504 PolarHBondContact O-OG1 3.26Å; T504-L508 WeakPolarHBondContact O-CB 3.49Å; T504-L508 PolarHBondContact O-N 2.86Å
505	F	53.5	Low	52.3	Low	99 Å²	99	101.6 Å²	101.6	43%	0.434	52%	0.524	S	S	.	.	H	α-helix	trans	-71.9	-36.7	179.2	-165.4	-94.4	0	0	0	112.6	N501 R503 L508 L509 W542	N501-F505 VanDerWaalsContact O-CB 3.26Å; N501-F505 WeakPolarHBondContact O-CB 3.45Å; N501-F505 PolarHBondContact O-N 2.94Å; R503-F505 VanDerWaalsContact C-N 3.34Å; R503-F505 PolarHBondContact O-N 2.85Å; F505-L508 PolarHBondContact O-N 3.31Å; F505-L509 HydrophobicContact CE1-CD1 4.5Å; F505-L509 VanDerWaalsContact O-CB 3.31Å; F505-L509 WeakPolarHBondContact O-CB 3.46Å; F505-L509 PolarHBondContact O-N 3.01Å; F505-W542 AromaticContact CD1-CH2 3.96Å; F505-W542 HydrophobicContact CD1-CH2 3.96Å; F505-W542 HydrophobicContact CD1-CZ2 4.2Å; F505-W542 AromaticContact CE1-CH2 3.99Å; F505-W542 HydrophobicContact CE1-CH2 3.99Å; F505-W542 HydrophobicContact CE1-CZ2 4.47Å
506	T	50.3	Low	52.3	Low	54 Å²	54	105.4 Å²	105.4	33%	0.331	53%	0.525	S	S	.	.	H	α-helix	trans	-65.8	-39.1	174.3	39.8	0	0	0	0	112.2	T502 R503 L509 F510	T502-T506 PolarHBondContact O-N 2.83Å; T502-T506 VanDerWaalsContact O-N 3.14Å; T502-T506 PolarHBondContact O-OG1 3.39Å; R503-T506 PolarHBondContact O-OG1 2.76Å; R503-T506 VanDerWaalsContact O-OG1 3.07Å; T506-L509 PolarHBondContact O-N 2.98Å; T506-F510 PolarHBondContact O-N 2.93Å
507	E	54	Low	52.1	Low	129 Å²	129	104.3 Å²	104.3	60%	0.603	52%	0.523	S	S	*	.	H	α-helix	trans	-66.4	-44	172.5	-71.3	-170.1	-172.5	0	0	112.5	R503 L509 F510 V511	R503-E507 PolarHBondContact O-N 3.4Å; E507-L509 VanDerWaalsContact C-N 3.31Å; E507-L509 PolarHBondContact O-N 3.01Å; E507-F510 PolarHBondContact O-N 3.32Å; E507-V511 WeakPolarHBondContact O-CG2 3.43Å; E507-V511 PolarHBondContact O-N 3.29Å
508	L	55.3	Low	51.5	Low	99 Å²	99	107.2 Å²	107.2	52%	0.518	54%	0.537	S	S	.	.	H	α-helix	trans	-60.5	-38.8	175.3	-108.5	156.3	0	0	0	112.7	T504 F505 V511 M512	T504-L508 WeakPolarHBondContact O-CB 3.49Å; T504-L508 PolarHBondContact O-N 2.86Å; F505-L508 PolarHBondContact O-N 3.31Å; L508-V511 PolarHBondContact O-N 3.18Å; L508-M512 WeakPolarHBondContact O-CB 3.27Å; L508-M512 WeakPolarHBondContact O-CG 3.42Å; L508-M512 PolarHBondContact O-N 2.92Å
509	L	52.2	Low	51.2	Low	80 Å²	80	110.5 Å²	110.5	42%	0.419	56%	0.559	S	S	.	*	H	α-helix	trans	-65.5	-44.8	175.6	-164.3	76	0	0	0	111.1	F505 T506 E507 V511 M512 L513	F505-L509 HydrophobicContact CE1-CD1 4.5Å; F505-L509 VanDerWaalsContact O-CB 3.31Å; F505-L509 WeakPolarHBondContact O-CB 3.46Å; F505-L509 PolarHBondContact O-N 3.01Å; T506-L509 PolarHBondContact O-N 2.98Å; E507-L509 VanDerWaalsContact C-N 3.31Å; E507-L509 PolarHBondContact O-N 3.01Å; L509-V511 VanDerWaalsContact C-N 3.33Å; L509-V511 PolarHBondContact O-N 3.22Å; L509-M512 PolarHBondContact O-N 3.04Å; L509-L513 HydrophobicContact CG-CD1 4.19Å; L509-L513 WeakPolarHBondContact O-CB 3.4Å; L509-L513 VanDerWaalsContact O-CG 3.32Å; L509-L513 WeakPolarHBondContact O-CG 3.46Å; L509-L513 PolarHBondContact O-N 3.36Å
510	F	50.9	Low	50.4	Low	143 Å²	143	115.4 Å²	115.4	63%	0.627	57%	0.568	S	S	*	*	H	α-helix	trans	-59.9	-40.4	173.8	-105.2	-79.3	0	0	0	112.6	T506 E507 R514	T506-F510 PolarHBondContact O-N 2.93Å; E507-F510 PolarHBondContact O-N 3.32Å; F510-R514 PolarHBondContact O-N 2.81Å; F510-R514 VanDerWaalsContact O-N 3.14Å
511	V	56.3	Low	50.1	Low	76 Å²	76	112 Å²	112	46%	0.461	57%	0.57	S	S	.	*	H	α-helix	trans	-69.2	-40.2	177.4	170.3	0	0	0	0	111.6	E507 L508 L509 K515	E507-V511 WeakPolarHBondContact O-CG2 3.43Å; E507-V511 PolarHBondContact O-N 3.29Å; L508-V511 PolarHBondContact O-N 3.18Å; L509-V511 VanDerWaalsContact C-N 3.33Å; L509-V511 PolarHBondContact O-N 3.22Å; V511-K515 PolarHBondContact O-N 3.19Å
512	M	50.8	Low	49.7	Very low	88 Å²	88	116 Å²	116	43%	0.433	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-47.2	176	-77	-161.2	-79.4	0	0	111.8	L508 L509 R514 K515 F516	L508-M512 WeakPolarHBondContact O-CB 3.27Å; L508-M512 WeakPolarHBondContact O-CG 3.42Å; L508-M512 PolarHBondContact O-N 2.92Å; L509-M512 PolarHBondContact O-N 3.04Å; M512-R514 VanDerWaalsContact C-N 3.28Å; M512-R514 PolarHBondContact O-N 2.9Å; M512-K515 PolarHBondContact O-N 3.41Å; M512-F516 WeakPolarHBondContact O-CD2 3.42Å; M512-F516 PolarHBondContact O-N 2.8Å
513	L	51.5	Low	49.4	Very low	101 Å²	101	119.3 Å²	119.3	53%	0.529	60%	0.603	S	S	.	*	H	α-helix	trans	-59.1	-38.2	177.9	-70.9	168.7	0	0	0	112.1	L509 K515	L509-L513 HydrophobicContact CG-CD1 4.19Å; L509-L513 WeakPolarHBondContact O-CB 3.4Å; L509-L513 VanDerWaalsContact O-CG 3.32Å; L509-L513 WeakPolarHBondContact O-CG 3.46Å; L509-L513 PolarHBondContact O-N 3.36Å; L513-K515 PolarHBondContact O-N 2.98Å
514	R	51.5	Low	49.1	Very low	218 Å²	218	118.5 Å²	118.5	82%	0.823	61%	0.607	S	S	*	*	H	α-helix	trans	-67.1	-28.8	172.5	-83.4	-175.1	171.5	177	-0.2	114.5	F510 M512	F510-R514 PolarHBondContact O-N 2.81Å; F510-R514 VanDerWaalsContact O-N 3.14Å; M512-R514 VanDerWaalsContact C-N 3.28Å; M512-R514 PolarHBondContact O-N 2.9Å
515	K	52.4	Low	48.4	Very low	177 Å²	177	122.5 Å²	122.5	77%	0.77	62%	0.618	S	S	*	*	H	α-helix	trans	-83.1	-16.6	-179.4	-87.8	-175.9	173.2	177.6	0	114.4	V511 M512 L513 G517	V511-K515 PolarHBondContact O-N 3.19Å; M512-K515 PolarHBondContact O-N 3.41Å; L513-K515 PolarHBondContact O-N 2.98Å; K515-G517 VanDerWaalsContact C-N 3.35Å; K515-G517 PolarHBondContact O-N 3.46Å
516	F	48.8	Very low	47.9	Very low	166 Å²	166	122.1 Å²	122.1	73%	0.728	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	9.8	-177.2	-87.3	-72.6	0	0	0	115.7	M512 L518	M512-F516 WeakPolarHBondContact O-CD2 3.42Å; M512-F516 PolarHBondContact O-N 2.8Å; F516-L518 PolarHBondContact O-N 3.2Å
517	G	43.9	Very low	47.8	Very low	69 Å²	69	127.3 Å²	127.3	71%	0.711	64%	0.637	S	S	*	*			trans	71.3	25.3	158.1	0	0	0	0	0	116.9	K515	K515-G517 VanDerWaalsContact C-N 3.35Å; K515-G517 PolarHBondContact O-N 3.46Å
518	L	41.4	Very low	47.2	Very low	120 Å²	120	128.4 Å²	128.4	63%	0.628	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-71.1	133.2	176.9	-75.4	158.1	0	0	0	111.5	F516	F516-L518 PolarHBondContact O-N 3.2Å
519	P	44.2	Very low	46.7	Very low	102 Å²	102	130.6 Å²	130.6	66%	0.662	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-75.9	143.2	-179.2	30.5	-34.3	0	0	0	112.2	G521	P519-G521 PolarHBondContact O-N 3.03Å
520	K	33.8	Very low	46.5	Very low	206 Å²	206	132.3 Å²	132.3	90%	0.896	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	127	176	-62.3	178.5	178.1	-179.5	0	110.8
521	G	47.1	Very low	46	Very low	67 Å²	67	127.8 Å²	127.8	69%	0.691	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	141.5	-19.1	171	0	0	0	0	0	117	P519 D523	P519-G521 PolarHBondContact O-N 3.03Å; G521-D523 PolarHBondContact N-OD2 3.34Å; G521-D523 VanDerWaalsContact N-OD2 3.15Å
522	E	47	Very low	45.4	Very low	150 Å²	150	130.1 Å²	130.1	70%	0.701	66%	0.656	S	S	*	*			trans	-104.5	11.1	174.9	-63.5	-166.6	141.6	0	0	112.9	E524 K525 M526	E522-E524 VanDerWaalsContact C-N 3.31Å; E522-E524 PolarHBondContact O-N 2.89Å; E522-K525 PolarHBondContact O-N 2.84Å; E522-M526 PolarHBondContact O-N 2.92Å
523	D	45.5	Very low	45.2	Very low	94 Å²	94	129.1 Å²	129.1	50%	0.503	66%	0.655	S	S	.	*	H	α-helix	trans	-58.9	-34.9	-166.6	-61.3	-62.4	0	0	0	113.3	G521 F527	G521-D523 PolarHBondContact N-OD2 3.34Å; G521-D523 VanDerWaalsContact N-OD2 3.15Å; D523-F527 WeakPolarHBondContact O-CB 3.31Å; D523-F527 VanDerWaalsContact O-CD2 3.28Å; D523-F527 WeakPolarHBondContact O-CD2 3.33Å; D523-F527 PolarHBondContact O-N 3.14Å
524	E	43.6	Very low	44.9	Very low	170 Å²	170	129.1 Å²	129.1	79%	0.794	66%	0.659	S	S	*	*	H	α-helix	trans	-75.2	-41.2	-177.9	-66.9	-176.7	146.2	0	0	113.6	E522 F527 E528	E522-E524 VanDerWaalsContact C-N 3.31Å; E522-E524 PolarHBondContact O-N 2.89Å; E524-F527 PolarHBondContact O-N 3.42Å; E524-E528 PolarHBondContact O-N 2.93Å
525	K	41.5	Very low	44.6	Very low	164 Å²	164	122.2 Å²	122.2	71%	0.713	64%	0.643	S	S	*	*	H	α-helix	trans	-74.8	-32.1	-176.8	-74.1	-178.6	177.7	175.2	0	113.3	E522 L529	E522-K525 PolarHBondContact O-N 2.84Å; K525-L529 PolarHBondContact O-N 3.35Å; K525-L529 VanDerWaalsContact O-N 3.14Å
526	M	44.4	Very low	44.4	Very low	92 Å²	92	115 Å²	115	45%	0.453	62%	0.617	S	S	.	*	H	α-helix	trans	-73	-32.8	171.6	-87.7	-93.5	-82.9	0	0	111.9	E522 L529 F530	E522-M526 PolarHBondContact O-N 2.92Å; M526-L529 PolarHBondContact O-N 3.29Å; M526-F530 PolarHBondContact O-N 3.05Å
527	F	48	Very low	44.4	Very low	163 Å²	163	114.2 Å²	114.2	72%	0.715	62%	0.62	S	S	*	*	H	α-helix	trans	-66.7	-35.3	170.5	-99.9	-96.2	0	0	0	112.7	D523 E524 F530 A531	D523-F527 WeakPolarHBondContact O-CB 3.31Å; D523-F527 VanDerWaalsContact O-CD2 3.28Å; D523-F527 WeakPolarHBondContact O-CD2 3.33Å; D523-F527 PolarHBondContact O-N 3.14Å; E524-F527 PolarHBondContact O-N 3.42Å; F527-F530 CarbonylContact O-C 3.38Å; F527-F530 PolarHBondContact O-N 3.47Å; F527-A531 PolarHBondContact O-N 2.84Å
528	E	41.7	Very low	44.6	Very low	151 Å²	151	119.1 Å²	119.1	71%	0.706	62%	0.617	S	S	*	*	H	α-helix	trans	-65.9	-39.6	171.2	-76	-166.5	145.1	0	0	112.8	E524 F530 A531	E524-E528 PolarHBondContact O-N 2.93Å; E528-F530 PolarHBondContact O-N 3.36Å; E528-A531 WeakPolarHBondContact O-CB 3.41Å; E528-A531 PolarHBondContact O-N 2.86Å
529	L	44.5	Very low	45.2	Very low	145 Å²	145	117.2 Å²	117.2	76%	0.759	61%	0.613	S	S	*	*	H	α-helix	trans	-63.4	-32.4	171.3	-112.6	85.6	0	0	0	112.3	K525 M526 A531	K525-L529 PolarHBondContact O-N 3.35Å; K525-L529 VanDerWaalsContact O-N 3.14Å; M526-L529 PolarHBondContact O-N 3.29Å; L529-A531 VanDerWaalsContact C-N 3.29Å; L529-A531 PolarHBondContact O-N 3.33Å
530	F	48.4	Very low	45.7	Very low	117 Å²	117	116.7 Å²	116.7	51%	0.513	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-78.3	-1.4	171.8	-94.9	-93.7	0	0	0	113.7	M526 F527 E528 L532 T533	M526-F530 PolarHBondContact O-N 3.05Å; F527-F530 CarbonylContact O-C 3.38Å; F527-F530 PolarHBondContact O-N 3.47Å; E528-F530 PolarHBondContact O-N 3.36Å; F530-L532 PolarHBondContact O-N 2.69Å; F530-T533 HydrophobicContact CD1-CG2 3.7Å; F530-T533 HydrophobicContact CE1-CG2 4.28Å; F530-T533 WeakPolarHBondContact O-CA 3.49Å; F530-T533 VanDerWaalsContact O-CB 3.32Å; F530-T533 WeakPolarHBondContact O-CB 3.09Å; F530-T533 PolarHBondContact O-N 2.9Å; F530-T533 PolarHBondContact O-OG1 3.42Å
531	A	40.6	Very low	46.9	Very low	48 Å²	48	111.1 Å²	111.1	40%	0.397	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-60.2	-23.7	-174	0	0	0	0	0	114.6	F527 E528 L529 T533 T534	F527-A531 PolarHBondContact O-N 2.84Å; E528-A531 WeakPolarHBondContact O-CB 3.41Å; E528-A531 PolarHBondContact O-N 2.86Å; L529-A531 VanDerWaalsContact C-N 3.29Å; L529-A531 PolarHBondContact O-N 3.33Å; A531-T533 PolarHBondContact O-N 2.88Å; A531-T534 WeakPolarHBondContact O-CB 3.39Å; A531-T534 WeakPolarHBondContact O-CG2 3.34Å; A531-T534 PolarHBondContact O-N 2.64Å; A531-T534 VanDerWaalsContact O-N 3.14Å; A531-T534 PolarHBondContact O-OG1 3.19Å
532	L	42.7	Very low	47.3	Very low	124 Å²	124	111.4 Å²	111.4	65%	0.649	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-58.6	-22.3	168.4	-86.7	158.9	0	0	0	113.3	W394 F530	W394-L532 HydrophobicContact CE3-CD2 4.22Å; W394-L532 HydrophobicContact CH2-CD2 3.68Å; W394-L532 HydrophobicContact CZ3-CD2 3.39Å; F530-L532 PolarHBondContact O-N 2.69Å
533	T	47.7	Very low	48	Very low	67 Å²	67	107.4 Å²	107.4	41%	0.411	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-87.3	0.7	178.4	71.3	0	0	0	0	114.2	F530 A531 C535 A536	F530-T533 HydrophobicContact CD1-CG2 3.7Å; F530-T533 HydrophobicContact CE1-CG2 4.28Å; F530-T533 WeakPolarHBondContact O-CA 3.49Å; F530-T533 VanDerWaalsContact O-CB 3.32Å; F530-T533 WeakPolarHBondContact O-CB 3.09Å; F530-T533 PolarHBondContact O-N 2.9Å; F530-T533 PolarHBondContact O-OG1 3.42Å; A531-T533 PolarHBondContact O-N 2.88Å; T533-C535 PolarHBondContact O-N 2.72Å; T533-C535 VanDerWaalsContact O-N 3.11Å; T533-A536 WeakPolarHBondContact O-CB 3.5Å; T533-A536 PolarHBondContact O-N 3.4Å
534	T	44	Very low	48.7	Very low	101 Å²	101	105.9 Å²	105.9	62%	0.62	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-58.5	-22.5	170.6	51.4	0	0	0	0	113	A531	A531-T534 WeakPolarHBondContact O-CB 3.39Å; A531-T534 WeakPolarHBondContact O-CG2 3.34Å; A531-T534 PolarHBondContact O-N 2.64Å; A531-T534 VanDerWaalsContact O-N 3.14Å; A531-T534 PolarHBondContact O-OG1 3.19Å
535	C	45.2	Very low	49.4	Very low	73 Å²	73	101.1 Å²	101.1	49%	0.493	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-68.8	-29.1	169	-72.4	0	0	0	0	114	T533 L537 R538 W541	T533-C535 PolarHBondContact O-N 2.72Å; T533-C535 VanDerWaalsContact O-N 3.11Å; C535-L537 PolarHBondContact O-N 2.66Å; C535-R538 PolarHBondContact O-N 3.18Å; C535-W541 WeakPolarHBondContact O-CB 3.38Å
536	A	49.2	Very low	50.5	Low	27 Å²	27	93.7 Å²	93.7	22%	0.223	49%	0.488	C	S	.	.	G	3₁₀ helix	trans	-76.3	-7.6	-175.4	0	0	0	0	0	114.2	T533 W541 W542	T533-A536 WeakPolarHBondContact O-CB 3.5Å; T533-A536 PolarHBondContact O-N 3.4Å; A536-W541 HydrophobicContact CB-CE3 4.07Å; A536-W541 HydrophobicContact CB-CZ3 4.06Å; A536-W542 PolarHBondContact O-NE1 2.93Å
537	L	47.3	Very low	51.4	Low	148 Å²	148	91.7 Å²	91.7	78%	0.775	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-84.2	-10.5	172	-81.6	157.9	0	0	0	113.3	C535	C535-L537 PolarHBondContact O-N 2.66Å
538	R	48.9	Very low	52.3	Low	173 Å²	173	90.5 Å²	90.5	65%	0.653	47%	0.473	S	S	*	.			trans	-77.2	126.1	170.8	-102.8	179.8	165.1	151.8	-1.6	110.2	C535 D540 W541	C535-R538 PolarHBondContact O-N 3.18Å; R538-D540 IonicContact NE-OD2 3.97Å; R538-D540 PolarHBondContact O-N 3Å; R538-W541 HydrophobicContact CB-CB 4.06Å; R538-W541 WeakPolarHBondContact O-CB 3.37Å; R538-W541 PolarHBondContact O-N 3.44Å; R538-W541 VanDerWaalsContact O-N 3.09Å
539	S	53.3	Low	53.4	Low	79 Å²	79	85.3 Å²	85.3	55%	0.552	45%	0.45	S	S	*	.	H	α-helix	trans	-46.3	-42.3	164.8	40.1	0	0	0	0	111.8	W541 W542 S543	S539-W541 VanDerWaalsContact C-N 3.31Å; S539-W541 PolarHBondContact O-N 3.14Å; S539-W542 PolarHBondContact O-N 3.39Å; S539-S543 PolarHBondContact O-N 3.09Å
540	D	55.9	Low	54.5	Low	92 Å²	92	80.6 Å²	80.6	49%	0.492	43%	0.425	S	S	.	.	H	α-helix	trans	-67.3	-34.5	-174.4	-39.1	-23.1	0	0	0	111	R538 W542 S543 D544	R538-D540 IonicContact NE-OD2 3.97Å; R538-D540 PolarHBondContact O-N 3Å; D540-W542 VanDerWaalsContact C-N 3.34Å; D540-W542 PolarHBondContact O-N 3.35Å; D540-S543 PolarHBondContact O-N 2.9Å; D540-S543 VanDerWaalsContact O-N 3.15Å; D540-S543 PolarHBondContact O-OG 2.92Å; D540-D544 WeakPolarHBondContact O-CB 3.42Å; D540-D544 PolarHBondContact O-N 3.45Å
541	W	58.7	Low	55.2	Low	89 Å²	89	79.2 Å²	79.2	34%	0.337	42%	0.423	S	S	.	.	H	α-helix	trans	-64.2	-37.4	-179.3	-176	85.3	0	0	0	112	C535 A536 R538 S539 D544 M545	C535-W541 WeakPolarHBondContact O-CB 3.38Å; A536-W541 HydrophobicContact CB-CE3 4.07Å; A536-W541 HydrophobicContact CB-CZ3 4.06Å; R538-W541 HydrophobicContact CB-CB 4.06Å; R538-W541 WeakPolarHBondContact O-CB 3.37Å; R538-W541 PolarHBondContact O-N 3.44Å; R538-W541 VanDerWaalsContact O-N 3.09Å; S539-W541 VanDerWaalsContact C-N 3.31Å; S539-W541 PolarHBondContact O-N 3.14Å; W541-D544 PolarHBondContact O-N 3.03Å; W541-M545 HydrophobicContact CD2-CB 4.43Å; W541-M545 HydrophobicContact CE3-CB 4.38Å; W541-M545 HydrophobicContact CH2-CB 4.43Å; W541-M545 HydrophobicContact CH2-CG 4.06Å; W541-M545 HydrophobicContact CZ2-CB 4.47Å; W541-M545 HydrophobicContact CZ2-CG 4.27Å; W541-M545 HydrophobicContact CZ2-SD 4.33Å; W541-M545 HydrophobicContact CZ3-CB 4.38Å; W541-M545 HydrophobicContact CZ3-CG 4.34Å; W541-M545 WeakPolarHBondContact O-CB 3.15Å; W541-M545 PolarHBondContact O-N 2.78Å
542	W	56.1	Low	56.3	Low	73 Å²	73	80.2 Å²	80.2	28%	0.277	43%	0.425	S	S	.	.	H	α-helix	trans	-72.2	-30.6	175.5	-71.4	94.8	0	0	0	112.7	V498 T502 F505 A536 S539 D540 G546	V498-W542 HydrophobicContact CG1-CB 3.86Å; T502-W542 HydrophobicContact CG2-CB 3.38Å; T502-W542 VanDerWaalsContact CG2-CD1 3.44Å; T502-W542 HydrophobicContact CG2-CD2 3.86Å; T502-W542 HydrophobicContact CG2-CG 3.25Å; F505-W542 AromaticContact CD1-CH2 3.96Å; F505-W542 HydrophobicContact CD1-CH2 3.96Å; F505-W542 HydrophobicContact CD1-CZ2 4.2Å; F505-W542 AromaticContact CE1-CH2 3.99Å; F505-W542 HydrophobicContact CE1-CH2 3.99Å; F505-W542 HydrophobicContact CE1-CZ2 4.47Å; A536-W542 PolarHBondContact O-NE1 2.93Å; S539-W542 PolarHBondContact O-N 3.39Å; D540-W542 VanDerWaalsContact C-N 3.34Å; D540-W542 PolarHBondContact O-N 3.35Å; W542-G546 WeakPolarHBondContact O-CA 3.45Å; W542-G546 PolarHBondContact O-N 3.24Å
543	S	60.3	Low	57.4	Low	65 Å²	65	75.3 Å²	75.3	46%	0.455	40%	0.4	S	S	.	.	H	α-helix	trans	-68.3	-43.6	171.7	79.9	0	0	0	0	111.7	S539 D540 S547	S539-S543 PolarHBondContact O-N 3.09Å; D540-S543 PolarHBondContact O-N 2.9Å; D540-S543 VanDerWaalsContact O-N 3.15Å; D540-S543 PolarHBondContact O-OG 2.92Å; S543-S547 WeakPolarHBondContact O-CB 3.03Å; S543-S547 PolarHBondContact O-N 2.68Å
544	D	61.9	Low	58.3	Low	62 Å²	62	74.7 Å²	74.7	33%	0.332	39%	0.393	S	S	.	.	H	α-helix	trans	-67.2	-49.9	177.3	-174.1	7.5	0	0	0	110.3	D540 W541 G546 S547 R548	D540-D544 WeakPolarHBondContact O-CB 3.42Å; D540-D544 PolarHBondContact O-N 3.45Å; W541-D544 PolarHBondContact O-N 3.03Å; D544-G546 PolarHBondContact O-N 2.87Å; D544-S547 CarbonylContact O-C 3.58Å; D544-S547 WeakPolarHBondContact O-CB 3.48Å; D544-S547 PolarHBondContact O-N 3.31Å; D544-S547 VanDerWaalsContact O-N 3.13Å; D544-S547 PolarHBondContact O-OG 2.72Å; D544-R548 VanDerWaalsContact CG-NE 3.33Å; D544-R548 VanDerWaalsContact O-CG 3.3Å; D544-R548 WeakPolarHBondContact O-CG 3.25Å; D544-R548 PolarHBondContact O-N 2.87Å; D544-R548 IonicContact OD1-CZ 3.43Å; D544-R548 IonicContact OD1-NE 3.42Å; D544-R548 PolarHBondContact OD1-NE 2.29Å; D544-R548 IonicContact OD1-NH2 2.7Å; D544-R548 PolarHBondContact OD1-NH2 2.88Å; D544-R548 IonicContact OD2-CZ 2.76Å; D544-R548 IonicContact OD2-NE 2.64Å; D544-R548 PolarHBondContact OD2-NE 3.09Å; D544-R548 IonicContact OD2-NH2 2.89Å; D544-R548 PolarHBondContact OD2-NH2 2.9Å
545	M	58.2	Low	59.1	Low	71 Å²	71	70.1 Å²	70.1	35%	0.35	37%	0.366	S	S	.	.	H	α-helix	trans	-60.6	-42	175.8	-171	64	176.2	0	0	112.4	W541 R548 I549	W541-M545 HydrophobicContact CD2-CB 4.43Å; W541-M545 HydrophobicContact CE3-CB 4.38Å; W541-M545 HydrophobicContact CH2-CB 4.43Å; W541-M545 HydrophobicContact CH2-CG 4.06Å; W541-M545 HydrophobicContact CZ2-CB 4.47Å; W541-M545 HydrophobicContact CZ2-CG 4.27Å; W541-M545 HydrophobicContact CZ2-SD 4.33Å; W541-M545 HydrophobicContact CZ3-CB 4.38Å; W541-M545 HydrophobicContact CZ3-CG 4.34Å; W541-M545 WeakPolarHBondContact O-CB 3.15Å; W541-M545 PolarHBondContact O-N 2.78Å; M545-R548 PolarHBondContact O-N 3.29Å; M545-I549 HydrophobicContact CE-CD1 4.21Å; M545-I549 HydrophobicContact CE-CG1 4.38Å; M545-I549 HydrophobicContact CG-CD1 4.05Å; M545-I549 WeakPolarHBondContact O-CB 3.31Å; M545-I549 VanDerWaalsContact O-CG1 3.27Å; M545-I549 WeakPolarHBondContact O-CG1 3.44Å; M545-I549 PolarHBondContact O-N 3.15Å
546	G	63	Low	60.1	Low	8 Å²	8	71 Å²	71	8%	0.082	36%	0.364	C	S	.	.	H	α-helix	trans	-60.8	-43.4	173.1	0	0	0	0	0	112.1	W542 D544 I549 I550	W542-G546 WeakPolarHBondContact O-CA 3.45Å; W542-G546 PolarHBondContact O-N 3.24Å; D544-G546 PolarHBondContact O-N 2.87Å; G546-I549 PolarHBondContact O-N 2.93Å; G546-I550 WeakPolarHBondContact O-CG1 3.16Å; G546-I550 PolarHBondContact O-N 2.84Å
547	S	64.8	Low	60.8	Low	50 Å²	50	73.3 Å²	73.3	35%	0.35	37%	0.369	S	S	.	.	H	α-helix	trans	-63.5	-40.4	174.2	85.1	0	0	0	0	112.3	S543 D544 I550 N551	S543-S547 WeakPolarHBondContact O-CB 3.03Å; S543-S547 PolarHBondContact O-N 2.68Å; D544-S547 CarbonylContact O-C 3.58Å; D544-S547 WeakPolarHBondContact O-CB 3.48Å; D544-S547 PolarHBondContact O-N 3.31Å; D544-S547 VanDerWaalsContact O-N 3.13Å; D544-S547 PolarHBondContact O-OG 2.72Å; S547-I550 PolarHBondContact O-N 3.16Å; S547-N551 WeakPolarHBondContact O-CB 3.33Å; S547-N551 PolarHBondContact O-N 3.3Å; S547-N551 PolarHBondContact O-ND2 2.75Å
548	R	65.1	Low	61.6	Low	137 Å²	137	67.7 Å²	67.7	52%	0.517	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-39.3	176.1	-69.3	172.4	-167.4	-145.2	8.7	112.2	D544 M545 N551 T552	D544-R548 VanDerWaalsContact CG-NE 3.33Å; D544-R548 VanDerWaalsContact O-CG 3.3Å; D544-R548 WeakPolarHBondContact O-CG 3.25Å; D544-R548 PolarHBondContact O-N 2.87Å; D544-R548 IonicContact OD1-CZ 3.43Å; D544-R548 IonicContact OD1-NE 3.42Å; D544-R548 PolarHBondContact OD1-NE 2.29Å; D544-R548 IonicContact OD1-NH2 2.7Å; D544-R548 PolarHBondContact OD1-NH2 2.88Å; D544-R548 IonicContact OD2-CZ 2.76Å; D544-R548 IonicContact OD2-NE 2.64Å; D544-R548 PolarHBondContact OD2-NE 3.09Å; D544-R548 IonicContact OD2-NH2 2.89Å; D544-R548 PolarHBondContact OD2-NH2 2.9Å; M545-R548 PolarHBondContact O-N 3.29Å; R548-N551 PolarHBondContact O-N 2.79Å; R548-T552 WeakPolarHBondContact O-CB 3.48Å; R548-T552 WeakPolarHBondContact O-CG2 3.44Å; R548-T552 PolarHBondContact O-N 2.88Å; R548-T552 PolarHBondContact O-OG1 2.88Å
549	I	65.9	Low	62.4	Low	43 Å²	43	63 Å²	63	22%	0.221	33%	0.327	C	S	.	.	H	α-helix	trans	-64.7	-45.6	174.5	-70.1	165.4	0	0	0	109.7	I489 M545 G546 T552 V553	I489-I549 HydrophobicContact CG2-CG2 4.38Å; M545-I549 HydrophobicContact CE-CD1 4.21Å; M545-I549 HydrophobicContact CE-CG1 4.38Å; M545-I549 HydrophobicContact CG-CD1 4.05Å; M545-I549 WeakPolarHBondContact O-CB 3.31Å; M545-I549 VanDerWaalsContact O-CG1 3.27Å; M545-I549 WeakPolarHBondContact O-CG1 3.44Å; M545-I549 PolarHBondContact O-N 3.15Å; G546-I549 PolarHBondContact O-N 2.93Å; I549-T552 WeakPolarHBondContact CA-OG1 3.38Å; I549-T552 PolarHBondContact O-N 3.19Å; I549-T552 PolarHBondContact O-OG1 2.81Å; I549-T552 VanDerWaalsContact O-OG1 3.1Å; I549-V553 HydrophobicContact CG2-CG2 4.19Å; I549-V553 WeakPolarHBondContact O-CB 3.18Å; I549-V553 VanDerWaalsContact O-CG2 3.25Å; I549-V553 WeakPolarHBondContact O-CG2 3.44Å; I549-V553 PolarHBondContact O-N 3.42Å
550	I	66.5	Low	63.1	Low	46 Å²	46	59.7 Å²	59.7	24%	0.236	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-48.5	175	-69.7	163.8	0	0	0	110.6	F493 G546 S547 T552 V553 L554	F493-I550 HydrophobicContact CB-CD1 4.33Å; F493-I550 HydrophobicContact CB-CG1 4.16Å; F493-I550 WeakPolarHBondContact O-CD1 3.29Å; G546-I550 WeakPolarHBondContact O-CG1 3.16Å; G546-I550 PolarHBondContact O-N 2.84Å; S547-I550 PolarHBondContact O-N 3.16Å; I550-T552 PolarHBondContact O-N 2.83Å; I550-V553 PolarHBondContact O-N 2.91Å; I550-L554 WeakPolarHBondContact O-CB 3.45Å; I550-L554 PolarHBondContact O-N 2.91Å
551	N	63.7	Low	63.6	Low	87 Å²	87	57.5 Å²	57.5	47%	0.465	30%	0.302	S	S	.	.	H	α-helix	trans	-69	-13.7	-178.1	-68.1	-15.7	0	0	0	113.9	S547 R548 P555	S547-N551 WeakPolarHBondContact O-CB 3.33Å; S547-N551 PolarHBondContact O-N 3.3Å; S547-N551 PolarHBondContact O-ND2 2.75Å; R548-N551 PolarHBondContact O-N 2.79Å; N551-P555 WeakPolarHBondContact O-CD 3.3Å; N551-P555 WeakPolarHBondContact O-CG 3.39Å
552	T	64.4	Low	64.2	Low	70 Å²	70	53.4 Å²	53.4	43%	0.429	29%	0.287	S	S	.	.	H	α-helix	trans	-100	-32.1	172.5	48.9	0	0	0	0	113.1	R548 I549 I550 P555	R548-T552 WeakPolarHBondContact O-CB 3.48Å; R548-T552 WeakPolarHBondContact O-CG2 3.44Å; R548-T552 PolarHBondContact O-N 2.88Å; R548-T552 PolarHBondContact O-OG1 2.88Å; I549-T552 WeakPolarHBondContact CA-OG1 3.38Å; I549-T552 PolarHBondContact O-N 3.19Å; I549-T552 PolarHBondContact O-OG1 2.81Å; I549-T552 VanDerWaalsContact O-OG1 3.1Å; I550-T552 PolarHBondContact O-N 2.83Å; T552-P555 WeakPolarHBondContact O-CB 3.45Å; T552-P555 WeakPolarHBondContact O-CD 3.08Å; T552-P555 WeakPolarHBondContact O-CG 2.64Å
553	V	66.6	Low	64.9	Low	21 Å²	21	50.9 Å²	50.9	13%	0.127	28%	0.279	C	S	.	.	H	α-helix	trans	-84.4	-33.3	179.6	178.2	0	0	0	0	112.5	I489 T490 I549 I550 I556 K557	I489-V553 HydrophobicContact CB-CG1 4.2Å; I489-V553 HydrophobicContact CG2-CB 4.39Å; I489-V553 HydrophobicContact CG2-CG1 3.97Å; I489-V553 HydrophobicContact CG2-CG2 4.03Å; T490-V553 HydrophobicContact CG2-CG1 3.89Å; I549-V553 HydrophobicContact CG2-CG2 4.19Å; I549-V553 WeakPolarHBondContact O-CB 3.18Å; I549-V553 VanDerWaalsContact O-CG2 3.25Å; I549-V553 WeakPolarHBondContact O-CG2 3.44Å; I549-V553 PolarHBondContact O-N 3.42Å; I550-V553 PolarHBondContact O-N 2.91Å; V553-I556 PolarHBondContact O-N 3.42Å; V553-I556 VanDerWaalsContact O-N 3.08Å; V553-K557 WeakPolarHBondContact O-CB 3.14Å; V553-K557 PolarHBondContact O-N 3.18Å
554	L	64.6	Low	65.4	Low	53 Å²	53	51.1 Å²	51.1	28%	0.277	27%	0.27	S	S	.	.	H	α-helix	trans	-55.7	-44.5	171.9	-171.7	76.6	0	0	0	112.3	I550 I556 K557 Q558	I550-L554 WeakPolarHBondContact O-CB 3.45Å; I550-L554 PolarHBondContact O-N 2.91Å; L554-I556 PolarHBondContact O-N 2.84Å; L554-K557 PolarHBondContact O-N 2.93Å; L554-Q558 WeakPolarHBondContact O-CG 3.17Å; L554-Q558 PolarHBondContact O-N 3.4Å
555	P	62.4	Low	65.6	Low	6 Å²	6	49.8 Å²	49.8	4%	0.039	26%	0.264	C	S	.	.	H	α-helix	trans	-44.2	-56.2	162.7	-33.8	31.3	0	0	0	115.9	L421 N551 T552 K557 Q558 L559	L421-P555 HydrophobicContact CB-CB 3.29Å; L421-P555 HydrophobicContact CB-CG 3.46Å; L421-P555 VanDerWaalsContact CB-CG 3.46Å; L421-P555 HydrophobicContact CD1-CB 3.85Å; L421-P555 HydrophobicContact CD2-CB 4.01Å; L421-P555 HydrophobicContact CG-CB 3.9Å; L421-P555 WeakPolarHBondContact O-CG 3.4Å; N551-P555 WeakPolarHBondContact O-CD 3.3Å; N551-P555 WeakPolarHBondContact O-CG 3.39Å; T552-P555 WeakPolarHBondContact O-CB 3.45Å; T552-P555 WeakPolarHBondContact O-CD 3.08Å; T552-P555 WeakPolarHBondContact O-CG 2.64Å; P555-K557 VanDerWaalsContact C-N 3.3Å; P555-K557 PolarHBondContact O-N 2.85Å; P555-Q558 WeakPolarHBondContact O-CB 3.42Å; P555-Q558 PolarHBondContact O-N 3.02Å; P555-L559 PolarHBondContact O-N 2.93Å
556	I	64.8	Low	65.9	Low	90 Å²	90	54.1 Å²	54.1	46%	0.462	28%	0.283	S	S	.	.	H	α-helix	trans	-67.3	-37.6	-172.8	-65	166.9	0	0	0	109.4	V553 L554 Q558 L559 L560	V553-I556 PolarHBondContact O-N 3.42Å; V553-I556 VanDerWaalsContact O-N 3.08Å; L554-I556 PolarHBondContact O-N 2.84Å; I556-Q558 VanDerWaalsContact C-N 3.33Å; I556-Q558 PolarHBondContact O-N 3.37Å; I556-L559 PolarHBondContact O-N 2.92Å; I556-L560 HydrophobicContact CG2-CD1 3.71Å; I556-L560 HydrophobicContact CG2-CG 4.25Å; I556-L560 VanDerWaalsContact O-CB 3.31Å; I556-L560 WeakPolarHBondContact O-CB 3.44Å; I556-L560 WeakPolarHBondContact O-CG 3.3Å; I556-L560 PolarHBondContact O-N 3.42Å
557	K	64.8	Low	66	Low	76 Å²	76	55.7 Å²	55.7	33%	0.33	30%	0.3	S	S	.	.	H	α-helix	trans	-62	-35.6	172	-176	177.4	178.6	178.6	0	112.8	A486 T490 V553 L554 P555 G561	A486-K557 HydrophobicContact CB-CB 4.34Å; T490-K557 HydrophobicContact CG2-CD 3.84Å; T490-K557 PolarHBondContact OG1-NZ 3.1Å; V553-K557 WeakPolarHBondContact O-CB 3.14Å; V553-K557 PolarHBondContact O-N 3.18Å; L554-K557 PolarHBondContact O-N 2.93Å; P555-K557 VanDerWaalsContact C-N 3.3Å; P555-K557 PolarHBondContact O-N 2.85Å; K557-G561 PolarHBondContact O-N 3Å
558	Q	64	Low	66.4	Low	31 Å²	31	55.5 Å²	55.5	15%	0.145	29%	0.291	C	S	.	.	H	α-helix	trans	-70.9	-46.3	174.5	-72.3	171.1	8.3	0	0	111.5	F426 L554 P555 I556 L560 G561 C562	F426-Q558 HydrophobicContact CD2-CB 4.22Å; F426-Q558 HydrophobicContact CE2-CB 4.39Å; L554-Q558 WeakPolarHBondContact O-CG 3.17Å; L554-Q558 PolarHBondContact O-N 3.4Å; P555-Q558 WeakPolarHBondContact O-CB 3.42Å; P555-Q558 PolarHBondContact O-N 3.02Å; I556-Q558 VanDerWaalsContact C-N 3.33Å; I556-Q558 PolarHBondContact O-N 3.37Å; Q558-L560 PolarHBondContact O-N 2.9Å; Q558-G561 WeakPolarHBondContact O-CA 3.36Å; Q558-G561 PolarHBondContact O-N 2.87Å; Q558-C562 PolarHBondContact O-N 3.33Å
559	L	65.4	Low	66.7	Low	74 Å²	74	51.7 Å²	51.7	39%	0.387	28%	0.281	S	S	.	.	H	α-helix	trans	-60.9	-44	175.3	168.9	147.5	0	0	0	112.2	W434 P555 I556 G561 C562	W434-L559 HydrophobicContact CH2-CB 4.3Å; W434-L559 HydrophobicContact CH2-CD1 3.89Å; W434-L559 HydrophobicContact CH2-CG 4.38Å; P555-L559 PolarHBondContact O-N 2.93Å; I556-L559 PolarHBondContact O-N 2.92Å; L559-G561 PolarHBondContact O-N 3.05Å; L559-C562 WeakPolarHBondContact O-CB 3.37Å; L559-C562 PolarHBondContact O-N 2.56Å
560	L	68.5	Low	67.1	Low	9 Å²	9	53 Å²	53	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-14.7	176	-69.3	169.4	0	0	0	112.9	F479 L482 N483 A486 I556 Q558 I563	F479-L560 HydrophobicContact CD1-CD2 4.31Å; L482-L560 HydrophobicContact CB-CD1 4.1Å; L482-L560 HydrophobicContact CB-CD2 4.1Å; N483-L560 HydrophobicContact CB-CB 4.35Å; N483-L560 PolarHBondContact ND2-O 2.85Å; A486-L560 HydrophobicContact CB-CD1 3.97Å; I556-L560 HydrophobicContact CG2-CD1 3.71Å; I556-L560 HydrophobicContact CG2-CG 4.25Å; I556-L560 VanDerWaalsContact O-CB 3.31Å; I556-L560 WeakPolarHBondContact O-CB 3.44Å; I556-L560 WeakPolarHBondContact O-CG 3.3Å; I556-L560 PolarHBondContact O-N 3.42Å; Q558-L560 PolarHBondContact O-N 2.9Å; L560-I563 HydrophobicContact CD2-CD1 4.28Å
561	G	66.6	Low	67.3	Low	47 Å²	47	53 Å²	53	49%	0.485	29%	0.288	S	S	.	.	H	α-helix	trans	-81.7	-18.6	170.6	0	0	0	0	0	114.5	K557 Q558 L559	K557-G561 PolarHBondContact O-N 3Å; Q558-G561 WeakPolarHBondContact O-CA 3.36Å; Q558-G561 PolarHBondContact O-N 2.87Å; L559-G561 PolarHBondContact O-N 3.05Å
562	C	70.4	Confident	67.8	Low	3 Å²	3	49.3 Å²	49.3	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-75.9	-31.2	173.9	-104	0	0	0	0	112.5	C431 Q558 L559	C431-C562 VanDerWaalsContact CA-SG 3.57Å; C431-C562 HydrophobicContact CB-CB 4.37Å; C431-C562 WeakPolarHBondContact CB-SG 3.24Å; C431-C562 WeakPolarHBondContact SG-CB 3.44Å; C431-C562 CovalentContact SG-SG 2.04Å; C431-C562 PolarHBondContact SG-SG 3.41Å; Q558-C562 PolarHBondContact O-N 3.33Å; L559-C562 WeakPolarHBondContact O-CB 3.37Å; L559-C562 PolarHBondContact O-N 2.56Å
563	I	71.6	Confident	68.4	Low	19 Å²	19	48.5 Å²	48.5	10%	0.097	26%	0.264	C	S	.	.	S	Bend	trans	-75	132.6	-174.2	-54.5	-176.8	0	0	0	110.8	L452 F479 L560 T565	L452-I563 HydrophobicContact CD2-CD1 4.34Å; L452-I563 HydrophobicContact CD2-CG1 4.16Å; F479-I563 HydrophobicContact CD1-CD1 3.7Å; F479-I563 HydrophobicContact CD1-CG2 4.47Å; F479-I563 HydrophobicContact CE1-CD1 3.73Å; F479-I563 HydrophobicContact CG-CD1 4.5Å; F479-I563 HydrophobicContact CG-CG2 4.29Å; L560-I563 HydrophobicContact CD2-CD1 4.28Å; I563-T565 PolarHBondContact O-N 3.31Å
564	R	70.9	Confident	68.6	Low	71 Å²	71	51.1 Å²	51.1	27%	0.268	28%	0.283	S	S	.	.			trans	-86	107.6	175.9	-171.3	174.7	-161.2	136.9	2.6	111.7	L452 R453 Y455 E566	L452-R564 PolarHBondContact O-N 2.88Å; L452-R564 VanDerWaalsContact O-N 3.13Å; R453-R564 HydrophobicContact CG-CB 3.98Å; Y455-R564 PolarHBondContact OH-NH1 3.45Å; Y455-R564 PolarHBondContact OH-NH2 2.93Å; R564-E566 WeakPolarHBondContact CG-O 3.45Å; R564-E566 PolarHBondContact NE-O 3.05Å
565	T	64.9	Low	68.8	Low	33 Å²	33	56.8 Å²	56.8	20%	0.202	31%	0.308	C	S	.	.			trans	-95.3	-27.9	176.2	55.2	0	0	0	0	113.9	N476 F479 I563	N476-T565 WeakPolarHBondContact CB-O 3.38Å; N476-T565 PolarHBondContact ND2-O 3.23Å; N476-T565 PolarHBondContact OD1-O 3.07Å; F479-T565 HydrophobicContact CB-CG2 3.73Å; I563-T565 PolarHBondContact O-N 3.31Å
566	E	64.7	Low	69.5	Low	162 Å²	162	61.3 Å²	61.3	76%	0.757	33%	0.328	S	S	*	.	S	Bend	trans	-103.8	135.2	-177.7	-71.3	-179.1	-172.1	0	0	112.4	R564 R568	R564-E566 WeakPolarHBondContact CG-O 3.45Å; R564-E566 PolarHBondContact NE-O 3.05Å; E566-R568 PolarHBondContact O-N 3.49Å
567	G	66.5	Low	69.8	Low	42 Å²	42	57.2 Å²	57.2	43%	0.433	31%	0.308	S	S	.	.	S	Bend	trans	63.7	19.4	176.9	0	0	0	0	0	114.9	Y455 I569	Y455-G567 VanDerWaalsContact CD1-O 3.24Å; Y455-G567 WeakPolarHBondContact CD1-O 3.46Å; Y455-G567 WeakPolarHBondContact CE1-O 3.42Å; G567-I569 PolarHBondContact O-N 3.46Å
568	R	73	Confident	69.9	Low	45 Å²	45	61.3 Å²	61.3	17%	0.17	33%	0.328	C	S	.	.			trans	-62.2	-29.2	179.4	-176.5	175.4	177.9	149.7	4.4	112.9	L451 Y455 V456 E566	L451-R568 PolarHBondContact O-NH1 3.04Å; L451-R568 PolarHBondContact O-NH2 3.38Å; Y455-R568 CarbonylContact C-O 3.59Å; Y455-R568 VanDerWaalsContact CA-O 3.26Å; Y455-R568 WeakPolarHBondContact CA-O 3.36Å; V456-R568 PolarHBondContact N-O 2.8Å; E566-R568 PolarHBondContact O-N 3.49Å
569	I	71.5	Confident	70.3	Confident	58 Å²	58	64.3 Å²	64.3	30%	0.297	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126	175.1	-57.5	177.3	0	0	0	107.2	V456 L458 L469 G567	V456-I569 HydrophobicContact CB-CG1 4.44Å; V456-I569 WeakPolarHBondContact O-CA 3.44Å; L458-I569 HydrophobicContact CD1-CG2 3.2Å; L458-I569 HydrophobicContact CG-CG2 4.48Å; L469-I569 HydrophobicContact CD2-CG2 4.1Å; G567-I569 PolarHBondContact O-N 3.46Å
570	Q	72.8	Confident	70.8	Confident	69 Å²	69	62.6 Å²	62.6	32%	0.322	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.4	178.3	-65.7	-172.6	-16	0	0	110.2	Y455 V456 L457 L458 V572	Y455-Q570 HydrophobicContact CD1-CG 4.2Å; Y455-Q570 HydrophobicContact CE1-CG 4.48Å; V456-Q570 PolarHBondContact O-N 2.94Å; L457-Q570 CarbonylContact C-O 3.47Å; L457-Q570 WeakPolarHBondContact CA-O 3.46Å; L457-Q570 HydrophobicContact CD2-CB 3.9Å; L458-Q570 PolarHBondContact N-O 3.27Å; Q570-V572 HydrophobicContact CB-CG2 4.34Å
571	V	71	Confident	71	Confident	47 Å²	47	63.6 Å²	63.6	29%	0.285	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	127.4	177.8	-170.8	0	0	0	0	107.9	L458 P461 N466 L469	L458-V571 HydrophobicContact CB-CG2 4.33Å; L458-V571 HydrophobicContact CD1-CG2 4.41Å; L458-V571 WeakPolarHBondContact O-CA 3.44Å; P461-V571 HydrophobicContact CB-CG1 3.73Å; N466-V571 WeakPolarHBondContact OD1-CG2 3.29Å; L469-V571 HydrophobicContact CD1-CG2 3.79Å
572	V	74.7	Confident	70.9	Confident	10 Å²	10	63.4 Å²	63.4	6%	0.061	35%	0.346	C	S	.	.			trans	-138	140	-162.7	-174.4	0	0	0	0	108.4	L457 L458 S459 Q570 E576 L577 T580	L457-V572 HydrophobicContact CD2-CG2 4.12Å; L458-V572 PolarHBondContact O-N 2.64Å; S459-V572 WeakPolarHBondContact CA-O 3.22Å; S459-V572 WeakPolarHBondContact CB-O 3.26Å; S459-V572 PolarHBondContact OG-O 3.06Å; Q570-V572 HydrophobicContact CB-CG2 4.34Å; V572-E576 HydrophobicContact CG1-CB 3.33Å; V572-L577 HydrophobicContact CB-CD1 4.42Å; V572-L577 HydrophobicContact CG1-CB 4.38Å; V572-T580 HydrophobicContact CG1-CG2 4.4Å
573	T	76.7	Confident	71.1	Confident	53 Å²	53	67 Å²	67	33%	0.325	37%	0.37	S	S	.	.			trans	-67	158.3	174.6	62.2	0	0	0	0	111.1	P461 E575 E576 L577	P461-T573 HydrophobicContact CG-CG2 4.07Å; T573-E575 PolarHBondContact O-N 3.4Å; T573-E576 WeakPolarHBondContact CB-OE2 3.03Å; T573-E576 WeakPolarHBondContact CG2-OE2 3.45Å; T573-E576 PolarHBondContact N-OE2 3.44Å; T573-E576 PolarHBondContact O-N 2.88Å; T573-E576 WeakPolarHBondContact OG1-CB 3.42Å; T573-E576 WeakPolarHBondContact OG1-CG 3.38Å; T573-E576 PolarHBondContact OG1-N 3.43Å; T573-E576 PolarHBondContact OG1-OE2 2.79Å; T573-L577 WeakPolarHBondContact O-CB 3.12Å; T573-L577 PolarHBondContact O-N 2.65Å
574	S	70.3	Confident	71.4	Confident	75 Å²	75	67 Å²	67	52%	0.524	37%	0.37	S	S	.	.	H	α-helix	trans	-61.1	-26.8	-179.5	-47	0	0	0	0	113.1	S459	S459-S574 WeakPolarHBondContact OG-CA 3.45Å; S459-S574 PolarHBondContact OG-N 2.81Å; S459-S574 PolarHBondContact OG-OG 2.87Å
575	E	70.1	Confident	71.4	Confident	173 Å²	173	65.9 Å²	65.9	81%	0.808	37%	0.369	S	S	*	.	H	α-helix	trans	-77.1	-44.7	175	-63.2	179.7	179.1	0	0	112	T573 L577	T573-E575 PolarHBondContact O-N 3.4Å; E575-L577 VanDerWaalsContact C-N 3.26Å; E575-L577 PolarHBondContact O-N 3.44Å
576	E	75.3	Confident	71.3	Confident	100 Å²	100	68.8 Å²	68.8	47%	0.467	39%	0.39	S	S	.	.	H	α-helix	trans	-67.9	-25.7	176.4	-69.4	164.4	140.5	0	0	112.6	V572 T573 Q578 T579 T580	V572-E576 HydrophobicContact CG1-CB 3.33Å; T573-E576 WeakPolarHBondContact CB-OE2 3.03Å; T573-E576 WeakPolarHBondContact CG2-OE2 3.45Å; T573-E576 PolarHBondContact N-OE2 3.44Å; T573-E576 PolarHBondContact O-N 2.88Å; T573-E576 WeakPolarHBondContact OG1-CB 3.42Å; T573-E576 WeakPolarHBondContact OG1-CG 3.38Å; T573-E576 PolarHBondContact OG1-N 3.43Å; T573-E576 PolarHBondContact OG1-OE2 2.79Å; E576-Q578 PolarHBondContact O-N 2.87Å; E576-T579 PolarHBondContact O-N 3.47Å; E576-T579 PolarHBondContact O-OG1 3.34Å; E576-T580 WeakPolarHBondContact O-CG2 3.47Å; E576-T580 PolarHBondContact O-N 3.4Å; E576-T580 PolarHBondContact O-OG1 2.83Å
577	L	72.8	Confident	71.6	Confident	5 Å²	5	66.5 Å²	66.5	3%	0.026	38%	0.38	C	S	.	.	H	α-helix	trans	-56.7	-49.5	-174.1	-172	72.2	0	0	0	111.7	L457 V572 T573 E575 T579 T580 V581 T593 E595	L457-L577 HydrophobicContact CB-CD1 3.7Å; L457-L577 HydrophobicContact CD1-CD1 3.88Å; L457-L577 HydrophobicContact CG-CD1 4.47Å; V572-L577 HydrophobicContact CB-CD1 4.42Å; V572-L577 HydrophobicContact CG1-CB 4.38Å; T573-L577 WeakPolarHBondContact O-CB 3.12Å; T573-L577 PolarHBondContact O-N 2.65Å; E575-L577 VanDerWaalsContact C-N 3.26Å; E575-L577 PolarHBondContact O-N 3.44Å; L577-T579 VanDerWaalsContact C-N 3.35Å; L577-T579 PolarHBondContact O-N 3.04Å; L577-T580 WeakPolarHBondContact CA-OG1 3.45Å; L577-T580 PolarHBondContact O-N 3.12Å; L577-T580 PolarHBondContact O-OG1 3.36Å; L577-V581 HydrophobicContact CD1-CG2 4.47Å; L577-V581 HydrophobicContact CG-CG2 4.34Å; L577-V581 VanDerWaalsContact O-CB 3.3Å; L577-V581 WeakPolarHBondContact O-CB 3.39Å; L577-V581 WeakPolarHBondContact O-CG2 3.43Å; L577-V581 PolarHBondContact O-N 3.02Å; L577-T593 HydrophobicContact CD1-CG2 4.19Å; L577-E595 HydrophobicContact CD2-CG 3.83Å; L577-E595 VanDerWaalsContact CD2-OE1 3.22Å; L577-E595 WeakPolarHBondContact CD2-OE1 3.42Å
578	Q	67	Low	71.8	Confident	161 Å²	161	69.6 Å²	69.6	75%	0.752	38%	0.379	S	S	*	.	H	α-helix	trans	-62.8	-41.7	-179.5	-66.5	-174.9	-18.9	0	0	112	E576 T580 G582	E576-Q578 PolarHBondContact O-N 2.87Å; Q578-T580 PolarHBondContact O-N 3.46Å; Q578-G582 PolarHBondContact O-N 2.85Å; Q578-G582 VanDerWaalsContact O-N 3.16Å
579	T	71.2	Confident	72	Confident	94 Å²	94	68 Å²	68	58%	0.577	37%	0.374	S	S	*	.	H	α-helix	trans	-67.2	-37.4	-179.8	71.5	0	0	0	0	112.9	E576 L577 C583	E576-T579 PolarHBondContact O-N 3.47Å; E576-T579 PolarHBondContact O-OG1 3.34Å; L577-T579 VanDerWaalsContact C-N 3.35Å; L577-T579 PolarHBondContact O-N 3.04Å; T579-C583 PolarHBondContact O-N 2.84Å; T579-C583 PolarHBondContact O-SG 3.34Å
580	T	75.4	Confident	72.3	Confident	38 Å²	38	65.5 Å²	65.5	23%	0.233	36%	0.361	C	S	.	.	H	α-helix	trans	-76.1	-38.5	178.5	50	0	0	0	0	111.7	V572 E576 L577 Q578 C583 L584	V572-T580 HydrophobicContact CG1-CG2 4.4Å; E576-T580 WeakPolarHBondContact O-CG2 3.47Å; E576-T580 PolarHBondContact O-N 3.4Å; E576-T580 PolarHBondContact O-OG1 2.83Å; L577-T580 WeakPolarHBondContact CA-OG1 3.45Å; L577-T580 PolarHBondContact O-N 3.12Å; L577-T580 PolarHBondContact O-OG1 3.36Å; Q578-T580 PolarHBondContact O-N 3.46Å; T580-C583 PolarHBondContact O-N 2.76Å; T580-L584 WeakPolarHBondContact O-CB 3.45Å; T580-L584 WeakPolarHBondContact O-CG 3.18Å; T580-L584 PolarHBondContact O-N 3.47Å
581	V	72.9	Confident	72.5	Confident	30 Å²	30	62.6 Å²	62.6	18%	0.182	35%	0.348	C	S	.	.	H	α-helix	trans	-55.8	-52	172.9	164.7	0	0	0	0	111.5	L457 L577 C583 L584 I585 L590 T593	L457-V581 HydrophobicContact CD1-CG2 3.84Å; L577-V581 HydrophobicContact CD1-CG2 4.47Å; L577-V581 HydrophobicContact CG-CG2 4.34Å; L577-V581 VanDerWaalsContact O-CB 3.3Å; L577-V581 WeakPolarHBondContact O-CB 3.39Å; L577-V581 WeakPolarHBondContact O-CG2 3.43Å; L577-V581 PolarHBondContact O-N 3.02Å; V581-C583 VanDerWaalsContact C-N 3.3Å; V581-C583 PolarHBondContact O-N 3.05Å; V581-L584 PolarHBondContact O-N 3.31Å; V581-I585 HydrophobicContact CG1-CD1 3.57Å; V581-I585 HydrophobicContact CG1-CG1 4.29Å; V581-I585 VanDerWaalsContact O-CG1 3.32Å; V581-I585 WeakPolarHBondContact O-CG1 3.31Å; V581-I585 PolarHBondContact O-N 2.96Å; V581-L590 HydrophobicContact CB-CD2 4.35Å; V581-L590 HydrophobicContact CG1-CD2 3.9Å; V581-L590 HydrophobicContact CG2-CD2 4.14Å; V581-T593 HydrophobicContact CG2-CG2 3.41Å; V581-T593 VanDerWaalsContact CG2-CG2 3.41Å
582	G	66.1	Low	72.9	Confident	44 Å²	44	60.4 Å²	60.4	45%	0.454	33%	0.334	S	S	.	.	H	α-helix	trans	-57.4	-41.8	179.5	0	0	0	0	0	112.9	Q578 S586	Q578-G582 PolarHBondContact O-N 2.85Å; Q578-G582 VanDerWaalsContact O-N 3.16Å; G582-S586 PolarHBondContact O-N 3.4Å
583	C	74.4	Confident	73	Confident	78 Å²	78	60.3 Å²	60.3	53%	0.527	33%	0.334	S	S	.	.	H	α-helix	trans	-65.7	-46.3	176.1	-62.8	0	0	0	0	112.2	T579 T580 V581 S586	T579-C583 PolarHBondContact O-N 2.84Å; T579-C583 PolarHBondContact O-SG 3.34Å; T580-C583 PolarHBondContact O-N 2.76Å; V581-C583 VanDerWaalsContact C-N 3.3Å; V581-C583 PolarHBondContact O-N 3.05Å; C583-S586 PolarHBondContact O-N 2.78Å; C583-S586 PolarHBondContact O-OG 3.21Å
584	L	77	Confident	73	Confident	19 Å²	19	57.8 Å²	57.8	10%	0.099	32%	0.318	C	S	.	.	H	α-helix	trans	-73.1	-29	-175.9	-67.9	-179.2	0	0	0	113.9	Y455 L457 T580 V581 N589 L590	Y455-L584 HydrophobicContact CD2-CD1 3.74Å; Y455-L584 HydrophobicContact CD2-CD2 3.5Å; Y455-L584 VanDerWaalsContact CD2-CD2 3.5Å; Y455-L584 HydrophobicContact CD2-CG 4.22Å; Y455-L584 HydrophobicContact CE2-CD1 4.35Å; Y455-L584 HydrophobicContact CE2-CD2 3.39Å; Y455-L584 HydrophobicContact CG-CD1 4.14Å; L457-L584 HydrophobicContact CD1-CD1 4.18Å; L457-L584 HydrophobicContact CD2-CD1 3.93Å; L457-L584 HydrophobicContact CG-CD1 4.34Å; T580-L584 WeakPolarHBondContact O-CB 3.45Å; T580-L584 WeakPolarHBondContact O-CG 3.18Å; T580-L584 PolarHBondContact O-N 3.47Å; V581-L584 PolarHBondContact O-N 3.31Å; L584-N589 HydrophobicContact CD2-CB 4.21Å; L584-N589 PolarHBondContact O-N 3.31Å; L584-L590 HydrophobicContact CB-CB 3.89Å; L584-L590 HydrophobicContact CB-CD1 4.4Å; L584-L590 HydrophobicContact CD1-CD1 4.25Å; L584-L590 PolarHBondContact O-N 2.82Å
585	I	70.2	Confident	73.2	Confident	48 Å²	48	57.7 Å²	57.7	25%	0.246	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-43.6	170.4	-70.6	173.2	0	0	0	110.1	V581 E587 Y588 L590 V617 L1607	V581-I585 HydrophobicContact CG1-CD1 3.57Å; V581-I585 HydrophobicContact CG1-CG1 4.29Å; V581-I585 VanDerWaalsContact O-CG1 3.32Å; V581-I585 WeakPolarHBondContact O-CG1 3.31Å; V581-I585 PolarHBondContact O-N 2.96Å; I585-E587 PolarHBondContact O-N 3.4Å; I585-E587 VanDerWaalsContact O-N 3.14Å; I585-Y588 PolarHBondContact O-N 3.31Å; I585-L590 HydrophobicContact CD1-CD2 4.07Å; I585-L590 HydrophobicContact CG1-CB 4.22Å; I585-L590 HydrophobicContact CG1-CD2 3.65Å; I585-V617 HydrophobicContact CD1-CG1 4.2Å; I585-V617 HydrophobicContact CG1-CG1 4.09Å; I585-V617 HydrophobicContact CG1-CG2 4.32Å; I585-V617 HydrophobicContact CG2-CG1 4.44Å; I585-L1607 HydrophobicContact CD1-CD1 4.43Å
586	S	64.7	Low	73.4	Confident	93 Å²	93	51.6 Å²	51.6	65%	0.65	28%	0.281	S	S	*	.	H	α-helix	trans	-61.4	-23.6	-178.1	78.2	0	0	0	0	114.5	G582 C583	G582-S586 PolarHBondContact O-N 3.4Å; C583-S586 PolarHBondContact O-N 2.78Å; C583-S586 PolarHBondContact O-OG 3.21Å
587	E	69.6	Low	73.1	Confident	114 Å²	114	52.3 Å²	52.3	53%	0.533	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	6	177.7	-60.2	-168.4	147	0	0	114.3	I585 N589	I585-E587 PolarHBondContact O-N 3.4Å; I585-E587 VanDerWaalsContact O-N 3.14Å; E587-N589 HydrophobicContact CB-CB 4.11Å; E587-N589 VanDerWaalsContact CB-ND2 3.31Å; E587-N589 WeakPolarHBondContact CB-ND2 3.24Å; E587-N589 PolarHBondContact O-N 2.8Å; E587-N589 PolarHBondContact OE2-ND2 3.29Å
588	Y	70.8	Confident	72.5	Confident	107 Å²	107	59.4 Å²	59.4	42%	0.42	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	35.5	-166.6	-52.6	-75.8	0	0	0	112.9	I446 Y449 T450 I585 Y619	I446-Y588 HydrophobicContact CD1-CD1 4.43Å; I446-Y588 HydrophobicContact CD1-CE1 4.11Å; I446-Y588 HydrophobicContact CG2-CD1 3.82Å; I446-Y588 HydrophobicContact CG2-CE1 4.44Å; I446-Y588 HydrophobicContact CG2-CG 4.32Å; Y449-Y588 WeakPolarHBondContact CE1-O 3.37Å; T450-Y588 WeakPolarHBondContact CG2-O 3.08Å; I585-Y588 PolarHBondContact O-N 3.31Å; Y588-Y619 HydrophobicContact CD1-CD1 4.13Å; Y588-Y619 AromaticContact CD1-CE1 3.94Å; Y588-Y619 HydrophobicContact CD1-CE1 3.94Å; Y588-Y619 HydrophobicContact CE1-CD1 4.43Å
589	N	78.1	Confident	72.1	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.07	31%	0.306	C	S	.	.			trans	-107.9	0.8	-176.9	-77.1	-30.3	0	0	0	112.4	Y449 G454 Y455 L584 E587	Y449-N589 WeakPolarHBondContact CE1-OD1 3.41Å; Y449-N589 PolarHBondContact OH-OD1 3.02Å; Y449-N589 VanDerWaalsContact OH-OD1 3.11Å; G454-N589 CarbonylContact C-O 3.57Å; G454-N589 WeakPolarHBondContact CA-O 3.23Å; Y455-N589 HydrophobicContact CD2-CB 4.14Å; Y455-N589 VanDerWaalsContact CD2-O 3.29Å; Y455-N589 WeakPolarHBondContact CD2-O 3.38Å; Y455-N589 HydrophobicContact CE2-CB 4.22Å; Y455-N589 PolarHBondContact N-O 2.88Å; L584-N589 HydrophobicContact CD2-CB 4.21Å; L584-N589 PolarHBondContact O-N 3.31Å; E587-N589 HydrophobicContact CB-CB 4.11Å; E587-N589 VanDerWaalsContact CB-ND2 3.31Å; E587-N589 WeakPolarHBondContact CB-ND2 3.24Å; E587-N589 PolarHBondContact O-N 2.8Å; E587-N589 PolarHBondContact OE2-ND2 3.29Å
590	L	77.8	Confident	71.3	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.1	172.6	-170.2	61.8	0	0	0	111.1	L457 V581 L584 I585 T593 V617 Y619	L457-L590 HydrophobicContact CD1-CD1 4.12Å; L457-L590 HydrophobicContact CG-CD1 4.01Å; V581-L590 HydrophobicContact CB-CD2 4.35Å; V581-L590 HydrophobicContact CG1-CD2 3.9Å; V581-L590 HydrophobicContact CG2-CD2 4.14Å; L584-L590 HydrophobicContact CB-CB 3.89Å; L584-L590 HydrophobicContact CB-CD1 4.4Å; L584-L590 HydrophobicContact CD1-CD1 4.25Å; L584-L590 PolarHBondContact O-N 2.82Å; I585-L590 HydrophobicContact CD1-CD2 4.07Å; I585-L590 HydrophobicContact CG1-CB 4.22Å; I585-L590 HydrophobicContact CG1-CD2 3.65Å; L590-T593 HydrophobicContact CD1-CG2 4.27Å; L590-T593 HydrophobicContact CD2-CG2 4.36Å; L590-V617 HydrophobicContact CB-CG2 4Å; L590-V617 HydrophobicContact CD2-CG2 3.77Å; L590-V617 HydrophobicContact CG-CG2 3.87Å; L590-Y619 PolarHBondContact O-OH 2.97Å
591	L	77.4	Confident	70.3	Confident	9 Å²	9	64.1 Å²	64.1	5%	0.047	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-51.8	170.6	-177.2	64	0	0	0	110.6	Y455 V456 M616 L620 P642 V646	Y455-L591 WeakPolarHBondContact O-CB 3.36Å; Y455-L591 PolarHBondContact O-N 3.38Å; V456-L591 HydrophobicContact CG2-CB 4.37Å; V456-L591 HydrophobicContact CG2-CD2 3.97Å; V456-L591 HydrophobicContact CG2-CG 4.48Å; L591-M616 WeakPolarHBondContact O-CE 3.47Å; L591-L620 HydrophobicContact CD1-CD1 3.9Å; L591-P642 HydrophobicContact CD1-CB 4.36Å; L591-V646 HydrophobicContact CD2-CG2 4.15Å; L591-V646 HydrophobicContact CG-CG2 4.34Å
592	S	78	Confident	69.2	Low	0 Å²	0	72.4 Å²	72.4	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	163	178.5	64	0	0	0	0	112.8	Y455 V456 L457 N615 M616	Y455-S592 PolarHBondContact O-N 2.97Å; V456-S592 WeakPolarHBondContact CA-O 3.32Å; L457-S592 PolarHBondContact N-O 3.31Å; S592-N615 CarbonylContact C-O 3.55Å; S592-N615 VanDerWaalsContact CA-O 3.27Å; S592-N615 WeakPolarHBondContact CA-O 3.39Å; S592-N615 WeakPolarHBondContact CB-O 3.31Å; S592-M616 VanDerWaalsContact CB-SD 3.53Å
593	T	77.3	Confident	68.3	Low	8 Å²	8	75.1 Å²	75.1	5%	0.049	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	148.5	161.9	70.3	0	0	0	0	110.3	L457 L577 V581 L590 I614 N615	L457-T593 HydrophobicContact CB-CG2 4.12Å; L457-T593 HydrophobicContact CD1-CG2 4.19Å; L457-T593 HydrophobicContact CG-CG2 4.42Å; L457-T593 CarbonylContact O-C 3.53Å; L457-T593 WeakPolarHBondContact O-CA 3.11Å; L577-T593 HydrophobicContact CD1-CG2 4.19Å; V581-T593 HydrophobicContact CG2-CG2 3.41Å; V581-T593 VanDerWaalsContact CG2-CG2 3.41Å; L590-T593 HydrophobicContact CD1-CG2 4.27Å; L590-T593 HydrophobicContact CD2-CG2 4.36Å; T593-I614 CarbonylContact O-C 3.54Å; T593-I614 WeakPolarHBondContact O-CA 3.47Å; T593-N615 PolarHBondContact N-O 3.17Å; T593-N615 PolarHBondContact O-N 2.87Å; T593-N615 WeakPolarHBondContact OG1-CB 3.39Å; T593-N615 PolarHBondContact OG1-ND2 2.86Å; T593-N615 VanDerWaalsContact OG1-ND2 3.15Å
594	V	77.4	Confident	67.3	Low	0 Å²	0	81.3 Å²	81.3	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	116.3	-178.4	-177.6	0	0	0	0	108.6	V456 L457 L458 S459 F596 Y612 T613 I614 I650	V456-V594 HydrophobicContact CG1-CG2 4.18Å; L457-V594 PolarHBondContact O-N 3.37Å; L458-V594 CarbonylContact C-O 3.59Å; L458-V594 WeakPolarHBondContact CA-O 3.42Å; L458-V594 HydrophobicContact CD2-CB 3.7Å; L458-V594 HydrophobicContact CD2-CG1 3.84Å; L458-V594 HydrophobicContact CD2-CG2 4.28Å; L458-V594 HydrophobicContact CG-CB 4.32Å; S459-V594 PolarHBondContact N-O 3.48Å; V594-F596 HydrophobicContact CG1-CE2 4.02Å; V594-F596 HydrophobicContact CG1-CZ 4.18Å; V594-Y612 HydrophobicContact CG1-CD2 4.45Å; V594-T613 VanDerWaalsContact CA-O 3.27Å; V594-T613 WeakPolarHBondContact CA-O 3.27Å; V594-I614 HydrophobicContact CG2-CG1 4.41Å; V594-I650 HydrophobicContact CG1-CD1 4.05Å; V594-I650 HydrophobicContact CG2-CD1 3.67Å
595	E	74	Confident	66.3	Low	73 Å²	73	85.9 Å²	85.9	34%	0.341	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.9	-180	-44.4	167.8	134	0	0	109.6	S459 L577 Y612 T613	S459-E595 CarbonylContact O-C 3.59Å; S459-E595 WeakPolarHBondContact O-CA 3.33Å; L577-E595 HydrophobicContact CD2-CG 3.83Å; L577-E595 VanDerWaalsContact CD2-OE1 3.22Å; L577-E595 WeakPolarHBondContact CD2-OE1 3.42Å; E595-Y612 CarbonylContact O-C 3.47Å; E595-Y612 VanDerWaalsContact O-CA 3.26Å; E595-Y612 WeakPolarHBondContact O-CA 3.21Å; E595-T613 VanDerWaalsContact CB-OG1 3.25Å; E595-T613 WeakPolarHBondContact CB-OG1 3.14Å; E595-T613 PolarHBondContact N-O 3.1Å; E595-T613 PolarHBondContact N-OG1 3Å; E595-T613 PolarHBondContact O-N 2.89Å; E595-T613 PolarHBondContact O-OG1 3.43Å; E595-T613 PolarHBondContact OE2-OG1 3.37Å; E595-T613 VanDerWaalsContact OE2-OG1 3.08Å
596	F	74.6	Confident	65.7	Low	45 Å²	45	87.4 Å²	87.4	20%	0.197	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	134.1	170.6	-64.9	-85.9	0	0	0	109.7	L458 S459 P460 V594 K598 W610 Y612	L458-F596 HydrophobicContact CD2-CE2 3.7Å; L458-F596 HydrophobicContact CD2-CZ 4.4Å; S459-F596 PolarHBondContact O-N 2.76Å; P460-F596 VanDerWaalsContact CD-O 3.3Å; P460-F596 WeakPolarHBondContact CD-O 3.15Å; V594-F596 HydrophobicContact CG1-CE2 4.02Å; V594-F596 HydrophobicContact CG1-CZ 4.18Å; F596-K598 PolarHBondContact O-N 2.77Å; F596-W610 AromaticContact CD1-CE3 3.91Å; F596-W610 HydrophobicContact CD1-CE3 3.91Å; F596-W610 HydrophobicContact CD1-CZ3 4.08Å; F596-W610 AromaticContact CE1-CE3 3.88Å; F596-W610 HydrophobicContact CE1-CE3 3.88Å; F596-W610 HydrophobicContact CE1-CZ3 4.01Å; F596-Y612 HydrophobicContact CD1-CG 4.49Å; F596-Y612 HydrophobicContact CE1-CD1 4.28Å; F596-Y612 HydrophobicContact CE1-CG 4.23Å
597	K	67.9	Low	65.5	Low	116 Å²	116	85.3 Å²	85.3	50%	0.504	43%	0.425	S	S	.	.			trans	-69	130.7	175.9	-167.4	179.8	179.8	-175.5	0	109.6	D599 E611	K597-D599 PolarHBondContact O-N 3.43Å; K597-E611 HydrophobicContact CB-CB 3.82Å; K597-E611 HydrophobicContact CD-CB 3.81Å; K597-E611 VanDerWaalsContact CD-CD 3.43Å; K597-E611 HydrophobicContact CD-CG 4.24Å; K597-E611 WeakPolarHBondContact CD-OE1 3.37Å; K597-E611 VanDerWaalsContact CD-OE2 3.27Å; K597-E611 WeakPolarHBondContact CD-OE2 3.18Å; K597-E611 PolarHBondContact N-O 2.76Å; K597-E611 IonicContact NZ-OE1 3.75Å; K597-E611 PolarHBondContact NZ-OE1 2.65Å; K597-E611 IonicContact NZ-OE2 2.75Å; K597-E611 PolarHBondContact NZ-OE2 3.07Å
598	K	61.3	Low	65	Low	153 Å²	153	81.9 Å²	81.9	67%	0.665	41%	0.414	S	S	*	.			trans	-79.3	113.8	-176.6	-171.5	176.9	-176.9	178.5	0	111.1	F596	F596-K598 PolarHBondContact O-N 2.77Å
599	D	57.3	Low	64.7	Low	115 Å²	115	80 Å²	80	62%	0.615	41%	0.411	S	S	*	.			trans	-76.5	136.9	161.8	-92.6	-21	0	0	0	110.1	K597 N601	K597-D599 PolarHBondContact O-N 3.43Å; D599-N601 VanDerWaalsContact C-N 3.25Å; D599-N601 PolarHBondContact O-N 2.97Å
600	N	54.7	Low	64.2	Low	146 Å²	146	81 Å²	81	78%	0.781	41%	0.413	S	S	*	.	S	Bend	trans	-80.6	6.5	-170.2	-74	-34.1	0	0	0	115.1
601	N	54.5	Low	63.7	Low	132 Å²	132	82.4 Å²	82.4	71%	0.706	42%	0.42	S	S	*	.			trans	-121.4	109.2	-176.5	-70.9	-18.7	0	0	0	111	D599 T603	D599-N601 VanDerWaalsContact C-N 3.25Å; D599-N601 PolarHBondContact O-N 2.97Å; N601-T603 PolarHBondContact O-N 3.33Å
602	E	50.6	Low	63.5	Low	204 Å²	204	82 Å²	82	95%	0.953	42%	0.418	S	S	*	.			trans	-75.3	81.4	173.9	-65.4	-178.2	164	0	0	111
603	T	47.2	Very low	63.2	Low	101 Å²	101	82.8 Å²	82.8	62%	0.62	42%	0.422	S	S	*	.			trans	-115.2	144.4	172	55.1	0	0	0	0	111.4	N601 V605	N601-T603 PolarHBondContact O-N 3.33Å; T603-V605 PolarHBondContact O-N 2.72Å
604	E	53.3	Low	63	Low	208 Å²	208	82.5 Å²	82.5	97%	0.972	42%	0.421	S	S	*	.	S	Bend	trans	-66.3	3.3	-177	-61.4	-179.2	136.4	0	0	114.8
605	V	55.5	Low	62.6	Low	114 Å²	114	84.2 Å²	84.2	69%	0.691	43%	0.43	S	S	*	.	S	Bend	trans	-96.1	124.8	-177.7	-176	0	0	0	0	109.2	T603	T603-V605 PolarHBondContact O-N 2.72Å
606	L	58.3	Low	62.3	Low	80 Å²	80	81.6 Å²	81.6	42%	0.419	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-51.1	127.6	174.6	-73.4	156.9	0	0	0	110.6	W610 L657	L606-W610 HydrophobicContact CD2-CZ2 4.08Å; L606-L657 HydrophobicContact CD2-CD2 4.45Å
607	P	60.9	Low	61.8	Low	49 Å²	49	80.2 Å²	80.2	32%	0.318	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-64.9	140.1	178.8	26.1	-32.9	0	0	0	110.1	W610	P607-W610 HydrophobicContact CG-CD2 4.43Å; P607-W610 HydrophobicContact CG-CZ2 3.92Å; P607-W610 VanDerWaalsContact O-CD1 3.31Å; P607-W610 PolarHBondContact O-NE1 3.46Å
608	S	59.2	Low	61.2	Low	43 Å²	43	76 Å²	76	30%	0.301	40%	0.396	S	S	.	.	S	Bend	trans	-78.2	-27.8	-179.7	65.1	0	0	0	0	112.7	T1595 N1596 V1597	S608-T1595 CarbonylContact C-O 3.43Å; S608-T1595 WeakPolarHBondContact CB-O 3.5Å; S608-T1595 VanDerWaalsContact O-O 3.1Å; S608-T1595 PolarHBondContact OG-O 2.78Å; S608-N1596 VanDerWaalsContact CB-OD1 3.27Å; S608-N1596 WeakPolarHBondContact CB-OD1 3.29Å; S608-N1596 VanDerWaalsContact O-CA 3.3Å; S608-N1596 WeakPolarHBondContact O-CA 3.24Å; S608-V1597 PolarHBondContact O-N 3.25Å; S608-V1597 VanDerWaalsContact O-N 3.12Å
609	L	63.9	Low	61	Low	68 Å²	68	71 Å²	71	36%	0.356	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	120.3	173.3	-179.7	65.1	0	0	0	108.8	V1597 E1599	L609-V1597 WeakPolarHBondContact CA-O 3.37Å; L609-V1597 HydrophobicContact CD1-CB 4.15Å; L609-V1597 HydrophobicContact CD1-CG1 4.41Å; L609-V1597 WeakPolarHBondContact CD1-O 3.01Å; L609-E1599 HydrophobicContact CD1-CB 4.11Å
610	W	67.4	Low	60.8	Low	32 Å²	32	65.5 Å²	65.5	12%	0.121	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.4	170.1	-70.8	69	0	0	0	109.2	F596 L606 P607 I654 L657 H658 V1597 V1598 E1599	F596-W610 AromaticContact CD1-CE3 3.91Å; F596-W610 HydrophobicContact CD1-CE3 3.91Å; F596-W610 HydrophobicContact CD1-CZ3 4.08Å; F596-W610 AromaticContact CE1-CE3 3.88Å; F596-W610 HydrophobicContact CE1-CE3 3.88Å; F596-W610 HydrophobicContact CE1-CZ3 4.01Å; L606-W610 HydrophobicContact CD2-CZ2 4.08Å; P607-W610 HydrophobicContact CG-CD2 4.43Å; P607-W610 HydrophobicContact CG-CZ2 3.92Å; P607-W610 VanDerWaalsContact O-CD1 3.31Å; P607-W610 PolarHBondContact O-NE1 3.46Å; W610-I654 HydrophobicContact CG-CG2 4.48Å; W610-L657 HydrophobicContact CH2-CD1 4.3Å; W610-H658 AromaticContact CD1-CE1 3.65Å; W610-H658 AromaticContact NE1-CE1 3.34Å; W610-H658 PolarHBondContact NE1-CE1 3.44Å; W610-H658 VanDerWaalsContact NE1-CE1 3.34Å; W610-H658 AromaticContact NE1-NE2 3.67Å; W610-V1597 PolarHBondContact N-O 2.81Å; W610-V1598 HydrophobicContact CB-CG2 4.24Å; W610-E1599 PolarHBondContact O-N 3.25Å
611	E	67.9	Low	60.7	Low	34 Å²	34	59.4 Å²	59.4	16%	0.159	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120	167.8	-80.3	-174.1	-106	0	0	109.6	K597 E1599 R1601	K597-E611 HydrophobicContact CB-CB 3.82Å; K597-E611 HydrophobicContact CD-CB 3.81Å; K597-E611 VanDerWaalsContact CD-CD 3.43Å; K597-E611 HydrophobicContact CD-CG 4.24Å; K597-E611 WeakPolarHBondContact CD-OE1 3.37Å; K597-E611 VanDerWaalsContact CD-OE2 3.27Å; K597-E611 WeakPolarHBondContact CD-OE2 3.18Å; K597-E611 PolarHBondContact N-O 2.76Å; K597-E611 IonicContact NZ-OE1 3.75Å; K597-E611 PolarHBondContact NZ-OE1 2.65Å; K597-E611 IonicContact NZ-OE2 2.75Å; K597-E611 PolarHBondContact NZ-OE2 3.07Å; E611-E1599 WeakPolarHBondContact CA-O 3.31Å; E611-E1599 HydrophobicContact CG-CB 4.42Å; E611-R1601 IonicContact OE2-CZ 2.76Å; E611-R1601 IonicContact OE2-NE 2.68Å; E611-R1601 PolarHBondContact OE2-NE 3.42Å; E611-R1601 IonicContact OE2-NH2 3.13Å
612	Y	72.8	Confident	60.4	Low	1 Å²	1	58.1 Å²	58.1	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	151.6	173.1	69.9	-97.6	0	0	0	112.2	V594 E595 F596 I614 I650 D651 I654 V1598 I1600 R1601	V594-Y612 HydrophobicContact CG1-CD2 4.45Å; E595-Y612 CarbonylContact O-C 3.47Å; E595-Y612 VanDerWaalsContact O-CA 3.26Å; E595-Y612 WeakPolarHBondContact O-CA 3.21Å; F596-Y612 HydrophobicContact CD1-CG 4.49Å; F596-Y612 HydrophobicContact CE1-CD1 4.28Å; F596-Y612 HydrophobicContact CE1-CG 4.23Å; Y612-I614 HydrophobicContact CD2-CD1 4.46Å; Y612-I614 HydrophobicContact CD2-CG1 3.95Å; Y612-I614 HydrophobicContact CE2-CD1 3.76Å; Y612-I614 HydrophobicContact CE2-CG1 3.75Å; Y612-I650 HydrophobicContact CE1-CG2 4.11Å; Y612-I650 HydrophobicContact CE2-CG2 4.15Å; Y612-D651 PolarHBondContact OH-OD1 2.78Å; Y612-I654 HydrophobicContact CD1-CD1 3.95Å; Y612-I654 HydrophobicContact CE1-CD1 3.59Å; Y612-V1598 HydrophobicContact CD1-CG1 4.35Å; Y612-V1598 HydrophobicContact CE1-CG1 3.67Å; Y612-I1600 HydrophobicContact CE1-CD1 4.42Å; Y612-I1600 HydrophobicContact CE1-CG1 4.02Å; Y612-I1600 HydrophobicContact CE2-CG1 4.42Å; Y612-I1600 HydrophobicContact CE2-CG2 4.22Å; Y612-I1600 WeakPolarHBondContact OH-CD1 3.41Å; Y612-R1601 PolarHBondContact O-N 3.43Å; Y612-R1601 VanDerWaalsContact O-N 3.12Å
613	T	70.5	Confident	60.2	Low	16 Å²	16	50.1 Å²	50.1	10%	0.098	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	149	171	68.4	0	0	0	0	110.2	V594 E595 R1601	V594-T613 VanDerWaalsContact CA-O 3.27Å; V594-T613 WeakPolarHBondContact CA-O 3.27Å; E595-T613 VanDerWaalsContact CB-OG1 3.25Å; E595-T613 WeakPolarHBondContact CB-OG1 3.14Å; E595-T613 PolarHBondContact N-O 3.1Å; E595-T613 PolarHBondContact N-OG1 3Å; E595-T613 PolarHBondContact O-N 2.89Å; E595-T613 PolarHBondContact O-OG1 3.43Å; E595-T613 PolarHBondContact OE2-OG1 3.37Å; E595-T613 VanDerWaalsContact OE2-OG1 3.08Å; T613-R1601 VanDerWaalsContact CA-O 3.23Å; T613-R1601 WeakPolarHBondContact CA-O 3.29Å; T613-R1601 WeakPolarHBondContact CB-O 3.31Å; T613-R1601 HydrophobicContact CG2-CB 4.01Å; T613-R1601 WeakPolarHBondContact CG2-O 3.21Å
614	I	73.3	Confident	59.9	Low	3 Å²	3	50.1 Å²	50.1	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	115	165.8	-57.6	174.8	0	0	0	106.5	T593 V594 Y612 M616 Y643 V646 R647 I650	T593-I614 CarbonylContact O-C 3.54Å; T593-I614 WeakPolarHBondContact O-CA 3.47Å; V594-I614 HydrophobicContact CG2-CG1 4.41Å; Y612-I614 HydrophobicContact CD2-CD1 4.46Å; Y612-I614 HydrophobicContact CD2-CG1 3.95Å; Y612-I614 HydrophobicContact CE2-CD1 3.76Å; Y612-I614 HydrophobicContact CE2-CG1 3.75Å; I614-M616 HydrophobicContact CG2-CG 4.32Å; I614-M616 HydrophobicContact CG2-SD 4.23Å; I614-Y643 HydrophobicContact CB-CE2 4.13Å; I614-Y643 HydrophobicContact CD1-CE2 4.32Å; I614-Y643 HydrophobicContact CG2-CD2 4.17Å; I614-Y643 HydrophobicContact CG2-CE2 4.26Å; I614-V646 HydrophobicContact CD1-CG1 4.32Å; I614-V646 HydrophobicContact CG2-CG1 4.14Å; I614-R647 HydrophobicContact CD1-CB 3.9Å; I614-R647 HydrophobicContact CD1-CG 4.36Å; I614-I650 HydrophobicContact CD1-CD1 3.88Å; I614-I650 HydrophobicContact CG1-CD1 4.19Å
615	N	69.4	Low	59.4	Low	36 Å²	36	42.5 Å²	42.5	19%	0.193	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	134.3	172.9	-42.3	-35.4	0	0	0	108.1	S592 T593 H1603	S592-N615 CarbonylContact C-O 3.55Å; S592-N615 VanDerWaalsContact CA-O 3.27Å; S592-N615 WeakPolarHBondContact CA-O 3.39Å; S592-N615 WeakPolarHBondContact CB-O 3.31Å; T593-N615 PolarHBondContact N-O 3.17Å; T593-N615 PolarHBondContact O-N 2.87Å; T593-N615 WeakPolarHBondContact OG1-CB 3.39Å; T593-N615 PolarHBondContact OG1-ND2 2.86Å; T593-N615 VanDerWaalsContact OG1-ND2 3.15Å; N615-H1603 PolarHBondContact OD1-O 3.14Å
616	M	68.3	Low	58.6	Low	17 Å²	17	40.6 Å²	40.6	8%	0.084	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	156.3	179.5	-64.2	-73	-54.4	0	0	108.4	L591 S592 I614 L620 L621 P642 Y643	L591-M616 WeakPolarHBondContact O-CE 3.47Å; S592-M616 VanDerWaalsContact CB-SD 3.53Å; I614-M616 HydrophobicContact CG2-CG 4.32Å; I614-M616 HydrophobicContact CG2-SD 4.23Å; M616-L620 HydrophobicContact CE-CB 4.14Å; M616-L620 HydrophobicContact CE-CD1 3.76Å; M616-L621 HydrophobicContact CB-CD1 3.63Å; M616-L621 HydrophobicContact CB-CG 4.17Å; M616-L621 HydrophobicContact CG-CD1 3.94Å; M616-P642 HydrophobicContact CE-CB 3.72Å; M616-Y643 HydrophobicContact CG-CD2 3.99Å
617	V	63.3	Low	57.6	Low	16 Å²	16	43.1 Å²	43.1	10%	0.097	24%	0.242	C	C	.	.			trans	-84.5	145.8	-178.3	-158.6	0	0	0	0	111.8	I585 L590 Y619 L620 L621	I585-V617 HydrophobicContact CD1-CG1 4.2Å; I585-V617 HydrophobicContact CG1-CG1 4.09Å; I585-V617 HydrophobicContact CG1-CG2 4.32Å; I585-V617 HydrophobicContact CG2-CG1 4.44Å; L590-V617 HydrophobicContact CB-CG2 4Å; L590-V617 HydrophobicContact CD2-CG2 3.77Å; L590-V617 HydrophobicContact CG-CG2 3.87Å; V617-Y619 HydrophobicContact CB-CD1 4.19Å; V617-Y619 HydrophobicContact CB-CE1 3.82Å; V617-Y619 HydrophobicContact CB-CE2 4.12Å; V617-Y619 HydrophobicContact CG1-CD1 3.67Å; V617-Y619 HydrophobicContact CG1-CE1 3.37Å; V617-Y619 HydrophobicContact CG1-CG 4.41Å; V617-Y619 HydrophobicContact CG2-CE1 4.35Å; V617-Y619 PolarHBondContact O-N 3.37Å; V617-L620 WeakPolarHBondContact O-CA 3.16Å; V617-L620 WeakPolarHBondContact O-CB 3.3Å; V617-L620 PolarHBondContact O-N 2.94Å; V617-L621 PolarHBondContact O-N 3.3Å
618	D	55.1	Low	56.6	Low	27 Å²	27	45.6 Å²	45.6	14%	0.144	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-17	-179.8	-88.6	30.9	0	0	0	117.3	L620 L1607 K1608	D618-L620 VanDerWaalsContact C-N 3.34Å; D618-L1607 PolarHBondContact OD1-N 2.71Å; D618-L1607 PolarHBondContact OD2-N 3.06Å; D618-L1607 VanDerWaalsContact OD2-N 3.14Å; D618-K1608 PolarHBondContact O-NZ 2.88Å; D618-K1608 WeakPolarHBondContact OD2-CD 3.36Å; D618-K1608 WeakPolarHBondContact OD2-CE 3.35Å; D618-K1608 VanDerWaalsContact OD2-CG 3.27Å; D618-K1608 WeakPolarHBondContact OD2-CG 3.06Å; D618-K1608 IonicContact OD2-NZ 2.87Å; D618-K1608 PolarHBondContact OD2-NZ 3.05Å
619	Y	56.9	Low	55.8	Low	48 Å²	48	49.9 Å²	49.9	19%	0.188	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-6.4	171.7	58.1	-111.9	0	0	0	113	I446 T450 Y588 L590 V617	I446-Y619 HydrophobicContact CG2-CD2 3.74Å; I446-Y619 HydrophobicContact CG2-CE2 4.22Å; I446-Y619 HydrophobicContact CG2-CG 4.07Å; T450-Y619 HydrophobicContact CG2-CD2 4.33Å; T450-Y619 HydrophobicContact CG2-CE2 3.45Å; T450-Y619 VanDerWaalsContact CG2-CE2 3.45Å; Y588-Y619 HydrophobicContact CD1-CD1 4.13Å; Y588-Y619 AromaticContact CD1-CE1 3.94Å; Y588-Y619 HydrophobicContact CD1-CE1 3.94Å; Y588-Y619 HydrophobicContact CE1-CD1 4.43Å; L590-Y619 PolarHBondContact O-OH 2.97Å; V617-Y619 HydrophobicContact CB-CD1 4.19Å; V617-Y619 HydrophobicContact CB-CE1 3.82Å; V617-Y619 HydrophobicContact CB-CE2 4.12Å; V617-Y619 HydrophobicContact CG1-CD1 3.67Å; V617-Y619 HydrophobicContact CG1-CE1 3.37Å; V617-Y619 HydrophobicContact CG1-CG 4.41Å; V617-Y619 HydrophobicContact CG2-CE1 4.35Å; V617-Y619 PolarHBondContact O-N 3.37Å
620	L	53.5	Low	54.8	Low	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-17.7	173.9	-68	170.1	0	0	0	113	A447 L591 M616 V617 D618 Y639 P642	A447-L620 HydrophobicContact CB-CD2 4.29Å; L591-L620 HydrophobicContact CD1-CD1 3.9Å; M616-L620 HydrophobicContact CE-CB 4.14Å; M616-L620 HydrophobicContact CE-CD1 3.76Å; V617-L620 WeakPolarHBondContact O-CA 3.16Å; V617-L620 WeakPolarHBondContact O-CB 3.3Å; V617-L620 PolarHBondContact O-N 2.94Å; D618-L620 VanDerWaalsContact C-N 3.34Å; L620-Y639 WeakPolarHBondContact O-CB 3.39Å; L620-P642 HydrophobicContact CD2-CG 4.19Å
621	L	53.6	Low	53.5	Low	19 Å²	19	52.4 Å²	52.4	10%	0.099	29%	0.292	C	S	.	.			trans	-138.9	126.1	177.1	-70.5	179	0	0	0	110.8	M616 V617 Y639 L1604	M616-L621 HydrophobicContact CB-CD1 3.63Å; M616-L621 HydrophobicContact CB-CG 4.17Å; M616-L621 HydrophobicContact CG-CD1 3.94Å; V617-L621 PolarHBondContact O-N 3.3Å; L621-Y639 WeakPolarHBondContact CD2-O 3.3Å; L621-L1604 HydrophobicContact CD1-CD2 3.88Å; L621-L1604 HydrophobicContact CD1-CG 4.16Å
622	D	48	Very low	52.3	Low	104 Å²	104	56.2 Å²	56.2	56%	0.556	31%	0.314	S	S	*	.			trans	-99.2	87.8	170.7	-150.9	14.7	0	0	0	109.5	N624 K1608	D622-N624 PolarHBondContact O-N 3.1Å; D622-K1608 IonicContact OD1-NZ 3.86Å
623	S	45.7	Very low	50.8	Low	36 Å²	36	60.9 Å²	60.9	25%	0.252	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.4	-174.6	48.5	0	0	0	0	114.5
624	N	42	Very low	49.5	Very low	102 Å²	102	69.7 Å²	69.7	55%	0.545	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	3.7	-157.7	-65.3	-6.1	0	0	0	114.9	D622 S626	D622-N624 PolarHBondContact O-N 3.1Å; N624-S626 PolarHBondContact O-N 3.31Å
625	S	41.8	Very low	48.1	Very low	47 Å²	47	75.2 Å²	75.2	33%	0.329	41%	0.405	S	S	.	.			trans	-95.1	27.5	-171.4	60	0	0	0	0	115.1	L627	S625-L627 PolarHBondContact O-N 3.09Å
626	S	37.8	Very low	47	Very low	74 Å²	74	76 Å²	76	52%	0.517	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	16.6	-167.6	75.6	0	0	0	0	117	N624	N624-S626 PolarHBondContact O-N 3.31Å
627	L	39	Very low	46.1	Very low	134 Å²	134	77 Å²	77	70%	0.702	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.2	-6.6	-172.8	-91.9	164.7	0	0	0	116.4	S625	S625-L627 PolarHBondContact O-N 3.09Å
628	D	39	Very low	45.4	Very low	100 Å²	100	78 Å²	78	54%	0.535	43%	0.429	S	S	.	.			trans	-103.8	102.8	174.7	-80	-31.8	0	0	0	110.7	D630	D628-D630 PolarHBondContact O-N 3.27Å
629	E	42.8	Very low	45.3	Very low	134 Å²	134	79.3 Å²	79.3	63%	0.626	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.7	172.1	-67.7	-159.9	115.1	0	0	113	R674	E629-R674 PolarHBondContact O-NH1 3.12Å
630	D	42.3	Very low	45.5	Very low	91 Å²	91	77.7 Å²	77.7	49%	0.487	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-2.4	-163.5	-69.5	-45.3	0	0	0	115.3	D628 D632 P682	D628-D630 PolarHBondContact O-N 3.27Å; D630-D632 PolarHBondContact O-N 3.19Å; D630-P682 WeakPolarHBondContact OD2-CA 3.17Å; D630-P682 VanDerWaalsContact OD2-CB 3.25Å; D630-P682 WeakPolarHBondContact OD2-CB 3.46Å
631	A	39.7	Very low	46	Very low	61 Å²	61	82.7 Å²	82.7	50%	0.504	45%	0.446	S	S	.	.	S	Bend	trans	-86.9	109	-176.1	0	0	0	0	0	114.2
632	D	43.5	Very low	46.5	Very low	114 Å²	114	82.2 Å²	82.2	61%	0.61	44%	0.444	S	S	*	.			trans	21.2	117.5	164.9	-68.4	-35.4	0	0	0	121	D630 Y634 H635	D630-D632 PolarHBondContact O-N 3.19Å; D632-Y634 PolarHBondContact O-N 2.85Å; D632-H635 PolarHBondContact O-N 3.23Å; D632-H635 VanDerWaalsContact O-N 3.11Å
633	S	40.3	Very low	47.6	Very low	99 Å²	99	78 Å²	78	69%	0.692	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-12	179.4	59.3	0	0	0	0	116.5	S637	S633-S637 PolarHBondContact O-OG 2.64Å
634	Y	43.5	Very low	48.8	Very low	201 Å²	201	76.8 Å²	76.8	79%	0.788	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-28.3	178.1	-78.8	-87.8	0	0	0	113.1	D632	D632-Y634 PolarHBondContact O-N 2.85Å
635	H	45.6	Very low	50.2	Low	119 Å²	119	76.2 Å²	76.2	55%	0.551	41%	0.409	S	S	*	.	H	α-helix	trans	-84.5	-32.2	-177.7	-73.8	-71.3	0	0	0	113.1	D632 Y639	D632-H635 PolarHBondContact O-N 3.23Å; D632-H635 VanDerWaalsContact O-N 3.11Å; H635-Y639 WeakPolarHBondContact O-CD2 3.44Å
636	F	44.8	Very low	51.7	Low	52 Å²	52	74.6 Å²	74.6	23%	0.228	40%	0.397	C	S	.	.	H	α-helix	trans	-80.6	-20.2	-175.5	-133.7	-86.6	0	0	0	115.1	N640	F636-N640 PolarHBondContact O-ND2 2.71Å
637	S	48.9	Very low	53.5	Low	40 Å²	40	71 Å²	71	28%	0.28	37%	0.372	S	S	.	.	H	α-helix	trans	-87.2	-51	-179.5	52.1	0	0	0	0	112.1	S633 Y639 N640 Y641	S633-S637 PolarHBondContact O-OG 2.64Å; S637-Y639 PolarHBondContact O-N 3.36Å; S637-N640 PolarHBondContact O-N 3.37Å; S637-Y641 WeakPolarHBondContact O-CD2 3.33Å; S637-Y641 WeakPolarHBondContact O-CE2 3.28Å
638	G	49.3	Very low	55.1	Low	36 Å²	36	66.3 Å²	66.3	37%	0.371	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-41.6	-172	0	0	0	0	0	115.5	Y641	G638-Y641 WeakPolarHBondContact O-CD2 3.5Å
639	Y	53.5	Low	56.6	Low	54 Å²	54	63.3 Å²	63.3	21%	0.212	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.9	-169.6	-69.3	-89.1	0	0	0	114.1	A447 L620 L621 H635 S637 P642	A447-Y639 HydrophobicContact CB-CE1 4.34Å; L620-Y639 WeakPolarHBondContact O-CB 3.39Å; L621-Y639 WeakPolarHBondContact CD2-O 3.3Å; H635-Y639 WeakPolarHBondContact O-CD2 3.44Å; S637-Y639 PolarHBondContact O-N 3.36Å; Y639-P642 WeakPolarHBondContact O-CD 2.93Å
640	N	60	Low	58.1	Low	14 Å²	14	57.8 Å²	57.8	8%	0.075	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-17.6	174.6	-77.5	-64.2	0	0	0	113.3	F636 S637 A644 L1574	F636-N640 PolarHBondContact O-ND2 2.71Å; S637-N640 PolarHBondContact O-N 3.37Å; N640-A644 PolarHBondContact O-N 3.19Å; N640-A644 VanDerWaalsContact O-N 3.15Å; N640-L1574 HydrophobicContact CB-CD2 4.41Å
641	Y	64.1	Low	59.5	Low	106 Å²	106	53.6 Å²	53.6	42%	0.416	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-43	-178.3	-67.2	-64.3	0	0	0	114.6	S637 G638 Y643 A644 I645	S637-Y641 WeakPolarHBondContact O-CD2 3.33Å; S637-Y641 WeakPolarHBondContact O-CE2 3.28Å; G638-Y641 WeakPolarHBondContact O-CD2 3.5Å; Y641-Y643 PolarHBondContact O-N 2.53Å; Y641-A644 PolarHBondContact O-N 3Å; Y641-I645 WeakPolarHBondContact O-CB 3.49Å; Y641-I645 WeakPolarHBondContact O-CD1 3.18Å; Y641-I645 VanDerWaalsContact O-CG1 3.24Å; Y641-I645 WeakPolarHBondContact O-CG1 3.46Å; Y641-I645 PolarHBondContact O-N 3.09Å
642	P	65.9	Low	60.9	Low	9 Å²	9	53.3 Å²	53.3	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-58.5	-44.2	179.3	-26.2	36.3	0	0	0	113.1	L451 L591 M616 L620 Y639 I645 V646	L451-P642 HydrophobicContact CD1-CG 4.37Å; L591-P642 HydrophobicContact CD1-CB 4.36Å; M616-P642 HydrophobicContact CE-CB 3.72Å; L620-P642 HydrophobicContact CD2-CG 4.19Å; Y639-P642 WeakPolarHBondContact O-CD 2.93Å; P642-I645 PolarHBondContact O-N 3.19Å; P642-V646 WeakPolarHBondContact O-CG2 3.27Å; P642-V646 PolarHBondContact O-N 3.22Å
643	Y	70.9	Confident	62.2	Low	16 Å²	16	48.8 Å²	48.8	6%	0.063	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-46.2	174.3	172.1	-102.1	0	0	0	111.7	I614 M616 Y641 I645 V646 R647 S1575 S1602	I614-Y643 HydrophobicContact CB-CE2 4.13Å; I614-Y643 HydrophobicContact CD1-CE2 4.32Å; I614-Y643 HydrophobicContact CG2-CD2 4.17Å; I614-Y643 HydrophobicContact CG2-CE2 4.26Å; M616-Y643 HydrophobicContact CG-CD2 3.99Å; Y641-Y643 PolarHBondContact O-N 2.53Å; Y643-I645 PolarHBondContact O-N 3.33Å; Y643-V646 PolarHBondContact O-N 2.94Å; Y643-R647 VanDerWaalsContact O-CB 3.27Å; Y643-R647 WeakPolarHBondContact O-CB 3.49Å; Y643-R647 PolarHBondContact O-N 3.04Å; Y643-R647 PolarHBondContact OH-NH1 2.63Å; Y643-S1575 PolarHBondContact OH-OG 3.16Å; Y643-S1602 WeakPolarHBondContact OH-CB 3.3Å
644	A	70.2	Confident	63.6	Low	9 Å²	9	44.3 Å²	44.3	7%	0.074	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-41.1	178	0	0	0	0	0	112.3	N640 Y641 D648 L1574 M1578	N640-A644 PolarHBondContact O-N 3.19Å; N640-A644 VanDerWaalsContact O-N 3.15Å; Y641-A644 PolarHBondContact O-N 3Å; A644-D648 WeakPolarHBondContact O-CB 3.5Å; A644-D648 PolarHBondContact O-N 3.25Å; A644-L1574 HydrophobicContact CB-CD2 4.34Å; A644-M1578 HydrophobicContact CB-CE 4.3Å; A644-M1578 HydrophobicContact CB-SD 4.33Å
645	I	71.8	Confident	64.8	Low	91 Å²	91	35.9 Å²	35.9	47%	0.467	19%	0.188	S	C	.	.	H	α-helix	trans	-65.8	-51.1	178.2	-68.5	161.8	0	0	0	111.2	L451 Y641 P642 Y643 R647 D648 V649	L451-I645 HydrophobicContact CD1-CD1 4.31Å; Y641-I645 WeakPolarHBondContact O-CB 3.49Å; Y641-I645 WeakPolarHBondContact O-CD1 3.18Å; Y641-I645 VanDerWaalsContact O-CG1 3.24Å; Y641-I645 WeakPolarHBondContact O-CG1 3.46Å; Y641-I645 PolarHBondContact O-N 3.09Å; P642-I645 PolarHBondContact O-N 3.19Å; Y643-I645 PolarHBondContact O-N 3.33Å; I645-R647 PolarHBondContact O-N 3.31Å; I645-D648 PolarHBondContact O-N 3.26Å; I645-V649 VanDerWaalsContact O-CG2 3.32Å; I645-V649 WeakPolarHBondContact O-CG2 3.37Å; I645-V649 PolarHBondContact O-N 3.26Å; I645-V649 VanDerWaalsContact O-N 3.16Å
646	V	72.3	Confident	65.8	Low	12 Å²	12	34 Å²	34	7%	0.073	18%	0.179	C	C	.	.	H	α-helix	trans	-55.7	-44.1	178.4	167.5	0	0	0	0	110.1	L591 I614 P642 Y643 I650	L591-V646 HydrophobicContact CD2-CG2 4.15Å; L591-V646 HydrophobicContact CG-CG2 4.34Å; I614-V646 HydrophobicContact CD1-CG1 4.32Å; I614-V646 HydrophobicContact CG2-CG1 4.14Å; P642-V646 WeakPolarHBondContact O-CG2 3.27Å; P642-V646 PolarHBondContact O-N 3.22Å; Y643-V646 PolarHBondContact O-N 2.94Å; V646-I650 HydrophobicContact CG1-CD1 3.72Å; V646-I650 WeakPolarHBondContact O-CD1 3.27Å; V646-I650 VanDerWaalsContact O-CG1 3.27Å; V646-I650 WeakPolarHBondContact O-CG1 3.44Å; V646-I650 PolarHBondContact O-N 2.94Å; V646-I650 VanDerWaalsContact O-N 3.13Å
647	R	75.1	Confident	66.8	Low	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.6	-45.1	178.3	179.5	172.3	178.1	171.4	-11.8	113.9	I614 Y643 I645 V649 I650 D651 S1575 S1579	I614-R647 HydrophobicContact CD1-CB 3.9Å; I614-R647 HydrophobicContact CD1-CG 4.36Å; Y643-R647 VanDerWaalsContact O-CB 3.27Å; Y643-R647 WeakPolarHBondContact O-CB 3.49Å; Y643-R647 PolarHBondContact O-N 3.04Å; Y643-R647 PolarHBondContact OH-NH1 2.63Å; I645-R647 PolarHBondContact O-N 3.31Å; R647-V649 PolarHBondContact O-N 3.11Å; R647-I650 PolarHBondContact O-N 3.13Å; R647-I650 VanDerWaalsContact O-N 3.16Å; R647-D651 WeakPolarHBondContact CG-OD2 3.3Å; R647-D651 IonicContact NE-OD2 2.78Å; R647-D651 PolarHBondContact NE-OD2 2.7Å; R647-D651 WeakPolarHBondContact O-CB 3.5Å; R647-D651 PolarHBondContact O-N 3.48Å; R647-S1575 VanDerWaalsContact NH1-CA 3.33Å; R647-S1575 PolarHBondContact NH1-O 2.95Å; R647-S1575 VanDerWaalsContact NH1-O 3.09Å; R647-S1575 PolarHBondContact NH1-OG 2.84Å; R647-S1575 PolarHBondContact NH2-O 2.7Å; R647-S1579 VanDerWaalsContact NH2-CB 3.34Å
648	D	73	Confident	67.6	Low	34 Å²	34	34.1 Å²	34.1	18%	0.182	18%	0.177	C	C	.	.	H	α-helix	trans	-58	-41.2	-178.8	-149.5	69.8	0	0	0	110.3	A644 I645 E652 R667 M1578	A644-D648 WeakPolarHBondContact O-CB 3.5Å; A644-D648 PolarHBondContact O-N 3.25Å; I645-D648 PolarHBondContact O-N 3.26Å; D648-E652 WeakPolarHBondContact O-CB 3.25Å; D648-E652 PolarHBondContact O-N 3.3Å; D648-R667 PolarHBondContact O-NH2 3.27Å; D648-R667 IonicContact OD1-CZ 2.7Å; D648-R667 IonicContact OD1-NE 3.6Å; D648-R667 PolarHBondContact OD1-NE 2.82Å; D648-R667 IonicContact OD1-NH1 3.95Å; D648-R667 IonicContact OD1-NH2 3.7Å; D648-R667 PolarHBondContact OD1-NH2 3.49Å; D648-R667 IonicContact OD2-CZ 3.53Å; D648-R667 VanDerWaalsContact OD2-CZ 3.26Å; D648-R667 IonicContact OD2-NE 3.87Å; D648-R667 PolarHBondContact OD2-NE 2.81Å; D648-R667 IonicContact OD2-NH2 3.12Å; D648-R667 PolarHBondContact OD2-NH2 2.76Å; D648-M1578 HydrophobicContact CB-CE 4.45Å
649	V	72.2	Confident	68.2	Low	37 Å²	37	35 Å²	35	22%	0.224	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-42.9	176.2	173	0	0	0	0	112.6	L472 L475 I645 R647 A653	L472-V649 HydrophobicContact CD2-CG1 3.4Å; L475-V649 HydrophobicContact CD1-CG2 4.1Å; I645-V649 VanDerWaalsContact O-CG2 3.32Å; I645-V649 WeakPolarHBondContact O-CG2 3.37Å; I645-V649 PolarHBondContact O-N 3.26Å; I645-V649 VanDerWaalsContact O-N 3.16Å; R647-V649 PolarHBondContact O-N 3.11Å; V649-A653 PolarHBondContact O-N 3.33Å; V649-A653 VanDerWaalsContact O-N 3.11Å
650	I	73	Confident	68.5	Low	19 Å²	19	37.4 Å²	37.4	10%	0.097	20%	0.195	C	C	.	.	H	α-helix	trans	-66.7	-46.9	176.3	-67.5	160.6	0	0	0	110.8	V594 Y612 I614 V646 R647 E652 A653 I654	V594-I650 HydrophobicContact CG1-CD1 4.05Å; V594-I650 HydrophobicContact CG2-CD1 3.67Å; Y612-I650 HydrophobicContact CE1-CG2 4.11Å; Y612-I650 HydrophobicContact CE2-CG2 4.15Å; I614-I650 HydrophobicContact CD1-CD1 3.88Å; I614-I650 HydrophobicContact CG1-CD1 4.19Å; V646-I650 HydrophobicContact CG1-CD1 3.72Å; V646-I650 WeakPolarHBondContact O-CD1 3.27Å; V646-I650 VanDerWaalsContact O-CG1 3.27Å; V646-I650 WeakPolarHBondContact O-CG1 3.44Å; V646-I650 PolarHBondContact O-N 2.94Å; V646-I650 VanDerWaalsContact O-N 3.13Å; R647-I650 PolarHBondContact O-N 3.13Å; R647-I650 VanDerWaalsContact O-N 3.16Å; I650-E652 VanDerWaalsContact C-N 3.32Å; I650-E652 PolarHBondContact O-N 2.68Å; I650-A653 PolarHBondContact O-N 3.36Å; I650-I654 HydrophobicContact CG2-CD1 3.85Å; I650-I654 HydrophobicContact CG2-CG1 4.5Å; I650-I654 WeakPolarHBondContact O-CG1 3.48Å; I650-I654 PolarHBondContact O-N 2.79Å
651	D	72.1	Confident	68.1	Low	3 Å²	3	47.6 Å²	47.6	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-34.2	179	-79.7	-38.5	0	0	0	111.4	Y612 R647 M655 N1582	Y612-D651 PolarHBondContact OH-OD1 2.78Å; R647-D651 WeakPolarHBondContact CG-OD2 3.3Å; R647-D651 IonicContact NE-OD2 2.78Å; R647-D651 PolarHBondContact NE-OD2 2.7Å; R647-D651 WeakPolarHBondContact O-CB 3.5Å; R647-D651 PolarHBondContact O-N 3.48Å; D651-M655 WeakPolarHBondContact O-CG 3.35Å; D651-M655 PolarHBondContact O-N 2.93Å; D651-N1582 HydrophobicContact CB-CB 4.44Å; D651-N1582 WeakPolarHBondContact CB-ND2 3.25Å; D651-N1582 VanDerWaalsContact CG-ND2 3.3Å; D651-N1582 PolarHBondContact OD2-ND2 3.09Å
652	E	69.9	Low	67.6	Low	55 Å²	55	46.1 Å²	46.1	26%	0.257	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-46.5	171.2	-169.2	173.7	-176.9	0	0	111.3	D648 I650 I654 M655 E656 R664	D648-E652 WeakPolarHBondContact O-CB 3.25Å; D648-E652 PolarHBondContact O-N 3.3Å; I650-E652 VanDerWaalsContact C-N 3.32Å; I650-E652 PolarHBondContact O-N 2.68Å; E652-I654 VanDerWaalsContact C-N 3.35Å; E652-I654 PolarHBondContact O-N 2.99Å; E652-M655 PolarHBondContact O-N 3.05Å; E652-M655 VanDerWaalsContact O-N 3.16Å; E652-E656 PolarHBondContact O-N 2.86Å; E652-R664 IonicContact OE1-CZ 2.68Å; E652-R664 IonicContact OE1-NE 3.12Å; E652-R664 PolarHBondContact OE1-NE 3.13Å; E652-R664 IonicContact OE1-NH2 3.95Å
653	A	69.1	Low	67.2	Low	19 Å²	19	53 Å²	53	16%	0.157	28%	0.278	C	S	.	.	H	α-helix	trans	-62.2	-39.2	177.2	0	0	0	0	0	113	L472 V649 I650 E656 L657	L472-A653 HydrophobicContact CD1-CB 3.64Å; L472-A653 HydrophobicContact CD2-CB 4.08Å; L472-A653 HydrophobicContact CG-CB 3.95Å; V649-A653 PolarHBondContact O-N 3.33Å; V649-A653 VanDerWaalsContact O-N 3.11Å; I650-A653 PolarHBondContact O-N 3.36Å; A653-E656 PolarHBondContact O-N 2.99Å; A653-L657 WeakPolarHBondContact O-CB 3.44Å; A653-L657 VanDerWaalsContact O-CG 3.29Å; A653-L657 WeakPolarHBondContact O-CG 3.4Å; A653-L657 PolarHBondContact O-N 2.9Å
654	I	69.9	Low	66.7	Low	4 Å²	4	57.6 Å²	57.6	2%	0.021	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-39.8	174.5	-65.1	168.3	0	0	0	110.7	W610 Y612 I650 E652 L657 H658 V1598	W610-I654 HydrophobicContact CG-CG2 4.48Å; Y612-I654 HydrophobicContact CD1-CD1 3.95Å; Y612-I654 HydrophobicContact CE1-CD1 3.59Å; I650-I654 HydrophobicContact CG2-CD1 3.85Å; I650-I654 HydrophobicContact CG2-CG1 4.5Å; I650-I654 WeakPolarHBondContact O-CG1 3.48Å; I650-I654 PolarHBondContact O-N 2.79Å; E652-I654 VanDerWaalsContact C-N 3.35Å; E652-I654 PolarHBondContact O-N 2.99Å; I654-L657 PolarHBondContact O-N 3.17Å; I654-H658 PolarHBondContact O-N 2.92Å; I654-H658 VanDerWaalsContact O-N 3.16Å; I654-H658 PolarHBondContact O-ND1 3.33Å; I654-V1598 HydrophobicContact CG2-CG2 3.92Å
655	M	68.5	Low	66.6	Low	24 Å²	24	58.7 Å²	58.7	12%	0.118	30%	0.299	C	S	.	.	H	α-helix	trans	-65	-38.6	174.2	-74.4	-172.9	-65.3	0	0	113	D651 E652 H658 R660 R667 M1585 L1586	D651-M655 WeakPolarHBondContact O-CG 3.35Å; D651-M655 PolarHBondContact O-N 2.93Å; E652-M655 PolarHBondContact O-N 3.05Å; E652-M655 VanDerWaalsContact O-N 3.16Å; M655-H658 PolarHBondContact O-N 3.17Å; M655-R660 PolarHBondContact O-N 2.97Å; M655-R667 VanDerWaalsContact CE-NH1 3.3Å; M655-M1585 HydrophobicContact SD-CB 3.94Å; M655-M1585 HydrophobicContact SD-SD 4.37Å; M655-L1586 HydrophobicContact CB-CD2 4.42Å; M655-L1586 HydrophobicContact CG-CD2 3.68Å; M655-L1586 HydrophobicContact CG-CG 3.89Å
656	E	66.5	Low	66.4	Low	80 Å²	80	55 Å²	55	37%	0.374	28%	0.284	S	S	.	.	H	α-helix	trans	-69.3	-34	174.6	-72.4	-164	165.2	0	0	112.9	E652 A653 H658 G659	E652-E656 PolarHBondContact O-N 2.86Å; A653-E656 PolarHBondContact O-N 2.99Å; E656-H658 VanDerWaalsContact C-N 3.34Å; E656-G659 PolarHBondContact O-N 3.25Å
657	L	65.8	Low	66.6	Low	38 Å²	38	55.8 Å²	55.8	20%	0.199	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-40.1	172.9	-79.9	166.9	0	0	0	111.9	K468 L606 W610 A653 I654 G659	K468-L657 HydrophobicContact CB-CD2 4.09Å; K468-L657 HydrophobicContact CD-CD2 3.75Å; K468-L657 HydrophobicContact CD-CG 4.47Å; K468-L657 HydrophobicContact CG-CD2 3.64Å; L606-L657 HydrophobicContact CD2-CD2 4.45Å; W610-L657 HydrophobicContact CH2-CD1 4.3Å; A653-L657 WeakPolarHBondContact O-CB 3.44Å; A653-L657 VanDerWaalsContact O-CG 3.29Å; A653-L657 WeakPolarHBondContact O-CG 3.4Å; A653-L657 PolarHBondContact O-N 2.9Å; I654-L657 PolarHBondContact O-N 3.17Å; L657-G659 PolarHBondContact O-N 3.39Å; L657-G659 VanDerWaalsContact O-N 3.13Å
658	H	66.4	Low	66.6	Low	56 Å²	56	60.9 Å²	60.9	26%	0.259	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	12.8	175.7	-68.7	88.2	0	0	0	114.1	W610 I654 M655 E656 L1586	W610-H658 AromaticContact CD1-CE1 3.65Å; W610-H658 AromaticContact NE1-CE1 3.34Å; W610-H658 PolarHBondContact NE1-CE1 3.44Å; W610-H658 VanDerWaalsContact NE1-CE1 3.34Å; W610-H658 AromaticContact NE1-NE2 3.67Å; I654-H658 PolarHBondContact O-N 2.92Å; I654-H658 VanDerWaalsContact O-N 3.16Å; I654-H658 PolarHBondContact O-ND1 3.33Å; M655-H658 PolarHBondContact O-N 3.17Å; E656-H658 VanDerWaalsContact C-N 3.34Å; H658-L1586 HydrophobicContact CB-CD2 4.41Å
659	G	61.6	Low	66.7	Low	55 Å²	55	61 Å²	61	57%	0.567	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.6	8.7	166.3	0	0	0	0	0	116.3	E656 L657 R661	E656-G659 PolarHBondContact O-N 3.25Å; L657-G659 PolarHBondContact O-N 3.39Å; L657-G659 VanDerWaalsContact O-N 3.13Å; G659-R661 VanDerWaalsContact C-N 3.27Å; G659-R661 PolarHBondContact O-N 2.88Å
660	R	59.3	Low	66.8	Low	105 Å²	105	62.9 Å²	62.9	40%	0.396	32%	0.316	S	S	.	.			trans	-74.9	73.3	173.9	-83.8	-162.9	170.5	173.9	8.2	113.3	M655 M1585	M655-R660 PolarHBondContact O-N 2.97Å; R660-M1585 PolarHBondContact NH1-O 2.97Å; R660-M1585 PolarHBondContact NH2-O 2.97Å
661	R	51.9	Low	66.6	Low	228 Å²	228	64.1 Å²	64.1	86%	0.86	33%	0.326	S	S	*	.			trans	-84.3	110.3	163.7	-69.1	177.5	171.8	168.9	-2.2	109.8	G659	G659-R661 VanDerWaalsContact C-N 3.27Å; G659-R661 PolarHBondContact O-N 2.88Å
662	G	53.2	Low	66.4	Low	74 Å²	74	65 Å²	65	76%	0.763	33%	0.329	S	S	*	.	S	Bend	trans	165.2	-31.8	163.3	0	0	0	0	0	120.7
663	K	59	Low	66	Low	155 Å²	155	64.1 Å²	64.1	67%	0.674	33%	0.328	S	S	*	.			trans	-149.4	124.5	-178.5	-67.8	-175	-177	178.1	0	111.4	A1559	K663-A1559 HydrophobicContact CB-CB 4.12Å; K663-A1559 HydrophobicContact CD-CB 4.3Å; K663-A1559 HydrophobicContact CG-CB 4.33Å
664	R	60.8	Low	65.1	Low	111 Å²	111	69 Å²	69	42%	0.419	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-79.9	126.9	168.6	-81.6	-169.5	165.2	155	10.3	110.6	E652 A1559	E652-R664 IonicContact OE1-CZ 2.68Å; E652-R664 IonicContact OE1-NE 3.12Å; E652-R664 PolarHBondContact OE1-NE 3.13Å; E652-R664 IonicContact OE1-NH2 3.95Å; R664-A1559 PolarHBondContact O-N 3.13Å
665	I	67.4	Low	64.1	Low	32 Å²	32	75.1 Å²	75.1	16%	0.164	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.2	174.7	-54.7	-179.6	0	0	0	107.6	R667 S1560 V1562 M1585	I665-R667 PolarHBondContact O-N 2.76Å; I665-S1560 CarbonylContact C-O 3.56Å; I665-S1560 WeakPolarHBondContact CA-O 3.36Å; I665-V1562 HydrophobicContact CG2-CB 4.5Å; I665-V1562 HydrophobicContact CG2-CG2 3.78Å; I665-M1585 HydrophobicContact CB-CE 4.42Å; I665-M1585 HydrophobicContact CD1-CE 4.33Å; I665-M1585 HydrophobicContact CG2-CE 3.81Å
666	G	68.2	Low	63.1	Low	14 Å²	14	77.4 Å²	77.4	14%	0.144	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	116.3	177.7	0	0	0	0	0	110.7	V1558 S1560 N1561 V1562	G666-V1558 VanDerWaalsContact N-CG1 3.28Å; G666-S1560 PolarHBondContact N-O 3.49Å; G666-N1561 WeakPolarHBondContact O-CA 3.4Å; G666-V1562 PolarHBondContact O-N 3.11Å
667	R	75.5	Confident	62.1	Low	29 Å²	29	78.6 Å²	78.6	11%	0.109	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	114.1	175.3	-68.4	174.2	-67.3	-171.6	1	109.4	D648 M655 I665 N1582 M1585	D648-R667 PolarHBondContact O-NH2 3.27Å; D648-R667 IonicContact OD1-CZ 2.7Å; D648-R667 IonicContact OD1-NE 3.6Å; D648-R667 PolarHBondContact OD1-NE 2.82Å; D648-R667 IonicContact OD1-NH1 3.95Å; D648-R667 IonicContact OD1-NH2 3.7Å; D648-R667 PolarHBondContact OD1-NH2 3.49Å; D648-R667 IonicContact OD2-CZ 3.53Å; D648-R667 VanDerWaalsContact OD2-CZ 3.26Å; D648-R667 IonicContact OD2-NE 3.87Å; D648-R667 PolarHBondContact OD2-NE 2.81Å; D648-R667 IonicContact OD2-NH2 3.12Å; D648-R667 PolarHBondContact OD2-NH2 2.76Å; M655-R667 VanDerWaalsContact CE-NH1 3.3Å; I665-R667 PolarHBondContact O-N 2.76Å; R667-N1582 WeakPolarHBondContact CD-OD1 3.2Å; R667-N1582 PolarHBondContact NH1-ND2 2.84Å; R667-N1582 PolarHBondContact NH1-OD1 3.39Å; R667-M1585 HydrophobicContact CG-CE 4.17Å
668	F	75.2	Confident	60.9	Low	107 Å²	107	81.1 Å²	81.1	47%	0.469	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	138	178	-70	-89.6	0	0	0	110.1	N1561 V1562 K1563 I1564	F668-N1561 HydrophobicContact CD2-CB 4.26Å; F668-N1561 HydrophobicContact CE2-CB 4.1Å; F668-V1562 PolarHBondContact N-O 3.26Å; F668-K1563 HydrophobicContact CB-CG 4.21Å; F668-K1563 CarbonylContact O-C 3.54Å; F668-K1563 WeakPolarHBondContact O-CA 3.26Å; F668-I1564 PolarHBondContact O-N 2.84Å
669	V	75	Confident	59.5	Low	35 Å²	35	88.6 Å²	88.6	21%	0.212	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.3	-177.6	167.5	0	0	0	0	109.4	Y1566 L1574 M1578	V669-Y1566 HydrophobicContact CG1-CD1 3.91Å; V669-Y1566 HydrophobicContact CG1-CE1 3.3Å; V669-L1574 HydrophobicContact CB-CD1 4.33Å; V669-L1574 HydrophobicContact CG1-CD1 3.43Å; V669-L1574 VanDerWaalsContact CG1-CD1 3.43Å; V669-L1574 HydrophobicContact CG1-CD2 4.01Å; V669-L1574 HydrophobicContact CG1-CG 4.38Å; V669-L1574 HydrophobicContact CG2-CD1 3.91Å; V669-M1578 HydrophobicContact CG2-CE 3.94Å
670	Q	73.9	Confident	58.5	Low	77 Å²	77	92.7 Å²	92.7	36%	0.36	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	116.7	-172.6	-178.1	60.7	53	0	0	111.3	I1564 W1565 Y1566	Q670-I1564 PolarHBondContact N-O 3.31Å; Q670-W1565 HydrophobicContact CB-CD2 4.23Å; Q670-W1565 HydrophobicContact CB-CE3 4.21Å; Q670-W1565 HydrophobicContact CG-CD2 3.9Å; Q670-W1565 HydrophobicContact CG-CE3 3.51Å; Q670-W1565 HydrophobicContact CG-CH2 3.79Å; Q670-W1565 HydrophobicContact CG-CZ2 4.12Å; Q670-W1565 HydrophobicContact CG-CZ3 3.44Å; Q670-W1565 VanDerWaalsContact CG-CZ3 3.44Å; Q670-W1565 VanDerWaalsContact O-CA 3.27Å; Q670-W1565 WeakPolarHBondContact O-CA 3.35Å; Q670-Y1566 VanDerWaalsContact O-CD1 3.24Å; Q670-Y1566 WeakPolarHBondContact O-CD1 3.36Å; Q670-Y1566 PolarHBondContact O-N 2.9Å; Q670-Y1566 VanDerWaalsContact O-N 3.16Å
671	P	69.5	Low	57.8	Low	46 Å²	46	89.3 Å²	89.3	30%	0.299	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	148.4	173.3	28.7	-34.2	0	0	0	111.2	Y1566	P671-Y1566 HydrophobicContact CB-CE1 4.02Å; P671-Y1566 HydrophobicContact CB-CE2 4.43Å; P671-Y1566 VanDerWaalsContact N-CE1 3.33Å
672	F	67.3	Low	57.4	Low	20 Å²	20	81 Å²	81	9%	0.088	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-58.2	141	171.1	-75.7	-38.1	0	0	0	112.6	R674 F1408 L1482 W1493 W1565 Y1566 P1567	F672-R674 PolarHBondContact O-N 2.94Å; F672-F1408 AromaticContact CE1-CE1 3.58Å; F672-F1408 HydrophobicContact CE1-CE1 3.58Å; F672-F1408 HydrophobicContact CE1-CZ 4.21Å; F672-F1408 AromaticContact CZ-CE1 3.91Å; F672-F1408 HydrophobicContact CZ-CE1 3.91Å; F672-L1482 HydrophobicContact CD1-CD1 3.92Å; F672-L1482 HydrophobicContact CD1-CD2 4.24Å; F672-L1482 HydrophobicContact CE1-CD1 3.97Å; F672-L1482 HydrophobicContact CE1-CD2 3.73Å; F672-L1482 HydrophobicContact CE1-CG 4.42Å; F672-L1482 HydrophobicContact CZ-CD2 4.4Å; F672-W1493 HydrophobicContact CE2-CB 3.79Å; F672-W1493 HydrophobicContact CZ-CB 4.02Å; F672-W1565 HydrophobicContact CD1-CB 4.21Å; F672-W1565 AromaticContact CD1-CE3 3.97Å; F672-W1565 HydrophobicContact CD1-CE3 3.97Å; F672-W1565 HydrophobicContact CE1-CB 3.73Å; F672-W1565 HydrophobicContact CE1-CE3 4.44Å; F672-W1565 HydrophobicContact CZ-CB 4.43Å; F672-Y1566 PolarHBondContact N-O 3.45Å; F672-P1567 VanDerWaalsContact CD2-CA 3.49Å; F672-P1567 HydrophobicContact CD2-CB 3.79Å; F672-P1567 HydrophobicContact CE2-CB 4.05Å; F672-P1567 HydrophobicContact CE2-CG 4.37Å
673	P	60.9	Low	57	Low	37 Å²	37	81.8 Å²	81.8	24%	0.24	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-61.3	130.4	175.6	26.9	-34.2	0	0	0	110.2	N1479 L1482	P673-N1479 HydrophobicContact CG-CB 4.26Å; P673-L1482 HydrophobicContact CG-CB 4.28Å
674	R	52	Low	56.6	Low	123 Å²	123	79.6 Å²	79.6	46%	0.464	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-100.8	145.6	170.7	-66.9	-171.1	-178.5	-157.2	7	109.2	E629 F672 G1568	E629-R674 PolarHBondContact O-NH1 3.12Å; F672-R674 PolarHBondContact O-N 2.94Å; R674-G1568 PolarHBondContact NH2-O 3.37Å
675	K	48.9	Very low	56.1	Low	131 Å²	131	76.2 Å²	76.2	57%	0.57	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-61.2	141.3	174.9	-173.7	171.9	-175.2	-176.2	0	109.7	I677 Y1483	K675-I677 HydrophobicContact CB-CG1 4.27Å; K675-I677 PolarHBondContact O-N 3.21Å; K675-Y1483 HydrophobicContact CB-CE2 3.95Å; K675-Y1483 HydrophobicContact CD-CE2 4.2Å; K675-Y1483 HydrophobicContact CG-CE2 3.92Å
676	A	47.4	Very low	55.5	Low	72 Å²	72	77 Å²	77	60%	0.595	38%	0.377	S	S	*	.			trans	-66.3	87	158.1	0	0	0	0	0	107.9	V678	A676-V678 PolarHBondContact O-N 2.87Å; A676-V678 VanDerWaalsContact O-N 3.11Å
677	I	44	Very low	55	Low	105 Å²	105	78.5 Å²	78.5	54%	0.538	38%	0.38	S	S	.	.			trans	-66.7	110.9	174.6	-64.5	173.2	0	0	0	105.9	K675 R679	K675-I677 HydrophobicContact CB-CG1 4.27Å; K675-I677 PolarHBondContact O-N 3.21Å; I677-R679 PolarHBondContact O-N 2.83Å
678	V	41.3	Very low	54.5	Low	91 Å²	91	81.4 Å²	81.4	55%	0.552	40%	0.395	S	S	*	.			trans	-47	127.3	163.8	174.4	0	0	0	0	106.4	A676 Y680	A676-V678 PolarHBondContact O-N 2.87Å; A676-V678 VanDerWaalsContact O-N 3.11Å; V678-Y680 HydrophobicContact CB-CD2 4.31Å; V678-Y680 HydrophobicContact CB-CE2 3.95Å; V678-Y680 HydrophobicContact CG1-CD2 4.44Å; V678-Y680 HydrophobicContact CG1-CE2 3.96Å; V678-Y680 WeakPolarHBondContact O-CD2 3.45Å; V678-Y680 PolarHBondContact O-N 2.93Å
679	R	36.9	Very low	54.2	Low	214 Å²	214	77.5 Å²	77.5	81%	0.808	38%	0.379	S	S	*	.			trans	-61	72.9	-171.4	-72.9	-179.2	172.5	-179.1	-4.5	113	I677	I677-R679 PolarHBondContact O-N 2.83Å
680	Y	41.1	Very low	54.3	Low	140 Å²	140	75.9 Å²	75.9	55%	0.549	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-74.1	147.1	155.8	-65.9	-74.1	0	0	0	107.6	V678	V678-Y680 HydrophobicContact CB-CD2 4.31Å; V678-Y680 HydrophobicContact CB-CE2 3.95Å; V678-Y680 HydrophobicContact CG1-CD2 4.44Å; V678-Y680 HydrophobicContact CG1-CE2 3.96Å; V678-Y680 WeakPolarHBondContact O-CD2 3.45Å; V678-Y680 PolarHBondContact O-N 2.93Å
681	P	43.9	Very low	54.4	Low	34 Å²	34	76.4 Å²	76.4	22%	0.221	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-54.5	156.4	168.9	22	-29.6	0	0	0	110.4	P685	P681-P685 HydrophobicContact CB-CG 4.29Å
682	P	45	Very low	54.6	Low	55 Å²	55	75.7 Å²	75.7	36%	0.357	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-47.4	163.4	172.8	14.3	-28	0	0	0	111.9	D630 Y684 P685	D630-P682 WeakPolarHBondContact OD2-CA 3.17Å; D630-P682 VanDerWaalsContact OD2-CB 3.25Å; D630-P682 WeakPolarHBondContact OD2-CB 3.46Å; P682-Y684 HydrophobicContact CB-CD2 4.32Å; P682-Y684 PolarHBondContact O-N 2.92Å; P682-P685 HydrophobicContact CG-CG 4.28Å; P682-P685 WeakPolarHBondContact O-CD 3.43Å
683	F	44.4	Very low	55	Low	90 Å²	90	75.3 Å²	75.3	40%	0.395	36%	0.363	S	S	.	.	H	α-helix	trans	-57.5	-26.6	178.5	-169.3	-122.8	0	0	0	112.5	M687	F683-M687 HydrophobicContact CD1-CE 4.13Å; F683-M687 HydrophobicContact CD1-CG 3.72Å; F683-M687 HydrophobicContact CD1-SD 4.15Å; F683-M687 HydrophobicContact CE1-CE 3.55Å; F683-M687 HydrophobicContact CE1-CG 3.69Å; F683-M687 HydrophobicContact CE1-SD 3.49Å; F683-M687 WeakPolarHBondContact CE1-SD 3.4Å; F683-M687 HydrophobicContact CE2-CG 4.47Å; F683-M687 HydrophobicContact CG-CG 4.14Å; F683-M687 HydrophobicContact CZ-CE 4.3Å; F683-M687 HydrophobicContact CZ-CG 4.08Å; F683-M687 HydrophobicContact CZ-SD 3.69Å; F683-M687 WeakPolarHBondContact O-CG 3.37Å; F683-M687 PolarHBondContact O-N 3.46Å
684	Y	50.6	Low	56	Low	109 Å²	109	74.1 Å²	74.1	43%	0.427	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-51.5	-173.3	-67.9	-80.5	0	0	0	116.9	P682 L686 M687 H688	P682-Y684 HydrophobicContact CB-CD2 4.32Å; P682-Y684 PolarHBondContact O-N 2.92Å; Y684-L686 VanDerWaalsContact C-N 3.3Å; Y684-L686 PolarHBondContact O-N 2.76Å; Y684-M687 WeakPolarHBondContact O-CB 3.27Å; Y684-M687 PolarHBondContact O-N 2.97Å; Y684-M687 VanDerWaalsContact O-N 3.11Å; Y684-H688 PolarHBondContact O-CD2 3.19Å; Y684-H688 PolarHBondContact O-N 3.38Å; Y684-H688 VanDerWaalsContact O-N 3.11Å
685	P	49.6	Very low	57.3	Low	39 Å²	39	71.3 Å²	71.3	25%	0.253	35%	0.349	S	S	.	.	H	α-helix	trans	-65.1	-31.8	-175.8	-24.9	37.9	0	0	0	113.5	P681 P682 H688	P681-P685 HydrophobicContact CB-CG 4.29Å; P682-P685 HydrophobicContact CG-CG 4.28Å; P682-P685 WeakPolarHBondContact O-CD 3.43Å; P685-H688 PolarHBondContact O-N 3.42Å
686	L	54.1	Low	58.8	Low	50 Å²	50	65.8 Å²	65.8	26%	0.262	33%	0.325	S	S	.	.	H	α-helix	trans	-72.5	-36.9	173.7	-76.5	162.8	0	0	0	112	Y684 H688 L689 V758	Y684-L686 VanDerWaalsContact C-N 3.3Å; Y684-L686 PolarHBondContact O-N 2.76Å; L686-H688 PolarHBondContact O-N 3.34Å; L686-L689 VanDerWaalsContact O-CB 3.25Å; L686-L689 WeakPolarHBondContact O-CB 3.4Å; L686-L689 PolarHBondContact O-N 3.03Å; L686-L689 VanDerWaalsContact O-N 3.09Å; L686-V758 HydrophobicContact CD2-CG1 4.06Å
687	M	59.3	Low	60.6	Low	44 Å²	44	62.6 Å²	62.6	22%	0.217	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-21.8	171.6	-71.6	-88.2	-82.6	0	0	112.8	F683 Y684 P690 L814 V842	F683-M687 HydrophobicContact CD1-CE 4.13Å; F683-M687 HydrophobicContact CD1-CG 3.72Å; F683-M687 HydrophobicContact CD1-SD 4.15Å; F683-M687 HydrophobicContact CE1-CE 3.55Å; F683-M687 HydrophobicContact CE1-CG 3.69Å; F683-M687 HydrophobicContact CE1-SD 3.49Å; F683-M687 WeakPolarHBondContact CE1-SD 3.4Å; F683-M687 HydrophobicContact CE2-CG 4.47Å; F683-M687 HydrophobicContact CG-CG 4.14Å; F683-M687 HydrophobicContact CZ-CE 4.3Å; F683-M687 HydrophobicContact CZ-CG 4.08Å; F683-M687 HydrophobicContact CZ-SD 3.69Å; F683-M687 WeakPolarHBondContact O-CG 3.37Å; F683-M687 PolarHBondContact O-N 3.46Å; Y684-M687 WeakPolarHBondContact O-CB 3.27Å; Y684-M687 PolarHBondContact O-N 2.97Å; Y684-M687 VanDerWaalsContact O-N 3.11Å; M687-P690 VanDerWaalsContact O-CD 3.24Å; M687-P690 WeakPolarHBondContact O-CD 3.44Å; M687-L814 HydrophobicContact CE-CD1 4.26Å; M687-L814 HydrophobicContact CE-CD2 3.94Å; M687-V842 HydrophobicContact SD-CG1 4.28Å
688	H	64.2	Low	62.6	Low	91 Å²	91	60.5 Å²	60.5	42%	0.421	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-4.8	173.7	-62.1	-44.8	0	0	0	114.7	Y684 P685 L686 P690 F691	Y684-H688 PolarHBondContact O-CD2 3.19Å; Y684-H688 PolarHBondContact O-N 3.38Å; Y684-H688 VanDerWaalsContact O-N 3.11Å; P685-H688 PolarHBondContact O-N 3.42Å; L686-H688 PolarHBondContact O-N 3.34Å; H688-P690 VanDerWaalsContact C-N 3.34Å; H688-F691 VanDerWaalsContact O-CB 3.24Å; H688-F691 WeakPolarHBondContact O-CB 3.49Å; H688-F691 PolarHBondContact O-N 2.76Å
689	L	69.7	Low	64.6	Low	25 Å²	25	56.9 Å²	56.9	13%	0.131	27%	0.265	C	S	.	.	H	α-helix	trans	-55.6	-36.8	175.3	-163	72.3	0	0	0	114.3	L686 F691 V692 F693 L753 V758 T845	L686-L689 VanDerWaalsContact O-CB 3.25Å; L686-L689 WeakPolarHBondContact O-CB 3.4Å; L686-L689 PolarHBondContact O-N 3.03Å; L686-L689 VanDerWaalsContact O-N 3.09Å; L689-F691 PolarHBondContact O-N 2.97Å; L689-V692 PolarHBondContact O-N 2.84Å; L689-V692 VanDerWaalsContact O-N 3.17Å; L689-F693 HydrophobicContact CD1-CE2 4.48Å; L689-F693 HydrophobicContact CD1-CZ 4.2Å; L689-F693 HydrophobicContact CD2-CE2 3.61Å; L689-F693 HydrophobicContact CD2-CZ 3.74Å; L689-F693 HydrophobicContact CG-CD2 4.25Å; L689-F693 HydrophobicContact CG-CE2 3.57Å; L689-F693 HydrophobicContact CG-CZ 3.74Å; L689-F693 WeakPolarHBondContact O-CD2 3.44Å; L689-F693 PolarHBondContact O-N 3Å; L689-L753 HydrophobicContact CD1-CD2 4.42Å; L689-V758 HydrophobicContact CD2-CG1 4.14Å; L689-T845 HydrophobicContact CD2-CG2 3.64Å
690	P	75.8	Confident	66.9	Low	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.4	-30.1	172	-23	33.5	0	0	0	114.3	M687 H688 T694 F810 N838 C841 V842	M687-P690 VanDerWaalsContact O-CD 3.24Å; M687-P690 WeakPolarHBondContact O-CD 3.44Å; H688-P690 VanDerWaalsContact C-N 3.34Å; P690-T694 WeakPolarHBondContact O-CB 3.48Å; P690-T694 WeakPolarHBondContact O-CG2 3.39Å; P690-T694 PolarHBondContact O-N 2.99Å; P690-T694 PolarHBondContact O-OG1 2.75Å; P690-F810 HydrophobicContact CB-CE1 4.34Å; P690-F810 HydrophobicContact CG-CZ 4.47Å; P690-N838 HydrophobicContact CB-CB 4.2Å; P690-C841 HydrophobicContact CB-CB 4.48Å; P690-C841 HydrophobicContact CG-CB 4.12Å; P690-V842 HydrophobicContact CG-CG2 3.91Å
691	F	75.8	Confident	69.2	Low	88 Å²	88	40.5 Å²	40.5	39%	0.386	20%	0.203	S	C	.	.	H	α-helix	trans	-64.8	-46	174.8	178.3	-117.4	0	0	0	111.1	H688 L689 F693 T694 L695 Y807	H688-F691 VanDerWaalsContact O-CB 3.24Å; H688-F691 WeakPolarHBondContact O-CB 3.49Å; H688-F691 PolarHBondContact O-N 2.76Å; L689-F691 PolarHBondContact O-N 2.97Å; F691-F693 PolarHBondContact O-N 2.79Å; F691-T694 WeakPolarHBondContact CA-OG1 3.33Å; F691-T694 PolarHBondContact O-N 2.84Å; F691-T694 PolarHBondContact O-OG1 3.12Å; F691-L695 HydrophobicContact CD1-CD1 4.05Å; F691-L695 HydrophobicContact CD2-CG 4.47Å; F691-L695 HydrophobicContact CE1-CD1 3.62Å; F691-L695 HydrophobicContact CE1-CG 4.46Å; F691-L695 HydrophobicContact CE2-CD1 4.19Å; F691-L695 HydrophobicContact CE2-CD2 4.33Å; F691-L695 HydrophobicContact CE2-CG 4.2Å; F691-L695 HydrophobicContact CZ-CD1 3.7Å; F691-L695 HydrophobicContact CZ-CD2 4.36Å; F691-L695 HydrophobicContact CZ-CG 4.2Å; F691-L695 WeakPolarHBondContact O-CG 3.44Å; F691-L695 PolarHBondContact O-N 3.42Å; F691-Y807 HydrophobicContact CB-CE2 3.88Å; F691-Y807 HydrophobicContact CD2-CD1 4.15Å; F691-Y807 HydrophobicContact CD2-CD2 4.41Å; F691-Y807 AromaticContact CD2-CE1 3.59Å; F691-Y807 HydrophobicContact CD2-CE1 3.59Å; F691-Y807 AromaticContact CD2-CE2 3.92Å; F691-Y807 HydrophobicContact CD2-CE2 3.92Å; F691-Y807 AromaticContact CD2-CZ 3.49Å; F691-Y807 VanDerWaalsContact CD2-CZ 3.49Å; F691-Y807 HydrophobicContact CE2-CE1 4.08Å; F691-Y807 HydrophobicContact CG-CE2 4.39Å
692	V	73.7	Confident	71.1	Confident	32 Å²	32	40.3 Å²	40.3	19%	0.194	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-48.9	177.2	-179.2	0	0	0	0	110.2	C92 L689 T694 L695 F696	C92-V692 HydrophobicContact CB-CG1 4.47Å; L689-V692 PolarHBondContact O-N 2.84Å; L689-V692 VanDerWaalsContact O-N 3.17Å; V692-T694 PolarHBondContact O-N 3.35Å; V692-L695 WeakPolarHBondContact O-CB 3.44Å; V692-L695 PolarHBondContact O-N 3.03Å; V692-F696 HydrophobicContact CG1-CD2 4.13Å; V692-F696 HydrophobicContact CG1-CE2 3.87Å; V692-F696 VanDerWaalsContact O-CD2 3.3Å; V692-F696 WeakPolarHBondContact O-CD2 3.35Å; V692-F696 PolarHBondContact O-N 3.4Å
693	F	77.1	Confident	73	Confident	12 Å²	12	40.1 Å²	40.1	5%	0.053	19%	0.193	C	C	.	.	H	α-helix	trans	-64.8	-39.9	179.2	-62	-36.9	0	0	0	113.8	L689 F691 L695 F696 F697 L749 L753 W837 C841	L689-F693 HydrophobicContact CD1-CE2 4.48Å; L689-F693 HydrophobicContact CD1-CZ 4.2Å; L689-F693 HydrophobicContact CD2-CE2 3.61Å; L689-F693 HydrophobicContact CD2-CZ 3.74Å; L689-F693 HydrophobicContact CG-CD2 4.25Å; L689-F693 HydrophobicContact CG-CE2 3.57Å; L689-F693 HydrophobicContact CG-CZ 3.74Å; L689-F693 WeakPolarHBondContact O-CD2 3.44Å; L689-F693 PolarHBondContact O-N 3Å; F691-F693 PolarHBondContact O-N 2.79Å; F693-L695 VanDerWaalsContact C-N 3.31Å; F693-L695 PolarHBondContact O-N 3.48Å; F693-F696 PolarHBondContact O-N 2.9Å; F693-F697 WeakPolarHBondContact O-CD2 3.38Å; F693-F697 PolarHBondContact O-N 3.16Å; F693-F697 VanDerWaalsContact O-N 3.11Å; F693-L749 HydrophobicContact CD1-CD1 3.99Å; F693-L749 HydrophobicContact CD1-CD2 3.66Å; F693-L749 HydrophobicContact CD1-CG 4.2Å; F693-L749 HydrophobicContact CE1-CD1 3.8Å; F693-L749 HydrophobicContact CE1-CD2 3.77Å; F693-L749 HydrophobicContact CE1-CG 3.9Å; F693-L753 HydrophobicContact CE1-CD1 3.78Å; F693-L753 HydrophobicContact CE1-CD2 4.14Å; F693-L753 HydrophobicContact CE1-CG 4.43Å; F693-L753 HydrophobicContact CZ-CD1 3.67Å; F693-L753 HydrophobicContact CZ-CD2 3.87Å; F693-L753 HydrophobicContact CZ-CG 4.39Å; F693-W837 HydrophobicContact CB-CZ2 3.75Å; F693-W837 AromaticContact CD2-CZ2 3.74Å; F693-W837 HydrophobicContact CD2-CZ2 3.74Å; F693-W837 AromaticContact CG-CZ2 3.87Å; F693-W837 HydrophobicContact CG-CZ2 3.87Å; F693-C841 VanDerWaalsContact CD2-SG 3.51Å; F693-C841 WeakPolarHBondContact CE2-SG 3.37Å
694	T	81	Confident	75	Confident	12 Å²	12	36 Å²	36	7%	0.074	18%	0.175	C	C	.	.	H	α-helix	trans	-66.7	-32.3	176.8	48.3	0	0	0	0	112.4	P690 F691 V692 F697 F698 N838	P690-T694 WeakPolarHBondContact O-CB 3.48Å; P690-T694 WeakPolarHBondContact O-CG2 3.39Å; P690-T694 PolarHBondContact O-N 2.99Å; P690-T694 PolarHBondContact O-OG1 2.75Å; F691-T694 WeakPolarHBondContact CA-OG1 3.33Å; F691-T694 PolarHBondContact O-N 2.84Å; F691-T694 PolarHBondContact O-OG1 3.12Å; V692-T694 PolarHBondContact O-N 3.35Å; T694-F697 PolarHBondContact O-N 3.11Å; T694-F698 VanDerWaalsContact O-CB 3.26Å; T694-F698 WeakPolarHBondContact O-CB 3.23Å; T694-F698 PolarHBondContact O-N 3.41Å; T694-N838 WeakPolarHBondContact CG2-OD1 3.17Å
695	L	79.3	Confident	76.8	Confident	64 Å²	64	30.8 Å²	30.8	34%	0.335	16%	0.155	S	C	.	.	H	α-helix	trans	-63.5	-41	170.6	-72.8	175.5	0	0	0	112.9	F691 V692 F693 F698 A699	F691-L695 HydrophobicContact CD1-CD1 4.05Å; F691-L695 HydrophobicContact CD2-CG 4.47Å; F691-L695 HydrophobicContact CE1-CD1 3.62Å; F691-L695 HydrophobicContact CE1-CG 4.46Å; F691-L695 HydrophobicContact CE2-CD1 4.19Å; F691-L695 HydrophobicContact CE2-CD2 4.33Å; F691-L695 HydrophobicContact CE2-CG 4.2Å; F691-L695 HydrophobicContact CZ-CD1 3.7Å; F691-L695 HydrophobicContact CZ-CD2 4.36Å; F691-L695 HydrophobicContact CZ-CG 4.2Å; F691-L695 WeakPolarHBondContact O-CG 3.44Å; F691-L695 PolarHBondContact O-N 3.42Å; V692-L695 WeakPolarHBondContact O-CB 3.44Å; V692-L695 PolarHBondContact O-N 3.03Å; F693-L695 VanDerWaalsContact C-N 3.31Å; F693-L695 PolarHBondContact O-N 3.48Å; L695-F698 PolarHBondContact O-N 3.04Å; L695-A699 PolarHBondContact O-N 3.31Å
696	F	80.2	Confident	78.4	Confident	14 Å²	14	32 Å²	32	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-60.9	-49.7	173.9	-85.2	-81.7	0	0	0	111.6	P88 I89 V692 F693 F698 A699 H700 L749	P88-F696 HydrophobicContact CB-CD1 3.95Å; P88-F696 HydrophobicContact CB-CE1 3.63Å; P88-F696 HydrophobicContact CB-CE2 4.2Å; P88-F696 HydrophobicContact CB-CG 4.38Å; P88-F696 HydrophobicContact CB-CZ 3.76Å; I89-F696 HydrophobicContact CG1-CE1 3.76Å; I89-F696 HydrophobicContact CG1-CZ 3.96Å; V692-F696 HydrophobicContact CG1-CD2 4.13Å; V692-F696 HydrophobicContact CG1-CE2 3.87Å; V692-F696 VanDerWaalsContact O-CD2 3.3Å; V692-F696 WeakPolarHBondContact O-CD2 3.35Å; V692-F696 PolarHBondContact O-N 3.4Å; F693-F696 PolarHBondContact O-N 2.9Å; F696-F698 VanDerWaalsContact C-N 3.31Å; F696-F698 PolarHBondContact O-N 3.21Å; F696-A699 PolarHBondContact O-N 2.68Å; F696-H700 PolarHBondContact O-CD2 3.31Å; F696-H700 VanDerWaalsContact O-CD2 3.24Å; F696-H700 PolarHBondContact O-N 2.87Å; F696-L749 HydrophobicContact CD2-CD1 4Å; F696-L749 HydrophobicContact CE2-CD1 3.79Å; F696-L749 HydrophobicContact CZ-CD1 4.15Å
697	F	85.9	Confident	79.8	Confident	6 Å²	6	31.4 Å²	31.4	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-62.8	-35.6	176.5	-78.1	-68.1	0	0	0	112.7	F693 T694 S701 Y742 Y771 C774 A778 Y803 W837	F693-F697 WeakPolarHBondContact O-CD2 3.38Å; F693-F697 PolarHBondContact O-N 3.16Å; F693-F697 VanDerWaalsContact O-N 3.11Å; T694-F697 PolarHBondContact O-N 3.11Å; F697-S701 VanDerWaalsContact O-CB 3.26Å; F697-S701 WeakPolarHBondContact O-CB 3.27Å; F697-S701 PolarHBondContact O-N 3.5Å; F697-S701 PolarHBondContact O-OG 2.82Å; F697-Y742 HydrophobicContact CD1-CD1 4.02Å; F697-Y742 AromaticContact CD1-CE1 3.89Å; F697-Y742 HydrophobicContact CD1-CE1 3.89Å; F697-Y742 HydrophobicContact CE1-CD1 4.16Å; F697-Y742 HydrophobicContact CE1-CE1 4.44Å; F697-Y771 HydrophobicContact CE1-CE2 4.09Å; F697-Y771 AromaticContact CE2-CD2 3.98Å; F697-Y771 HydrophobicContact CE2-CD2 3.98Å; F697-Y771 AromaticContact CE2-CE2 3.74Å; F697-Y771 HydrophobicContact CE2-CE2 3.74Å; F697-Y771 AromaticContact CZ-CD2 3.59Å; F697-Y771 HydrophobicContact CZ-CD2 3.59Å; F697-Y771 HydrophobicContact CZ-CE1 4.45Å; F697-Y771 AromaticContact CZ-CE2 3.32Å; F697-Y771 HydrophobicContact CZ-CE2 3.32Å; F697-Y771 HydrophobicContact CZ-CG 4.27Å; F697-Y771 AromaticContact CZ-CZ 3.79Å; F697-C774 HydrophobicContact CE2-CB 4.46Å; F697-C774 HydrophobicContact CZ-CB 4.02Å; F697-C774 VanDerWaalsContact CZ-SG 3.57Å; F697-A778 HydrophobicContact CD1-CB 4.5Å; F697-Y803 HydrophobicContact CB-CE1 3.96Å; F697-W837 HydrophobicContact CE2-CD2 4.22Å; F697-W837 AromaticContact CE2-CE2 3.86Å; F697-W837 HydrophobicContact CE2-CH2 4.47Å; F697-W837 HydrophobicContact CE2-CZ2 4Å
698	F	86.1	Confident	81	Confident	60 Å²	60	29.4 Å²	29.4	26%	0.263	15%	0.148	S	C	.	.	H	α-helix	trans	-62.4	-48.1	174.1	170.2	-102	0	0	0	112.3	T694 L695 F696 H700 S701 M702 Y803	T694-F698 VanDerWaalsContact O-CB 3.26Å; T694-F698 WeakPolarHBondContact O-CB 3.23Å; T694-F698 PolarHBondContact O-N 3.41Å; L695-F698 PolarHBondContact O-N 3.04Å; F696-F698 VanDerWaalsContact C-N 3.31Å; F696-F698 PolarHBondContact O-N 3.21Å; F698-H700 PolarHBondContact O-N 3.14Å; F698-S701 WeakPolarHBondContact CA-OG 3.2Å; F698-S701 PolarHBondContact O-N 2.89Å; F698-S701 PolarHBondContact O-OG 2.71Å; F698-M702 HydrophobicContact CD2-CE 3.98Å; F698-M702 HydrophobicContact CD2-CG 4Å; F698-M702 HydrophobicContact CE1-CG 4.36Å; F698-M702 HydrophobicContact CE2-CE 3.99Å; F698-M702 HydrophobicContact CE2-CG 3.65Å; F698-M702 HydrophobicContact CE2-SD 4.01Å; F698-M702 HydrophobicContact CZ-CG 3.86Å; F698-M702 VanDerWaalsContact O-CG 3.31Å; F698-M702 WeakPolarHBondContact O-CG 3.4Å; F698-M702 PolarHBondContact O-N 3.12Å; F698-Y803 HydrophobicContact CB-CD1 3.94Å; F698-Y803 HydrophobicContact CB-CE1 4.41Å; F698-Y803 HydrophobicContact CB-CG 4.25Å; F698-Y803 HydrophobicContact CD2-CD1 4.48Å; F698-Y803 HydrophobicContact CD2-CD2 4.35Å; F698-Y803 AromaticContact CD2-CG 3.94Å; F698-Y803 HydrophobicContact CD2-CG 3.94Å
699	A	83.1	Confident	81.8	Confident	16 Å²	16	25.3 Å²	25.3	13%	0.132	13%	0.13	C	C	.	.	H	α-helix	trans	-59.1	-46.7	179.9	0	0	0	0	0	112.5	P88 L695 F696 H703	P88-A699 HydrophobicContact CG-CB 4.42Å; L695-A699 PolarHBondContact O-N 3.31Å; F696-A699 PolarHBondContact O-N 2.68Å; A699-H703 PolarHBondContact O-N 3.2Å
700	H	85.8	Confident	82.1	Confident	10 Å²	10	29.3 Å²	29.3	5%	0.046	14%	0.143	C	C	.	.	H	α-helix	trans	-71.6	-39.9	-179.2	-70.1	-63	0	0	0	113.2	F85 F696 F698 H703 M704 I741 Y742 S745	F85-H700 AromaticContact CZ-CE1 3.99Å; F696-H700 PolarHBondContact O-CD2 3.31Å; F696-H700 VanDerWaalsContact O-CD2 3.24Å; F696-H700 PolarHBondContact O-N 2.87Å; F698-H700 PolarHBondContact O-N 3.14Å; H700-H703 PolarHBondContact O-N 3.14Å; H700-M704 PolarHBondContact O-N 3.15Å; H700-I741 HydrophobicContact CB-CG2 4.25Å; H700-I741 WeakPolarHBondContact ND1-CG2 3.39Å; H700-Y742 HydrophobicContact CB-CD1 4.08Å; H700-Y742 HydrophobicContact CB-CE1 3.62Å; H700-S745 VanDerWaalsContact NE2-CB 3.31Å; H700-S745 WeakPolarHBondContact NE2-CB 3.38Å
701	S	88.4	Confident	82.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.2	-41.9	176.6	57.4	0	0	0	0	112.6	F697 F698 H703 M704 L705 C782 Y803	F697-S701 VanDerWaalsContact O-CB 3.26Å; F697-S701 WeakPolarHBondContact O-CB 3.27Å; F697-S701 PolarHBondContact O-N 3.5Å; F697-S701 PolarHBondContact O-OG 2.82Å; F698-S701 WeakPolarHBondContact CA-OG 3.2Å; F698-S701 PolarHBondContact O-N 2.89Å; F698-S701 PolarHBondContact O-OG 2.71Å; S701-H703 VanDerWaalsContact C-N 3.31Å; S701-H703 PolarHBondContact O-N 3.3Å; S701-M704 PolarHBondContact O-N 2.86Å; S701-L705 WeakPolarHBondContact O-CG 3.26Å; S701-L705 PolarHBondContact O-N 3.24Å; S701-C782 VanDerWaalsContact CB-SG 3.56Å; S701-Y803 WeakPolarHBondContact CB-OH 3.33Å; S701-Y803 WeakPolarHBondContact OG-CE2 3.4Å; S701-Y803 VanDerWaalsContact OG-CZ 3.24Å; S701-Y803 PolarHBondContact OG-OH 2.93Å
702	M	84.8	Confident	82.2	Confident	29 Å²	29	32.9 Å²	32.9	14%	0.143	16%	0.156	C	C	.	.	H	α-helix	trans	-61.3	-38.4	175.7	-70.5	-48.4	108.6	0	0	112.2	F698 L705 L706 G799 Y803	F698-M702 HydrophobicContact CD2-CE 3.98Å; F698-M702 HydrophobicContact CD2-CG 4Å; F698-M702 HydrophobicContact CE1-CG 4.36Å; F698-M702 HydrophobicContact CE2-CE 3.99Å; F698-M702 HydrophobicContact CE2-CG 3.65Å; F698-M702 HydrophobicContact CE2-SD 4.01Å; F698-M702 HydrophobicContact CZ-CG 3.86Å; F698-M702 VanDerWaalsContact O-CG 3.31Å; F698-M702 WeakPolarHBondContact O-CG 3.4Å; F698-M702 PolarHBondContact O-N 3.12Å; M702-L705 HydrophobicContact CE-CD1 4.04Å; M702-L706 WeakPolarHBondContact O-CB 3.12Å; M702-L706 PolarHBondContact O-N 2.99Å; M702-L706 VanDerWaalsContact O-N 3.08Å; M702-G799 WeakPolarHBondContact CE-O 3.34Å; M702-Y803 HydrophobicContact CE-CD2 3.94Å; M702-Y803 HydrophobicContact CE-CE2 4.25Å
703	H	84.7	Confident	82.1	Confident	51 Å²	51	38.2 Å²	38.2	24%	0.236	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-46	174.2	179.1	-100.3	0	0	0	111.9	W81 A699 H700 S701 L706 V707	W81-H703 AromaticContact CZ2-NE2 3.94Å; A699-H703 PolarHBondContact O-N 3.2Å; H700-H703 PolarHBondContact O-N 3.14Å; S701-H703 VanDerWaalsContact C-N 3.31Å; S701-H703 PolarHBondContact O-N 3.3Å; H703-L706 PolarHBondContact O-N 3.24Å; H703-V707 WeakPolarHBondContact O-CG2 3.23Å; H703-V707 PolarHBondContact O-N 3.02Å; H703-V707 VanDerWaalsContact O-N 3.13Å
704	M	86.2	Confident	81.8	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.015	19%	0.191	C	C	.	.	H	α-helix	trans	-62.1	-44	179.1	-76.7	-63.5	-66.8	0	0	112.9	H700 S701 V707 A708 F734 R737 A738 I741	H700-M704 PolarHBondContact O-N 3.15Å; S701-M704 PolarHBondContact O-N 2.86Å; M704-V707 PolarHBondContact O-N 3.04Å; M704-A708 PolarHBondContact O-N 3.13Å; M704-A708 VanDerWaalsContact O-N 3.12Å; M704-F734 HydrophobicContact CE-CD2 4.29Å; M704-F734 HydrophobicContact CE-CE2 4Å; M704-F734 HydrophobicContact CE-CZ 4.23Å; M704-R737 HydrophobicContact CE-CB 4.15Å; M704-R737 HydrophobicContact CE-CG 3.96Å; M704-R737 HydrophobicContact SD-CG 3.98Å; M704-A738 HydrophobicContact CE-CB 3.78Å; M704-I741 HydrophobicContact SD-CD1 3.69Å
705	L	87	Confident	81.2	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-42.4	175.6	-73.4	174.5	0	0	0	112.1	S701 M702 V707 A709 C782 L785 V795	S701-L705 WeakPolarHBondContact O-CG 3.26Å; S701-L705 PolarHBondContact O-N 3.24Å; M702-L705 HydrophobicContact CE-CD1 4.04Å; L705-V707 PolarHBondContact O-N 3.31Å; L705-A709 WeakPolarHBondContact O-CB 3.43Å; L705-A709 PolarHBondContact O-N 2.85Å; L705-C782 HydrophobicContact CD2-CB 4.07Å; L705-C782 VanDerWaalsContact CD2-O 3.28Å; L705-C782 WeakPolarHBondContact CD2-O 3.26Å; L705-C782 HydrophobicContact CG-CB 4.4Å; L705-L785 HydrophobicContact CD1-CD1 4.33Å; L705-L785 HydrophobicContact CD2-CB 4.04Å; L705-V795 HydrophobicContact CB-CG1 4.08Å; L705-V795 HydrophobicContact CD2-CG1 3.89Å; L705-V795 HydrophobicContact CG-CG1 4.43Å
706	L	83.9	Confident	81.1	Confident	63 Å²	63	38.7 Å²	38.7	33%	0.33	19%	0.186	S	C	.	.	H	α-helix	trans	-60.9	-44.9	178.1	174.6	63.9	0	0	0	112.2	M702 H703 R710 L792 M796	M702-L706 WeakPolarHBondContact O-CB 3.12Å; M702-L706 PolarHBondContact O-N 2.99Å; M702-L706 VanDerWaalsContact O-N 3.08Å; H703-L706 PolarHBondContact O-N 3.24Å; L706-R710 WeakPolarHBondContact O-CB 3.16Å; L706-R710 PolarHBondContact O-N 3.44Å; L706-R710 VanDerWaalsContact O-N 3.07Å; L706-L792 HydrophobicContact CD1-CD1 4.22Å; L706-L792 HydrophobicContact CD1-CD2 4.42Å; L706-M796 HydrophobicContact CD1-CE 4.4Å; L706-M796 HydrophobicContact CD1-SD 3.85Å
707	V	83.8	Confident	80.6	Confident	39 Å²	39	39.4 Å²	39.4	24%	0.236	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-50	-179.1	176.9	0	0	0	0	110.2	H703 M704 L705 A709 R710 E711	H703-V707 WeakPolarHBondContact O-CG2 3.23Å; H703-V707 PolarHBondContact O-N 3.02Å; H703-V707 VanDerWaalsContact O-N 3.13Å; M704-V707 PolarHBondContact O-N 3.04Å; L705-V707 PolarHBondContact O-N 3.31Å; V707-A709 PolarHBondContact O-N 3.44Å; V707-R710 PolarHBondContact O-N 2.85Å; V707-E711 WeakPolarHBondContact CG1-OE1 3.39Å; V707-E711 WeakPolarHBondContact O-CG 3.26Å; V707-E711 PolarHBondContact O-N 2.93Å
708	A	83.6	Confident	79.8	Confident	2 Å²	2	42.5 Å²	42.5	2%	0.017	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-43.1	179.1	0	0	0	0	0	112.5	M704 R710 E711 R712 F734 Y786	M704-A708 PolarHBondContact O-N 3.13Å; M704-A708 VanDerWaalsContact O-N 3.12Å; A708-R710 VanDerWaalsContact C-N 3.33Å; A708-R710 PolarHBondContact O-N 2.9Å; A708-E711 PolarHBondContact O-N 2.77Å; A708-R712 PolarHBondContact O-N 3.12Å; A708-F734 HydrophobicContact CB-CD2 4.25Å; A708-F734 HydrophobicContact CB-CE2 3.87Å; A708-Y786 HydrophobicContact CB-CD2 3.62Å; A708-Y786 HydrophobicContact CB-CE2 3.93Å; A708-Y786 HydrophobicContact CB-CG 4.14Å; A708-Y786 VanDerWaalsContact O-CE2 3.31Å; A708-Y786 WeakPolarHBondContact O-CE2 3.44Å
709	A	81.6	Confident	79.4	Confident	5 Å²	5	40 Å²	40	4%	0.041	20%	0.204	C	C	.	.	H	α-helix	trans	-62.4	-38.2	176.8	0	0	0	0	0	112.6	L705 V707 Q713 L792 V795	L705-A709 WeakPolarHBondContact O-CB 3.43Å; L705-A709 PolarHBondContact O-N 2.85Å; V707-A709 PolarHBondContact O-N 3.44Å; A709-Q713 WeakPolarHBondContact O-CB 3.35Å; A709-Q713 PolarHBondContact O-N 2.88Å; A709-L792 HydrophobicContact CB-CB 4.21Å; A709-L792 HydrophobicContact CB-CD1 4.14Å; A709-L792 HydrophobicContact CB-CG 4.01Å; A709-V795 HydrophobicContact CB-CB 4.37Å; A709-V795 HydrophobicContact CB-CG1 4.34Å; A709-V795 HydrophobicContact CB-CG2 4.42Å
710	R	76.5	Confident	79.1	Confident	108 Å²	108	40.4 Å²	40.4	41%	0.408	20%	0.203	S	C	.	.	H	α-helix	trans	-67.1	-42.7	175.1	-174.4	176.6	-179.8	173.9	-0.2	111.7	L706 V707 A708 R712 Q713 Q714 L792 E1030	L706-R710 WeakPolarHBondContact O-CB 3.16Å; L706-R710 PolarHBondContact O-N 3.44Å; L706-R710 VanDerWaalsContact O-N 3.07Å; V707-R710 PolarHBondContact O-N 2.85Å; A708-R710 VanDerWaalsContact C-N 3.33Å; A708-R710 PolarHBondContact O-N 2.9Å; R710-R712 VanDerWaalsContact C-N 3.31Å; R710-R712 PolarHBondContact O-N 3.14Å; R710-Q713 PolarHBondContact O-N 2.88Å; R710-Q714 PolarHBondContact O-N 3.19Å; R710-L792 HydrophobicContact CB-CD1 4.27Å; R710-E1030 IonicContact CZ-OE2 3.44Å; R710-E1030 IonicContact NH2-OE2 3.27Å; R710-E1030 PolarHBondContact NH2-OE2 3.12Å
711	E	78.1	Confident	78.5	Confident	62 Å²	62	44.5 Å²	44.5	29%	0.29	22%	0.221	S	C	.	.	H	α-helix	trans	-59.7	-40.7	176.8	-72.3	164.6	167.6	0	0	111.8	V707 A708 G715 F716 R737	V707-E711 WeakPolarHBondContact CG1-OE1 3.39Å; V707-E711 WeakPolarHBondContact O-CG 3.26Å; V707-E711 PolarHBondContact O-N 2.93Å; A708-E711 PolarHBondContact O-N 2.77Å; E711-G715 PolarHBondContact O-N 3.38Å; E711-F716 HydrophobicContact CB-CD2 4.32Å; E711-F716 HydrophobicContact CG-CD2 4.45Å; E711-F716 PolarHBondContact O-N 3.4Å; E711-R737 IonicContact OE1-CZ 2.68Å; E711-R737 IonicContact OE1-NH1 2.78Å; E711-R737 PolarHBondContact OE1-NH1 3.39Å; E711-R737 IonicContact OE1-NH2 3.84Å; E711-R737 IonicContact OE2-CZ 3.44Å; E711-R737 IonicContact OE2-NH1 3.46Å; E711-R737 IonicContact OE2-NH2 3.92Å; E711-R737 PolarHBondContact OE2-NH2 3.24Å
712	R	76.5	Confident	77.5	Confident	101 Å²	101	45 Å²	45	38%	0.381	22%	0.224	S	C	.	.	H	α-helix	trans	-67.1	-44.4	173.6	-175.8	176.5	-175.7	174.8	5.5	112.5	A708 R710 Q714 G715 Y786 T787 F789	A708-R712 PolarHBondContact O-N 3.12Å; R710-R712 VanDerWaalsContact C-N 3.31Å; R710-R712 PolarHBondContact O-N 3.14Å; R712-Q714 VanDerWaalsContact C-N 3.3Å; R712-Q714 PolarHBondContact O-N 2.98Å; R712-G715 PolarHBondContact O-N 3.13Å; R712-Y786 HydrophobicContact CB-CE2 3.71Å; R712-Y786 HydrophobicContact CG-CE2 4.27Å; R712-Y786 PolarHBondContact NH1-O 3.45Å; R712-T787 PolarHBondContact NH1-O 2.7Å; R712-F789 PolarHBondContact NH1-O 3.21Å
713	Q	70.7	Confident	76.8	Confident	145 Å²	145	43.7 Å²	43.7	68%	0.678	22%	0.218	S	C	*	.	H	α-helix	trans	-63.8	-34.3	179.5	-172.9	176.3	-2	0	0	112.6	A709 R710 G715	A709-Q713 WeakPolarHBondContact O-CB 3.35Å; A709-Q713 PolarHBondContact O-N 2.88Å; R710-Q713 PolarHBondContact O-N 2.88Å; Q713-G715 VanDerWaalsContact C-N 3.28Å
714	Q	70	Confident	75.9	Confident	65 Å²	65	42.5 Å²	42.5	30%	0.304	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-10.3	175	-70.4	178.9	-36.9	0	0	113.2	R710 R712 F716 E1030	R710-Q714 PolarHBondContact O-N 3.19Å; R712-Q714 VanDerWaalsContact C-N 3.3Å; R712-Q714 PolarHBondContact O-N 2.98Å; Q714-F716 HydrophobicContact CB-CD2 3.99Å; Q714-F716 HydrophobicContact CB-CE2 3.77Å; Q714-F716 HydrophobicContact CB-CZ 4.33Å; Q714-E1030 PolarHBondContact NE2-OE2 3.45Å
715	G	70.1	Confident	75.2	Confident	25 Å²	25	44.2 Å²	44.2	26%	0.258	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	14.6	173.8	0	0	0	0	0	115.1	E711 R712 Q713 S717 S718 Y719	E711-G715 PolarHBondContact O-N 3.38Å; R712-G715 PolarHBondContact O-N 3.13Å; Q713-G715 VanDerWaalsContact C-N 3.28Å; G715-S717 VanDerWaalsContact C-N 3.34Å; G715-S717 PolarHBondContact O-N 3.06Å; G715-S718 PolarHBondContact O-N 3.48Å; G715-Y719 PolarHBondContact O-N 2.79Å
716	F	76.3	Confident	74.5	Confident	7 Å²	7	51.8 Å²	51.8	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-58.8	-42.1	-177.4	-69.7	-60.8	0	0	0	113	E711 Q714 S718 Y719 M720 C1027 L1028 F1029	E711-F716 HydrophobicContact CB-CD2 4.32Å; E711-F716 HydrophobicContact CG-CD2 4.45Å; E711-F716 PolarHBondContact O-N 3.4Å; Q714-F716 HydrophobicContact CB-CD2 3.99Å; Q714-F716 HydrophobicContact CB-CE2 3.77Å; Q714-F716 HydrophobicContact CB-CZ 4.33Å; F716-S718 VanDerWaalsContact C-N 3.29Å; F716-S718 PolarHBondContact O-N 3.3Å; F716-Y719 PolarHBondContact O-N 3.39Å; F716-M720 WeakPolarHBondContact O-CB 3.42Å; F716-M720 PolarHBondContact O-N 3.01Å; F716-C1027 HydrophobicContact CD1-CB 4.47Å; F716-L1028 WeakPolarHBondContact CZ-O 3.31Å; F716-F1029 HydrophobicContact CD1-CE1 4.08Å; F716-F1029 HydrophobicContact CD1-CE2 4.47Å; F716-F1029 HydrophobicContact CD1-CZ 4.03Å; F716-F1029 HydrophobicContact CD2-CD1 4.48Å; F716-F1029 AromaticContact CD2-CE1 3.99Å; F716-F1029 HydrophobicContact CD2-CE1 3.99Å; F716-F1029 AromaticContact CE1-CD1 3.92Å; F716-F1029 HydrophobicContact CE1-CD1 3.92Å; F716-F1029 HydrophobicContact CE1-CD2 4.32Å; F716-F1029 AromaticContact CE1-CE1 3.9Å; F716-F1029 HydrophobicContact CE1-CE1 3.9Å; F716-F1029 HydrophobicContact CE1-CE2 4.31Å; F716-F1029 HydrophobicContact CE1-CG 4.13Å; F716-F1029 HydrophobicContact CE1-CZ 4.1Å; F716-F1029 AromaticContact CE2-CD1 3.84Å; F716-F1029 HydrophobicContact CE2-CD1 3.84Å; F716-F1029 AromaticContact CE2-CE1 3.81Å; F716-F1029 HydrophobicContact CE2-CE1 3.81Å; F716-F1029 HydrophobicContact CG-CE1 4.13Å; F716-F1029 HydrophobicContact CG-CZ 4.31Å; F716-F1029 AromaticContact CZ-CD1 3.54Å; F716-F1029 HydrophobicContact CZ-CD1 3.54Å; F716-F1029 AromaticContact CZ-CE1 3.78Å; F716-F1029 HydrophobicContact CZ-CE1 3.78Å; F716-F1029 HydrophobicContact CZ-CG 4.02Å; F716-F1029 HydrophobicContact CZ-CZ 4.44Å
717	S	70.5	Confident	73.9	Confident	30 Å²	30	53.2 Å²	53.2	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-56.9	-42.8	-178.9	-178.2	0	0	0	0	112.1	G715 Y719 M720 K721	G715-S717 VanDerWaalsContact C-N 3.34Å; G715-S717 PolarHBondContact O-N 3.06Å; S717-Y719 PolarHBondContact O-N 3.26Å; S717-M720 PolarHBondContact O-N 3.49Å; S717-K721 WeakPolarHBondContact O-CB 3.42Å; S717-K721 VanDerWaalsContact O-CG 3.27Å; S717-K721 WeakPolarHBondContact O-CG 3.4Å; S717-K721 PolarHBondContact O-N 2.94Å
718	S	68.7	Low	73.5	Confident	71 Å²	71	54.2 Å²	54.2	50%	0.497	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-38	175.2	-57.2	0	0	0	0	112.6	G715 F716 V722	G715-S718 PolarHBondContact O-N 3.48Å; F716-S718 VanDerWaalsContact C-N 3.29Å; F716-S718 PolarHBondContact O-N 3.3Å; S718-V722 WeakPolarHBondContact O-CG2 2.93Å
719	Y	77.2	Confident	73.3	Confident	6 Å²	6	56.6 Å²	56.6	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-73.3	-38.2	179.3	-172.8	-125.4	0	0	0	112.8	G715 F716 S717 V722 S723 Y1021 P1023 C1027 Y1041 V1086	G715-Y719 PolarHBondContact O-N 2.79Å; F716-Y719 PolarHBondContact O-N 3.39Å; S717-Y719 PolarHBondContact O-N 3.26Å; Y719-V722 PolarHBondContact O-N 3.07Å; Y719-S723 PolarHBondContact O-N 3.32Å; Y719-S723 PolarHBondContact O-OG 2.95Å; Y719-Y1021 WeakPolarHBondContact CE2-O 3.19Å; Y719-P1023 HydrophobicContact CD2-CG 3.92Å; Y719-P1023 HydrophobicContact CE2-CG 4.05Å; Y719-C1027 HydrophobicContact CD1-CB 3.56Å; Y719-C1027 HydrophobicContact CD2-CB 4.46Å; Y719-C1027 HydrophobicContact CE1-CB 4.21Å; Y719-C1027 HydrophobicContact CG-CB 3.72Å; Y719-Y1041 HydrophobicContact CD1-CE1 4.19Å; Y719-Y1041 WeakPolarHBondContact CD1-OH 3.29Å; Y719-Y1041 AromaticContact CE1-CE1 3.79Å; Y719-Y1041 HydrophobicContact CE1-CE1 3.79Å; Y719-Y1041 AromaticContact CE1-CZ 3.74Å; Y719-V1086 HydrophobicContact CE1-CG1 4.32Å
720	M	78	Confident	73.1	Confident	25 Å²	25	58.4 Å²	58.4	12%	0.123	29%	0.29	C	S	.	.	H	α-helix	trans	-67.6	-35.6	174.7	-83.8	175.1	157.5	0	0	112.8	F716 S717 V722 S723 G724 L725 F730 F1029 F1040	F716-M720 WeakPolarHBondContact O-CB 3.42Å; F716-M720 PolarHBondContact O-N 3.01Å; S717-M720 PolarHBondContact O-N 3.49Å; M720-V722 PolarHBondContact O-N 3.22Å; M720-S723 PolarHBondContact O-N 3.26Å; M720-G724 PolarHBondContact O-N 3.11Å; M720-L725 HydrophobicContact CB-CD1 3.6Å; M720-L725 HydrophobicContact CG-CD1 3.8Å; M720-L725 PolarHBondContact O-N 3.26Å; M720-L725 HydrophobicContact SD-CD1 4.13Å; M720-F730 HydrophobicContact CB-CE1 3.72Å; M720-F730 HydrophobicContact CB-CZ 3.46Å; M720-F730 VanDerWaalsContact CB-CZ 3.46Å; M720-F730 HydrophobicContact CG-CE1 4.41Å; M720-F730 HydrophobicContact SD-CE1 3.81Å; M720-F730 HydrophobicContact SD-CZ 4.49Å; M720-F1029 HydrophobicContact CE-CE2 4.26Å; M720-F1029 HydrophobicContact CE-CZ 3.71Å; M720-F1040 HydrophobicContact CE-CE1 3.84Å; M720-F1040 HydrophobicContact CE-CZ 3.74Å
721	K	71.6	Confident	73.3	Confident	96 Å²	96	54.2 Å²	54.2	42%	0.417	28%	0.276	S	S	.	.	H	α-helix	trans	-60.4	-26.5	170.6	-78.2	177.8	-176.9	-171.2	0	113	S717 S723 F730 F1016	S717-K721 WeakPolarHBondContact O-CB 3.42Å; S717-K721 VanDerWaalsContact O-CG 3.27Å; S717-K721 WeakPolarHBondContact O-CG 3.4Å; S717-K721 PolarHBondContact O-N 2.94Å; K721-S723 VanDerWaalsContact C-N 3.32Å; K721-F730 HydrophobicContact CG-CE2 3.83Å; K721-F730 HydrophobicContact CG-CZ 4.07Å; K721-F1016 WeakPolarHBondContact O-CE1 3.27Å; K721-F1016 WeakPolarHBondContact O-CZ 3.43Å
722	V	68.8	Low	73.6	Confident	11 Å²	11	54.3 Å²	54.3	7%	0.067	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-3.7	173.1	-171.1	0	0	0	0	112.4	S718 Y719 M720 L994 F1016 Y1021	S718-V722 WeakPolarHBondContact O-CG2 2.93Å; Y719-V722 PolarHBondContact O-N 3.07Å; M720-V722 PolarHBondContact O-N 3.22Å; V722-L994 HydrophobicContact CG2-CD1 3.84Å; V722-L994 HydrophobicContact CG2-CD2 3.32Å; V722-L994 HydrophobicContact CG2-CG 3.38Å; V722-F1016 VanDerWaalsContact O-CD1 3.3Å; V722-F1016 WeakPolarHBondContact O-CD1 3.14Å; V722-Y1021 HydrophobicContact CB-CD1 4.46Å; V722-Y1021 HydrophobicContact CG1-CD1 3.92Å; V722-Y1021 HydrophobicContact CG1-CG 4.09Å; V722-Y1021 HydrophobicContact CG2-CD1 4.39Å
723	S	69.9	Low	74.1	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.007	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-4.4	-174.3	-57.2	0	0	0	0	114.4	Y719 M720 K721	Y719-S723 PolarHBondContact O-N 3.32Å; Y719-S723 PolarHBondContact O-OG 2.95Å; M720-S723 PolarHBondContact O-N 3.26Å; K721-S723 VanDerWaalsContact C-N 3.32Å
724	G	65	Low	74.9	Confident	27 Å²	27	46.8 Å²	46.8	28%	0.278	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	146.4	-32.6	-175.1	0	0	0	0	0	115	M720 K726 F1016	M720-G724 PolarHBondContact O-N 3.11Å; G724-K726 PolarHBondContact O-N 3.23Å; G724-F1016 VanDerWaalsContact CA-CG 3.43Å; G724-F1016 VanDerWaalsContact N-CG 3.32Å
725	L	71.5	Confident	75.7	Confident	39 Å²	39	45.3 Å²	45.3	20%	0.204	25%	0.252	C	S	.	.			trans	-87.6	109.1	-152.3	-70.6	162	0	0	0	112.8	M720 T729 F730 L1044	M720-L725 HydrophobicContact CB-CD1 3.6Å; M720-L725 HydrophobicContact CG-CD1 3.8Å; M720-L725 PolarHBondContact O-N 3.26Å; M720-L725 HydrophobicContact SD-CD1 4.13Å; L725-T729 WeakPolarHBondContact CB-OG1 3.34Å; L725-T729 HydrophobicContact CD2-CG2 4.15Å; L725-T729 WeakPolarHBondContact CD2-OG1 3.24Å; L725-F730 HydrophobicContact CB-CD2 4.46Å; L725-F730 HydrophobicContact CB-CE2 3.66Å; L725-F730 HydrophobicContact CB-CZ 3.88Å; L725-F730 HydrophobicContact CD1-CZ 4.34Å; L725-L1044 HydrophobicContact CD1-CD1 3.7Å; L725-L1044 HydrophobicContact CD1-CD2 4.06Å; L725-L1044 HydrophobicContact CD1-CG 4.46Å; L725-L1044 HydrophobicContact CD2-CD1 3.93Å; L725-L1044 HydrophobicContact CG-CD1 3.85Å
726	K	71.9	Confident	76.6	Confident	160 Å²	160	49.2 Å²	49.2	70%	0.696	27%	0.266	S	S	*	.			trans	-58.5	147.8	164.7	-67.1	-176.2	178.5	-179.4	0	109.7	G724 V728 T729	G724-K726 PolarHBondContact O-N 3.23Å; K726-V728 PolarHBondContact O-N 2.92Å; K726-V728 VanDerWaalsContact O-N 3.07Å; K726-T729 PolarHBondContact O-N 3.1Å; K726-T729 PolarHBondContact O-OG1 3.25Å
727	W	71.6	Confident	77.2	Confident	92 Å²	92	52.4 Å²	52.4	35%	0.348	28%	0.278	S	S	.	.	H	α-helix	trans	-52.3	-36.4	-179.9	68.5	-98.3	0	0	0	112.7	T729 F730 L731 L890	W727-T729 PolarHBondContact O-N 2.78Å; W727-F730 WeakPolarHBondContact O-CB 3.33Å; W727-F730 PolarHBondContact O-N 3.43Å; W727-L731 HydrophobicContact CZ3-CD2 3.94Å; W727-L731 PolarHBondContact O-N 3.19Å; W727-L890 HydrophobicContact CE3-CD2 4.19Å; W727-L890 HydrophobicContact CH2-CD2 3.13Å; W727-L890 HydrophobicContact CZ2-CD2 4.07Å; W727-L890 HydrophobicContact CZ3-CD2 3.2Å
728	V	75	Confident	78	Confident	61 Å²	61	51 Å²	51	37%	0.37	27%	0.268	S	S	.	.	H	α-helix	trans	-51.2	-40.1	175.8	-175.5	0	0	0	0	112.4	K726 F730 L731 T732	K726-V728 PolarHBondContact O-N 2.92Å; K726-V728 VanDerWaalsContact O-N 3.07Å; V728-F730 VanDerWaalsContact C-N 3.29Å; V728-F730 PolarHBondContact O-N 3.28Å; V728-L731 WeakPolarHBondContact O-CB 3.42Å; V728-L731 PolarHBondContact O-N 3.48Å; V728-T732 HydrophobicContact CG1-CG2 4.28Å; V728-T732 PolarHBondContact O-N 3.43Å; V728-T732 PolarHBondContact O-OG1 3.4Å
729	T	80.1	Confident	79	Confident	51 Å²	51	50.7 Å²	50.7	31%	0.313	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-26.7	-177.7	62.3	0	0	0	0	113.2	L725 K726 W727 T732 S733	L725-T729 WeakPolarHBondContact CB-OG1 3.34Å; L725-T729 HydrophobicContact CD2-CG2 4.15Å; L725-T729 WeakPolarHBondContact CD2-OG1 3.24Å; K726-T729 PolarHBondContact O-N 3.1Å; K726-T729 PolarHBondContact O-OG1 3.25Å; W727-T729 PolarHBondContact O-N 2.78Å; T729-T732 PolarHBondContact O-OG1 2.76Å; T729-S733 WeakPolarHBondContact O-CB 3.21Å; T729-S733 PolarHBondContact O-N 3.49Å
730	F	77.3	Confident	79.6	Confident	44 Å²	44	54.3 Å²	54.3	19%	0.193	28%	0.283	C	S	.	.	H	α-helix	trans	-75.2	-39.3	172.4	-62.2	-91.2	0	0	0	111.1	M720 K721 L725 W727 V728 F734	M720-F730 HydrophobicContact CB-CE1 3.72Å; M720-F730 HydrophobicContact CB-CZ 3.46Å; M720-F730 VanDerWaalsContact CB-CZ 3.46Å; M720-F730 HydrophobicContact CG-CE1 4.41Å; M720-F730 HydrophobicContact SD-CE1 3.81Å; M720-F730 HydrophobicContact SD-CZ 4.49Å; K721-F730 HydrophobicContact CG-CE2 3.83Å; K721-F730 HydrophobicContact CG-CZ 4.07Å; L725-F730 HydrophobicContact CB-CD2 4.46Å; L725-F730 HydrophobicContact CB-CE2 3.66Å; L725-F730 HydrophobicContact CB-CZ 3.88Å; L725-F730 HydrophobicContact CD1-CZ 4.34Å; W727-F730 WeakPolarHBondContact O-CB 3.33Å; W727-F730 PolarHBondContact O-N 3.43Å; V728-F730 VanDerWaalsContact C-N 3.29Å; V728-F730 PolarHBondContact O-N 3.28Å; F730-F734 VanDerWaalsContact O-CB 3.24Å; F730-F734 WeakPolarHBondContact O-CB 3.32Å; F730-F734 PolarHBondContact O-N 3.48Å
731	L	81.3	Confident	80.1	Confident	19 Å²	19	54.5 Å²	54.5	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-62.3	-51	174.5	174.1	62	0	0	0	110.7	W727 V728 S733 F734 L735 Y783	W727-L731 HydrophobicContact CZ3-CD2 3.94Å; W727-L731 PolarHBondContact O-N 3.19Å; V728-L731 WeakPolarHBondContact O-CB 3.42Å; V728-L731 PolarHBondContact O-N 3.48Å; L731-S733 PolarHBondContact O-N 3.29Å; L731-F734 PolarHBondContact O-N 3.47Å; L731-L735 HydrophobicContact CD1-CD1 3.79Å; L731-L735 HydrophobicContact CD1-CG 4Å; L731-L735 HydrophobicContact CG-CD1 3.97Å; L731-L735 WeakPolarHBondContact O-CG 3.26Å; L731-L735 PolarHBondContact O-N 3.16Å; L731-Y783 HydrophobicContact CB-CE2 4.44Å; L731-Y783 HydrophobicContact CD1-CD1 3.78Å; L731-Y783 HydrophobicContact CD1-CD2 3.98Å; L731-Y783 HydrophobicContact CD1-CE1 3.7Å; L731-Y783 HydrophobicContact CD1-CE2 3.89Å; L731-Y783 HydrophobicContact CD1-CG 3.92Å
732	T	84.6	Confident	80.9	Confident	65 Å²	65	50 Å²	50	40%	0.399	26%	0.264	S	S	.	.	H	α-helix	trans	-64.9	-42.1	179.7	57.5	0	0	0	0	112	V728 T729 F734 L735 I736	V728-T732 HydrophobicContact CG1-CG2 4.28Å; V728-T732 PolarHBondContact O-N 3.43Å; V728-T732 PolarHBondContact O-OG1 3.4Å; T729-T732 PolarHBondContact O-OG1 2.76Å; T732-F734 VanDerWaalsContact C-N 3.32Å; T732-F734 PolarHBondContact O-N 3.43Å; T732-L735 PolarHBondContact O-N 3.05Å; T732-I736 WeakPolarHBondContact O-CB 3.32Å; T732-I736 WeakPolarHBondContact O-CD1 3.49Å; T732-I736 WeakPolarHBondContact O-CG1 3.47Å; T732-I736 PolarHBondContact O-N 2.92Å
733	S	86.3	Confident	81.8	Confident	75 Å²	75	56.2 Å²	56.2	52%	0.524	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-40	174.6	179.3	0	0	0	0	112.5	T729 L731 R737	T729-S733 WeakPolarHBondContact O-CB 3.21Å; T729-S733 PolarHBondContact O-N 3.49Å; L731-S733 PolarHBondContact O-N 3.29Å; S733-R737 WeakPolarHBondContact O-CB 3.47Å; S733-R737 PolarHBondContact O-N 2.88Å; S733-R737 VanDerWaalsContact O-N 3.09Å
734	F	86.5	Confident	82.6	Confident	12 Å²	12	60.4 Å²	60.4	5%	0.053	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-47.8	175.8	178.5	-87.6	0	0	0	112	M704 A708 F730 L731 T732 R737 A738 A779 C782 Y783	M704-F734 HydrophobicContact CE-CD2 4.29Å; M704-F734 HydrophobicContact CE-CE2 4Å; M704-F734 HydrophobicContact CE-CZ 4.23Å; A708-F734 HydrophobicContact CB-CD2 4.25Å; A708-F734 HydrophobicContact CB-CE2 3.87Å; F730-F734 VanDerWaalsContact O-CB 3.24Å; F730-F734 WeakPolarHBondContact O-CB 3.32Å; F730-F734 PolarHBondContact O-N 3.48Å; L731-F734 PolarHBondContact O-N 3.47Å; T732-F734 VanDerWaalsContact C-N 3.32Å; T732-F734 PolarHBondContact O-N 3.43Å; F734-R737 PolarHBondContact O-N 2.87Å; F734-A738 PolarHBondContact O-N 3.05Å; F734-A779 WeakPolarHBondContact CE1-O 3.28Å; F734-C782 HydrophobicContact CE1-CB 4.32Å; F734-C782 HydrophobicContact CZ-CB 3.9Å; F734-Y783 HydrophobicContact CB-CD2 4.35Å; F734-Y783 AromaticContact CD1-CD2 3.67Å; F734-Y783 HydrophobicContact CD1-CD2 3.67Å; F734-Y783 HydrophobicContact CD1-CG 4.31Å; F734-Y783 HydrophobicContact CE1-CD2 4.08Å; F734-Y783 HydrophobicContact CE1-CG 4.43Å; F734-Y783 AromaticContact CG-CD2 3.92Å; F734-Y783 HydrophobicContact CG-CD2 3.92Å
735	L	87	Confident	83.5	Confident	34 Å²	34	59.5 Å²	59.5	18%	0.178	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-45.3	179.6	-70.3	173.8	0	0	0	111.8	L731 T732 R737 A738 L739 A779 T780	L731-L735 HydrophobicContact CD1-CD1 3.79Å; L731-L735 HydrophobicContact CD1-CG 4Å; L731-L735 HydrophobicContact CG-CD1 3.97Å; L731-L735 WeakPolarHBondContact O-CG 3.26Å; L731-L735 PolarHBondContact O-N 3.16Å; T732-L735 PolarHBondContact O-N 3.05Å; L735-R737 VanDerWaalsContact C-N 3.34Å; L735-R737 PolarHBondContact O-N 2.78Å; L735-A738 WeakPolarHBondContact O-CB 3.47Å; L735-A738 PolarHBondContact O-N 3Å; L735-A738 VanDerWaalsContact O-N 3.17Å; L735-L739 WeakPolarHBondContact O-CB 3.4Å; L735-L739 VanDerWaalsContact O-CG 3.32Å; L735-L739 WeakPolarHBondContact O-CG 3.43Å; L735-L739 PolarHBondContact O-N 2.76Å; L735-A779 HydrophobicContact CD2-CB 4.03Å; L735-T780 HydrophobicContact CD2-CG2 4.17Å
736	I	90.4	Very high	84.1	Confident	108 Å²	108	57.8 Å²	57.8	55%	0.554	29%	0.294	S	S	*	.	H	α-helix	trans	-60	-45.3	176.2	-67.5	164	0	0	0	110.4	T732 A738 L739 V740	T732-I736 WeakPolarHBondContact O-CB 3.32Å; T732-I736 WeakPolarHBondContact O-CD1 3.49Å; T732-I736 WeakPolarHBondContact O-CG1 3.47Å; T732-I736 PolarHBondContact O-N 2.92Å; I736-A738 VanDerWaalsContact C-N 3.3Å; I736-A738 PolarHBondContact O-N 3.16Å; I736-L739 PolarHBondContact O-N 2.84Å; I736-V740 HydrophobicContact CG2-CG2 4.37Å; I736-V740 VanDerWaalsContact O-CG2 3.32Å; I736-V740 WeakPolarHBondContact O-CG2 3.34Å; I736-V740 PolarHBondContact O-N 2.82Å
737	R	88.7	Confident	84.6	Confident	73 Å²	73	54 Å²	54	28%	0.275	28%	0.284	S	S	.	.	H	α-helix	trans	-61.5	-37.5	176.8	-176.4	170.8	68	-172.1	-1.8	112.2	M704 E711 S733 F734 L735 I741	M704-R737 HydrophobicContact CE-CB 4.15Å; M704-R737 HydrophobicContact CE-CG 3.96Å; M704-R737 HydrophobicContact SD-CG 3.98Å; E711-R737 IonicContact OE1-CZ 2.68Å; E711-R737 IonicContact OE1-NH1 2.78Å; E711-R737 PolarHBondContact OE1-NH1 3.39Å; E711-R737 IonicContact OE1-NH2 3.84Å; E711-R737 IonicContact OE2-CZ 3.44Å; E711-R737 IonicContact OE2-NH1 3.46Å; E711-R737 IonicContact OE2-NH2 3.92Å; E711-R737 PolarHBondContact OE2-NH2 3.24Å; S733-R737 WeakPolarHBondContact O-CB 3.47Å; S733-R737 PolarHBondContact O-N 2.88Å; S733-R737 VanDerWaalsContact O-N 3.09Å; F734-R737 PolarHBondContact O-N 2.87Å; L735-R737 VanDerWaalsContact C-N 3.34Å; L735-R737 PolarHBondContact O-N 2.78Å; R737-I741 HydrophobicContact CG-CD1 4.35Å; R737-I741 WeakPolarHBondContact O-CD1 3.5Å; R737-I741 WeakPolarHBondContact O-CG1 3.47Å
738	A	87.5	Confident	85.1	Confident	1 Å²	1	53 Å²	53	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-66.7	-53.2	176.2	0	0	0	0	0	111.5	M704 F734 L735 I736 V740 I741 Y742 A779	M704-A738 HydrophobicContact CE-CB 3.78Å; F734-A738 PolarHBondContact O-N 3.05Å; L735-A738 WeakPolarHBondContact O-CB 3.47Å; L735-A738 PolarHBondContact O-N 3Å; L735-A738 VanDerWaalsContact O-N 3.17Å; I736-A738 VanDerWaalsContact C-N 3.3Å; I736-A738 PolarHBondContact O-N 3.16Å; A738-V740 PolarHBondContact O-N 3.28Å; A738-I741 PolarHBondContact O-N 2.86Å; A738-I741 VanDerWaalsContact O-N 3.16Å; A738-Y742 HydrophobicContact CB-CD2 4.37Å; A738-Y742 HydrophobicContact CB-CE2 4.14Å; A738-Y742 WeakPolarHBondContact O-CD2 3.42Å; A738-Y742 PolarHBondContact O-N 2.89Å; A738-A779 HydrophobicContact CB-CB 3.63Å
739	L	88.7	Confident	85.3	Confident	64 Å²	64	50.5 Å²	50.5	34%	0.335	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-37.9	-175.3	-67.5	171.9	0	0	0	112.6	L735 I736 I741 Y742 F743 V776	L735-L739 WeakPolarHBondContact O-CB 3.4Å; L735-L739 VanDerWaalsContact O-CG 3.32Å; L735-L739 WeakPolarHBondContact O-CG 3.43Å; L735-L739 PolarHBondContact O-N 2.76Å; I736-L739 PolarHBondContact O-N 2.84Å; L739-I741 VanDerWaalsContact C-N 3.35Å; L739-I741 PolarHBondContact O-N 2.92Å; L739-Y742 PolarHBondContact O-N 3.19Å; L739-F743 WeakPolarHBondContact O-CB 3.3Å; L739-F743 PolarHBondContact O-N 2.81Å; L739-V776 HydrophobicContact CD2-CG2 3.88Å
740	V	89.8	Confident	85.2	Confident	82 Å²	82	49.5 Å²	49.5	50%	0.497	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-40.1	175.2	170.6	0	0	0	0	111.8	I736 A738 L744	I736-V740 HydrophobicContact CG2-CG2 4.37Å; I736-V740 VanDerWaalsContact O-CG2 3.32Å; I736-V740 WeakPolarHBondContact O-CG2 3.34Å; I736-V740 PolarHBondContact O-N 2.82Å; A738-V740 PolarHBondContact O-N 3.28Å; V740-L744 HydrophobicContact CG1-CD1 4.23Å; V740-L744 WeakPolarHBondContact O-CG 3.21Å; V740-L744 PolarHBondContact O-N 3.23Å
741	I	87.8	Confident	85.3	Confident	29 Å²	29	55.2 Å²	55.2	15%	0.149	28%	0.282	C	S	.	.	H	α-helix	trans	-68.7	-45.6	178.2	-69.3	169.8	0	0	0	110.4	H700 M704 R737 A738 L739 L744 S745	H700-I741 HydrophobicContact CB-CG2 4.25Å; H700-I741 WeakPolarHBondContact ND1-CG2 3.39Å; M704-I741 HydrophobicContact SD-CD1 3.69Å; R737-I741 HydrophobicContact CG-CD1 4.35Å; R737-I741 WeakPolarHBondContact O-CD1 3.5Å; R737-I741 WeakPolarHBondContact O-CG1 3.47Å; A738-I741 PolarHBondContact O-N 2.86Å; A738-I741 VanDerWaalsContact O-N 3.16Å; L739-I741 VanDerWaalsContact C-N 3.35Å; L739-I741 PolarHBondContact O-N 2.92Å; I741-L744 PolarHBondContact O-N 3.35Å; I741-S745 PolarHBondContact O-N 3.13Å; I741-S745 VanDerWaalsContact O-N 3.09Å; I741-S745 PolarHBondContact O-OG 3.48Å
742	Y	89.3	Confident	84.9	Confident	1 Å²	1	56 Å²	56	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-65.8	-38	177.7	-66.8	-52.1	0	0	0	112.8	F697 H700 A738 L739 S745 G746 Y771 A778 A779	F697-Y742 HydrophobicContact CD1-CD1 4.02Å; F697-Y742 AromaticContact CD1-CE1 3.89Å; F697-Y742 HydrophobicContact CD1-CE1 3.89Å; F697-Y742 HydrophobicContact CE1-CD1 4.16Å; F697-Y742 HydrophobicContact CE1-CE1 4.44Å; H700-Y742 HydrophobicContact CB-CD1 4.08Å; H700-Y742 HydrophobicContact CB-CE1 3.62Å; A738-Y742 HydrophobicContact CB-CD2 4.37Å; A738-Y742 HydrophobicContact CB-CE2 4.14Å; A738-Y742 WeakPolarHBondContact O-CD2 3.42Å; A738-Y742 PolarHBondContact O-N 2.89Å; L739-Y742 PolarHBondContact O-N 3.19Å; Y742-S745 WeakPolarHBondContact CA-OG 3.4Å; Y742-S745 PolarHBondContact O-N 2.93Å; Y742-S745 PolarHBondContact O-OG 3.22Å; Y742-G746 PolarHBondContact O-N 3.02Å; Y742-Y771 WeakPolarHBondContact O-CE1 3.33Å; Y742-Y771 PolarHBondContact O-OH 3.09Å; Y742-Y771 VanDerWaalsContact O-OH 3.13Å; Y742-A778 HydrophobicContact CE2-CB 4.3Å; Y742-A779 HydrophobicContact CE2-CB 4.26Å
743	F	87.8	Confident	84.3	Confident	142 Å²	142	53.6 Å²	53.6	62%	0.623	27%	0.272	S	S	*	.	H	α-helix	trans	-60.9	-47.7	175.9	178.4	-99.2	0	0	0	111.5	L739 S745 G746 V747	L739-F743 WeakPolarHBondContact O-CB 3.3Å; L739-F743 PolarHBondContact O-N 2.81Å; F743-S745 PolarHBondContact O-N 2.89Å; F743-G746 PolarHBondContact O-N 3.49Å; F743-V747 HydrophobicContact CD1-CG2 4.46Å; F743-V747 HydrophobicContact CE1-CG2 4.04Å; F743-V747 HydrophobicContact CE2-CG2 4.37Å; F743-V747 HydrophobicContact CZ-CG2 3.99Å; F743-V747 WeakPolarHBondContact O-CG2 3.48Å; F743-V747 PolarHBondContact O-N 3.4Å
744	L	86.7	Confident	83.5	Confident	90 Å²	90	54.2 Å²	54.2	47%	0.471	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-38.8	177.7	-70.5	171.1	0	0	0	112.5	V740 I741 I748	V740-L744 HydrophobicContact CG1-CD1 4.23Å; V740-L744 WeakPolarHBondContact O-CG 3.21Å; V740-L744 PolarHBondContact O-N 3.23Å; I741-L744 PolarHBondContact O-N 3.35Å; L744-I748 WeakPolarHBondContact O-CG1 3.33Å; L744-I748 PolarHBondContact O-N 3.02Å
745	S	83.7	Confident	82.6	Confident	7 Å²	7	59.5 Å²	59.5	5%	0.049	30%	0.298	C	S	.	.	H	α-helix	trans	-67.9	-36.4	173.5	56.3	0	0	0	0	112.6	H700 I741 Y742 F743 I748 L749 Y771	H700-S745 VanDerWaalsContact NE2-CB 3.31Å; H700-S745 WeakPolarHBondContact NE2-CB 3.38Å; I741-S745 PolarHBondContact O-N 3.13Å; I741-S745 VanDerWaalsContact O-N 3.09Å; I741-S745 PolarHBondContact O-OG 3.48Å; Y742-S745 WeakPolarHBondContact CA-OG 3.4Å; Y742-S745 PolarHBondContact O-N 2.93Å; Y742-S745 PolarHBondContact O-OG 3.22Å; F743-S745 PolarHBondContact O-N 2.89Å; S745-I748 PolarHBondContact O-N 2.77Å; S745-L749 VanDerWaalsContact O-CB 3.24Å; S745-L749 WeakPolarHBondContact O-CB 3.47Å; S745-L749 PolarHBondContact O-N 2.78Å; S745-Y771 PolarHBondContact OG-OH 3.12Å
746	G	83.3	Confident	81.5	Confident	3 Å²	3	60.8 Å²	60.8	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-45.9	177.2	0	0	0	0	0	112.5	Y742 F743 I748 L749 F750 Y771	Y742-G746 PolarHBondContact O-N 3.02Å; F743-G746 PolarHBondContact O-N 3.49Å; G746-I748 VanDerWaalsContact C-N 3.33Å; G746-I748 PolarHBondContact O-N 3.25Å; G746-L749 WeakPolarHBondContact O-CB 3.47Å; G746-L749 PolarHBondContact O-N 3.29Å; G746-F750 WeakPolarHBondContact O-CD2 3.2Å; G746-F750 PolarHBondContact O-N 2.77Å; G746-Y771 VanDerWaalsContact CA-CE1 3.45Å; G746-Y771 VanDerWaalsContact CA-CZ 3.48Å; G746-Y771 PolarHBondContact N-OH 3.07Å
747	V	83.5	Confident	79.9	Confident	81 Å²	81	59.6 Å²	59.6	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-58.3	-44.6	177.5	172.4	0	0	0	0	111.6	F743 Y751	F743-V747 HydrophobicContact CD1-CG2 4.46Å; F743-V747 HydrophobicContact CE1-CG2 4.04Å; F743-V747 HydrophobicContact CE2-CG2 4.37Å; F743-V747 HydrophobicContact CZ-CG2 3.99Å; F743-V747 WeakPolarHBondContact O-CG2 3.48Å; F743-V747 PolarHBondContact O-N 3.4Å; V747-Y751 WeakPolarHBondContact O-CB 3.32Å; V747-Y751 PolarHBondContact O-N 3.4Å; V747-Y751 VanDerWaalsContact O-N 3.08Å
748	I	82.2	Confident	78.6	Confident	70 Å²	70	57.8 Å²	57.8	36%	0.359	31%	0.31	S	S	.	.	H	α-helix	trans	-66.3	-41.5	178	-62.2	165.7	0	0	0	110.9	I89 L744 S745 G746 Y751 V752	I89-I748 HydrophobicContact CD1-CG2 3.76Å; L744-I748 WeakPolarHBondContact O-CG1 3.33Å; L744-I748 PolarHBondContact O-N 3.02Å; S745-I748 PolarHBondContact O-N 2.77Å; G746-I748 VanDerWaalsContact C-N 3.33Å; G746-I748 PolarHBondContact O-N 3.25Å; I748-Y751 PolarHBondContact O-N 2.93Å; I748-V752 WeakPolarHBondContact O-CG2 3.43Å; I748-V752 PolarHBondContact O-N 2.97Å; I748-V752 VanDerWaalsContact O-N 3.15Å
749	L	78.8	Confident	77.5	Confident	10 Å²	10	58.7 Å²	58.7	5%	0.052	32%	0.315	C	S	.	.	H	α-helix	trans	-64.2	-47.6	179.8	-174	67	0	0	0	111.9	F693 F696 S745 G746 Y751 V752 L753 Y771	F693-L749 HydrophobicContact CD1-CD1 3.99Å; F693-L749 HydrophobicContact CD1-CD2 3.66Å; F693-L749 HydrophobicContact CD1-CG 4.2Å; F693-L749 HydrophobicContact CE1-CD1 3.8Å; F693-L749 HydrophobicContact CE1-CD2 3.77Å; F693-L749 HydrophobicContact CE1-CG 3.9Å; F696-L749 HydrophobicContact CD2-CD1 4Å; F696-L749 HydrophobicContact CE2-CD1 3.79Å; F696-L749 HydrophobicContact CZ-CD1 4.15Å; S745-L749 VanDerWaalsContact O-CB 3.24Å; S745-L749 WeakPolarHBondContact O-CB 3.47Å; S745-L749 PolarHBondContact O-N 2.78Å; G746-L749 WeakPolarHBondContact O-CB 3.47Å; G746-L749 PolarHBondContact O-N 3.29Å; L749-Y751 VanDerWaalsContact C-N 3.35Å; L749-Y751 PolarHBondContact O-N 3.32Å; L749-V752 PolarHBondContact O-N 3.46Å; L749-L753 HydrophobicContact CG-CD1 4.1Å; L749-L753 VanDerWaalsContact O-CG 3.29Å; L749-L753 WeakPolarHBondContact O-CG 3.4Å; L749-L753 PolarHBondContact O-N 2.85Å; L749-Y771 HydrophobicContact CD2-CD2 4.32Å; L749-Y771 HydrophobicContact CD2-CE2 3.78Å
750	F	78.3	Confident	76.4	Confident	30 Å²	30	58.9 Å²	58.9	13%	0.132	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-35.2	177.4	-73.9	-60.5	0	0	0	112.7	G746 V752 L753 L754 S767 I768 Y771	G746-F750 WeakPolarHBondContact O-CD2 3.2Å; G746-F750 PolarHBondContact O-N 2.77Å; F750-V752 PolarHBondContact O-N 2.74Å; F750-L753 HydrophobicContact CD1-CD1 4.01Å; F750-L753 HydrophobicContact CE1-CD1 4.3Å; F750-L753 PolarHBondContact O-N 3.4Å; F750-L754 VanDerWaalsContact O-CG 3.28Å; F750-L754 WeakPolarHBondContact O-CG 3.4Å; F750-L754 PolarHBondContact O-N 2.74Å; F750-S767 WeakPolarHBondContact CE1-OG 3.42Å; F750-I768 HydrophobicContact CD1-CG1 4.45Å; F750-I768 HydrophobicContact CD2-CG1 4.01Å; F750-I768 HydrophobicContact CE1-CG1 4.29Å; F750-I768 HydrophobicContact CE2-CB 4.45Å; F750-I768 HydrophobicContact CE2-CG1 3.82Å; F750-I768 HydrophobicContact CG-CG1 4.35Å; F750-I768 HydrophobicContact CZ-CG1 3.97Å; F750-Y771 HydrophobicContact CE2-CD1 4.22Å; F750-Y771 HydrophobicContact CE2-CD2 4.42Å; F750-Y771 AromaticContact CE2-CG 3.93Å; F750-Y771 HydrophobicContact CE2-CG 3.93Å; F750-Y771 HydrophobicContact CZ-CD2 4.47Å; F750-Y771 HydrophobicContact CZ-CG 4.15Å
751	Y	78.3	Confident	75.3	Confident	164 Å²	164	63.5 Å²	63.5	64%	0.643	33%	0.332	S	S	*	.	H	α-helix	trans	-59.1	-45.6	172.2	179.8	-103.8	0	0	0	111.8	V747 I748 L749 L754 D755	V747-Y751 WeakPolarHBondContact O-CB 3.32Å; V747-Y751 PolarHBondContact O-N 3.4Å; V747-Y751 VanDerWaalsContact O-N 3.08Å; I748-Y751 PolarHBondContact O-N 2.93Å; L749-Y751 VanDerWaalsContact C-N 3.35Å; L749-Y751 PolarHBondContact O-N 3.32Å; Y751-L754 PolarHBondContact O-N 2.72Å; Y751-D755 WeakPolarHBondContact O-CB 3.4Å; Y751-D755 PolarHBondContact O-N 3.43Å; Y751-D755 VanDerWaalsContact O-N 3.14Å
752	V	74.4	Confident	74.2	Confident	36 Å²	36	63.8 Å²	63.8	22%	0.218	34%	0.343	C	S	.	.	H	α-helix	trans	-66.4	-38.5	176.5	174.2	0	0	0	0	112.2	I748 L749 F750 L754 D755 V756	I748-V752 WeakPolarHBondContact O-CG2 3.43Å; I748-V752 PolarHBondContact O-N 2.97Å; I748-V752 VanDerWaalsContact O-N 3.15Å; L749-V752 PolarHBondContact O-N 3.46Å; F750-V752 PolarHBondContact O-N 2.74Å; V752-L754 VanDerWaalsContact C-N 3.35Å; V752-L754 PolarHBondContact O-N 2.84Å; V752-D755 PolarHBondContact O-N 3.12Å; V752-V756 HydrophobicContact CG1-CG2 4.4Å; V752-V756 VanDerWaalsContact O-CG2 3.24Å; V752-V756 WeakPolarHBondContact O-CG2 3.5Å; V752-V756 PolarHBondContact O-N 3.42Å
753	L	70.6	Confident	73.4	Confident	13 Å²	13	63.9 Å²	63.9	7%	0.068	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-33	179.7	-69.5	163.6	0	0	0	113.3	L689 F693 L749 F750 V758 I759	L689-L753 HydrophobicContact CD1-CD2 4.42Å; F693-L753 HydrophobicContact CE1-CD1 3.78Å; F693-L753 HydrophobicContact CE1-CD2 4.14Å; F693-L753 HydrophobicContact CE1-CG 4.43Å; F693-L753 HydrophobicContact CZ-CD1 3.67Å; F693-L753 HydrophobicContact CZ-CD2 3.87Å; F693-L753 HydrophobicContact CZ-CG 4.39Å; L749-L753 HydrophobicContact CG-CD1 4.1Å; L749-L753 VanDerWaalsContact O-CG 3.29Å; L749-L753 WeakPolarHBondContact O-CG 3.4Å; L749-L753 PolarHBondContact O-N 2.85Å; F750-L753 HydrophobicContact CD1-CD1 4.01Å; F750-L753 HydrophobicContact CE1-CD1 4.3Å; F750-L753 PolarHBondContact O-N 3.4Å; L753-V758 HydrophobicContact CD2-CB 4.43Å; L753-V758 PolarHBondContact O-N 2.73Å; L753-I759 HydrophobicContact CB-CD1 4.02Å; L753-I759 HydrophobicContact CB-CG1 4.43Å; L753-I759 HydrophobicContact CD1-CD1 3.84Å; L753-I759 HydrophobicContact CD2-CD1 4.43Å; L753-I759 HydrophobicContact CG-CD1 4.33Å
754	L	71.1	Confident	72.9	Confident	88 Å²	88	58.4 Å²	58.4	46%	0.461	32%	0.321	S	S	.	.	H	α-helix	trans	-71.4	-44.2	174.5	-71.1	168	0	0	0	111.4	F750 Y751 V752 V756 A757 V764	F750-L754 VanDerWaalsContact O-CG 3.28Å; F750-L754 WeakPolarHBondContact O-CG 3.4Å; F750-L754 PolarHBondContact O-N 2.74Å; Y751-L754 PolarHBondContact O-N 2.72Å; V752-L754 VanDerWaalsContact C-N 3.35Å; V752-L754 PolarHBondContact O-N 2.84Å; L754-V756 VanDerWaalsContact C-N 3.27Å; L754-V756 PolarHBondContact O-N 3.24Å; L754-A757 PolarHBondContact O-N 2.8Å; L754-A757 VanDerWaalsContact O-N 3.08Å; L754-V764 HydrophobicContact CD2-CG2 3.8Å
755	D	67.1	Low	72.6	Confident	124 Å²	124	59.7 Å²	59.7	66%	0.663	33%	0.328	S	S	*	.	H	α-helix	trans	-62.7	-32.2	179.7	-164.7	46.4	0	0	0	112.7	Y751 V752 A757	Y751-D755 WeakPolarHBondContact O-CB 3.4Å; Y751-D755 PolarHBondContact O-N 3.43Å; Y751-D755 VanDerWaalsContact O-N 3.14Å; V752-D755 PolarHBondContact O-N 3.12Å; D755-A757 VanDerWaalsContact C-N 3.32Å
756	V	62.5	Low	72.4	Confident	61 Å²	61	60.7 Å²	60.7	37%	0.37	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	3.3	178.7	-175.2	0	0	0	0	112.2	L96 V752 L754 V758	L96-V756 HydrophobicContact CD1-CG1 4.35Å; L96-V756 HydrophobicContact CD1-CG2 4.09Å; L96-V756 HydrophobicContact CD2-CG1 3.94Å; V752-V756 HydrophobicContact CG1-CG2 4.4Å; V752-V756 VanDerWaalsContact O-CG2 3.24Å; V752-V756 WeakPolarHBondContact O-CG2 3.5Å; V752-V756 PolarHBondContact O-N 3.42Å; L754-V756 VanDerWaalsContact C-N 3.27Å; L754-V756 PolarHBondContact O-N 3.24Å; V756-V758 HydrophobicContact CB-CG2 3.9Å; V756-V758 HydrophobicContact CG1-CG2 3.63Å; V756-V758 PolarHBondContact O-N 3.38Å
757	A	58.6	Low	72.3	Confident	82 Å²	82	61 Å²	61	68%	0.678	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	34.1	-179.7	0	0	0	0	0	114.7	L754 D755	L754-A757 PolarHBondContact O-N 2.8Å; L754-A757 VanDerWaalsContact O-N 3.08Å; D755-A757 VanDerWaalsContact C-N 3.32Å
758	V	60.7	Low	72.3	Confident	36 Å²	36	60.8 Å²	60.8	22%	0.218	33%	0.328	C	S	.	.			trans	-82.1	-21.2	-178.4	-176.6	0	0	0	0	112.2	L686 L689 L753 V756	L686-V758 HydrophobicContact CD2-CG1 4.06Å; L689-V758 HydrophobicContact CD2-CG1 4.14Å; L753-V758 HydrophobicContact CD2-CB 4.43Å; L753-V758 PolarHBondContact O-N 2.73Å; V756-V758 HydrophobicContact CB-CG2 3.9Å; V756-V758 HydrophobicContact CG1-CG2 3.63Å; V756-V758 PolarHBondContact O-N 3.38Å
759	I	63.7	Low	72.6	Confident	20 Å²	20	60.2 Å²	60.2	10%	0.103	33%	0.327	C	S	.	.	S	Bend	trans	-132.7	119.4	-171.6	-59.3	-174.6	0	0	0	109.5	L753 T763 V764	L753-I759 HydrophobicContact CB-CD1 4.02Å; L753-I759 HydrophobicContact CB-CG1 4.43Å; L753-I759 HydrophobicContact CD1-CD1 3.84Å; L753-I759 HydrophobicContact CD2-CD1 4.43Å; L753-I759 HydrophobicContact CG-CD1 4.33Å; I759-T763 WeakPolarHBondContact CG2-OG1 3.18Å; I759-V764 HydrophobicContact CG2-CG2 3.83Å
760	N	66.1	Low	73	Confident	67 Å²	67	60 Å²	60	36%	0.358	33%	0.326	S	S	.	.			trans	-71.3	147.3	177	-64.8	-4.6	0	0	0	111.1	G762 T763 V764 A848	N760-G762 VanDerWaalsContact C-N 3.27Å; N760-G762 PolarHBondContact O-N 2.73Å; N760-G762 VanDerWaalsContact O-N 3.11Å; N760-T763 PolarHBondContact N-OG1 3.28Å; N760-T763 PolarHBondContact O-N 3.23Å; N760-T763 PolarHBondContact O-OG1 3.22Å; N760-V764 PolarHBondContact O-N 3.13Å; N760-A848 PolarHBondContact ND2-O 3.06Å
761	E	65.9	Low	73.4	Confident	180 Å²	180	59.2 Å²	59.2	84%	0.841	32%	0.322	S	S	*	.	H	α-helix	trans	-48.1	-45.2	-176.9	-61.3	-170	161.6	0	0	113.3	T763 V764	E761-T763 PolarHBondContact O-N 3.47Å; E761-T763 VanDerWaalsContact O-N 3.09Å; E761-V764 PolarHBondContact O-N 2.83Å
762	G	65.3	Low	74	Confident	35 Å²	35	53.7 Å²	53.7	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-64.8	-8.6	178	0	0	0	0	0	116.2	N760	N760-G762 VanDerWaalsContact C-N 3.27Å; N760-G762 PolarHBondContact O-N 2.73Å; N760-G762 VanDerWaalsContact O-N 3.11Å
763	T	73.7	Confident	74.7	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.018	30%	0.303	C	S	.	.	H	α-helix	trans	-109.7	-14.7	177.2	62.1	0	0	0	0	113.5	I759 N760 E761 L765 W766 S767 A848	I759-T763 WeakPolarHBondContact CG2-OG1 3.18Å; N760-T763 PolarHBondContact N-OG1 3.28Å; N760-T763 PolarHBondContact O-N 3.23Å; N760-T763 PolarHBondContact O-OG1 3.22Å; E761-T763 PolarHBondContact O-N 3.47Å; E761-T763 VanDerWaalsContact O-N 3.09Å; T763-L765 PolarHBondContact O-N 3.42Å; T763-W766 PolarHBondContact O-N 2.78Å; T763-S767 PolarHBondContact O-N 3.07Å; T763-S767 VanDerWaalsContact O-N 3.17Å; T763-A848 HydrophobicContact CG2-CB 4.5Å
764	V	76.4	Confident	75.6	Confident	27 Å²	27	52 Å²	52	16%	0.164	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-47.5	-177	178.2	0	0	0	0	111.6	L754 I759 N760 E761 W766 S767 I768	L754-V764 HydrophobicContact CD2-CG2 3.8Å; I759-V764 HydrophobicContact CG2-CG2 3.83Å; N760-V764 PolarHBondContact O-N 3.13Å; E761-V764 PolarHBondContact O-N 2.83Å; V764-W766 VanDerWaalsContact C-N 3.32Å; V764-W766 PolarHBondContact O-N 2.71Å; V764-S767 PolarHBondContact O-N 3.37Å; V764-S767 PolarHBondContact O-OG 3.5Å; V764-I768 HydrophobicContact CG1-CD1 3.81Å; V764-I768 HydrophobicContact CG1-CG1 4.45Å; V764-I768 WeakPolarHBondContact O-CG1 3.46Å; V764-I768 PolarHBondContact O-N 2.92Å
765	L	80.6	Confident	76.5	Confident	117 Å²	117	48.3 Å²	48.3	61%	0.613	28%	0.283	S	S	*	.	H	α-helix	trans	-55.2	-45.7	-177.8	179.5	62.4	0	0	0	112.6	T763 I768 V769	T763-L765 PolarHBondContact O-N 3.42Å; L765-I768 PolarHBondContact O-N 3.2Å; L765-V769 WeakPolarHBondContact O-CG2 3.4Å; L765-V769 PolarHBondContact O-N 3.24Å
766	W	80.5	Confident	77.7	Confident	28 Å²	28	44.7 Å²	44.7	11%	0.106	27%	0.266	C	S	.	.	H	α-helix	trans	-73.8	-33.1	-178.3	-69.4	106	0	0	0	113.1	T763 V764 I768 V769 L770 L854 W856 L859	T763-W766 PolarHBondContact O-N 2.78Å; V764-W766 VanDerWaalsContact C-N 3.32Å; V764-W766 PolarHBondContact O-N 2.71Å; W766-I768 VanDerWaalsContact C-N 3.31Å; W766-I768 PolarHBondContact O-N 2.86Å; W766-V769 HydrophobicContact CE3-CB 4.39Å; W766-V769 HydrophobicContact CE3-CG1 4.41Å; W766-V769 HydrophobicContact CZ3-CG1 4.46Å; W766-V769 PolarHBondContact O-N 2.84Å; W766-L770 WeakPolarHBondContact O-CB 3.49Å; W766-L770 PolarHBondContact O-N 3.23Å; W766-L854 HydrophobicContact CB-CD2 3.59Å; W766-L854 VanDerWaalsContact CD1-CD2 3.48Å; W766-L854 HydrophobicContact CD2-CD2 4.04Å; W766-L854 HydrophobicContact CG-CB 4.46Å; W766-L854 HydrophobicContact CG-CD2 3.39Å; W766-L854 HydrophobicContact CG-CG 4.49Å; W766-L854 PolarHBondContact NE1-O 2.71Å; W766-W856 HydrophobicContact CH2-CD2 4.19Å; W766-W856 AromaticContact CH2-CE3 3.9Å; W766-W856 HydrophobicContact CH2-CE3 3.9Å; W766-W856 AromaticContact CH2-CH2 3.76Å; W766-W856 HydrophobicContact CH2-CH2 3.76Å; W766-W856 HydrophobicContact CH2-CZ2 4.03Å; W766-W856 AromaticContact CH2-CZ3 3.69Å; W766-W856 HydrophobicContact CH2-CZ3 3.69Å; W766-W856 HydrophobicContact CZ2-CD2 4.04Å; W766-W856 HydrophobicContact CZ2-CE3 4.21Å; W766-W856 HydrophobicContact CZ2-CH2 4.35Å; W766-W856 HydrophobicContact CZ2-CZ2 4.17Å; W766-W856 HydrophobicContact CZ2-CZ3 4.36Å; W766-L859 HydrophobicContact CD2-CD2 3.99Å; W766-L859 HydrophobicContact CE3-CD2 3.91Å; W766-L859 HydrophobicContact CH2-CD1 3.47Å; W766-L859 VanDerWaalsContact CH2-CD1 3.47Å; W766-L859 HydrophobicContact CH2-CD2 4.28Å; W766-L859 HydrophobicContact CH2-CG 4.44Å; W766-L859 HydrophobicContact CZ2-CD1 3.71Å; W766-L859 HydrophobicContact CZ2-CD2 4.32Å; W766-L859 HydrophobicContact CZ2-CG 4.4Å; W766-L859 HydrophobicContact CZ3-CD1 3.93Å; W766-L859 HydrophobicContact CZ3-CD2 4.06Å
767	S	79.9	Confident	79	Confident	9 Å²	9	41.8 Å²	41.8	6%	0.063	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-38.9	170	74	0	0	0	0	112.1	F750 T763 V764 L770 Y771	F750-S767 WeakPolarHBondContact CE1-OG 3.42Å; T763-S767 PolarHBondContact O-N 3.07Å; T763-S767 VanDerWaalsContact O-N 3.17Å; V764-S767 PolarHBondContact O-N 3.37Å; V764-S767 PolarHBondContact O-OG 3.5Å; S767-L770 PolarHBondContact O-N 2.77Å; S767-Y771 WeakPolarHBondContact O-CB 3.44Å; S767-Y771 PolarHBondContact O-N 3.03Å
768	I	84.3	Confident	80.5	Confident	77 Å²	77	38.1 Å²	38.1	40%	0.395	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-44.6	175.8	-67.4	167	0	0	0	110.8	F750 V764 L765 W766 Y771 A772	F750-I768 HydrophobicContact CD1-CG1 4.45Å; F750-I768 HydrophobicContact CD2-CG1 4.01Å; F750-I768 HydrophobicContact CE1-CG1 4.29Å; F750-I768 HydrophobicContact CE2-CB 4.45Å; F750-I768 HydrophobicContact CE2-CG1 3.82Å; F750-I768 HydrophobicContact CG-CG1 4.35Å; F750-I768 HydrophobicContact CZ-CG1 3.97Å; V764-I768 HydrophobicContact CG1-CD1 3.81Å; V764-I768 HydrophobicContact CG1-CG1 4.45Å; V764-I768 WeakPolarHBondContact O-CG1 3.46Å; V764-I768 PolarHBondContact O-N 2.92Å; L765-I768 PolarHBondContact O-N 3.2Å; W766-I768 VanDerWaalsContact C-N 3.31Å; W766-I768 PolarHBondContact O-N 2.86Å; I768-Y771 PolarHBondContact O-N 3.07Å; I768-A772 WeakPolarHBondContact O-CB 3.47Å; I768-A772 PolarHBondContact O-N 3.26Å
769	V	87	Confident	81.9	Confident	58 Å²	58	36.4 Å²	36.4	35%	0.352	21%	0.207	S	C	.	.	H	α-helix	trans	-61.6	-44.9	176.8	171.6	0	0	0	0	111.3	L765 W766 A772 S773 L875	L765-V769 WeakPolarHBondContact O-CG2 3.4Å; L765-V769 PolarHBondContact O-N 3.24Å; W766-V769 HydrophobicContact CE3-CB 4.39Å; W766-V769 HydrophobicContact CE3-CG1 4.41Å; W766-V769 HydrophobicContact CZ3-CG1 4.46Å; W766-V769 PolarHBondContact O-N 2.84Å; V769-A772 PolarHBondContact O-N 2.99Å; V769-S773 PolarHBondContact O-N 3.15Å; V769-S773 PolarHBondContact O-OG 3.36Å; V769-L875 HydrophobicContact CG1-CD2 4.2Å
770	L	87.2	Confident	83.2	Confident	5 Å²	5	35.6 Å²	35.6	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-47.4	175.8	-168.4	74.4	0	0	0	110.6	W766 S767 A772 S773 C774 W837 L875 L878	W766-L770 WeakPolarHBondContact O-CB 3.49Å; W766-L770 PolarHBondContact O-N 3.23Å; S767-L770 PolarHBondContact O-N 2.77Å; L770-A772 PolarHBondContact O-N 3.26Å; L770-S773 PolarHBondContact O-N 3.17Å; L770-S773 PolarHBondContact O-OG 2.68Å; L770-C774 WeakPolarHBondContact O-CB 3.32Å; L770-C774 PolarHBondContact O-N 2.97Å; L770-W837 HydrophobicContact CB-CZ3 4.07Å; L770-W837 HydrophobicContact CD2-CE3 3.87Å; L770-W837 HydrophobicContact CD2-CH2 4.43Å; L770-W837 HydrophobicContact CD2-CZ3 3.64Å; L770-W837 HydrophobicContact CG-CE3 3.76Å; L770-W837 HydrophobicContact CG-CZ3 3.6Å; L770-L875 HydrophobicContact CD1-CD2 3.86Å; L770-L875 HydrophobicContact CD1-CG 4.35Å; L770-L878 HydrophobicContact CD1-CD1 4.3Å
771	Y	88.5	Confident	84.4	Confident	13 Å²	13	33 Å²	33	5%	0.051	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-42.7	179.4	-174.7	-87.6	0	0	0	112.2	F697 Y742 S745 G746 L749 F750 S767 I768 C774 S775 W837	F697-Y771 HydrophobicContact CE1-CE2 4.09Å; F697-Y771 AromaticContact CE2-CD2 3.98Å; F697-Y771 HydrophobicContact CE2-CD2 3.98Å; F697-Y771 AromaticContact CE2-CE2 3.74Å; F697-Y771 HydrophobicContact CE2-CE2 3.74Å; F697-Y771 AromaticContact CZ-CD2 3.59Å; F697-Y771 HydrophobicContact CZ-CD2 3.59Å; F697-Y771 HydrophobicContact CZ-CE1 4.45Å; F697-Y771 AromaticContact CZ-CE2 3.32Å; F697-Y771 HydrophobicContact CZ-CE2 3.32Å; F697-Y771 HydrophobicContact CZ-CG 4.27Å; F697-Y771 AromaticContact CZ-CZ 3.79Å; Y742-Y771 WeakPolarHBondContact O-CE1 3.33Å; Y742-Y771 PolarHBondContact O-OH 3.09Å; Y742-Y771 VanDerWaalsContact O-OH 3.13Å; S745-Y771 PolarHBondContact OG-OH 3.12Å; G746-Y771 VanDerWaalsContact CA-CE1 3.45Å; G746-Y771 VanDerWaalsContact CA-CZ 3.48Å; G746-Y771 PolarHBondContact N-OH 3.07Å; L749-Y771 HydrophobicContact CD2-CD2 4.32Å; L749-Y771 HydrophobicContact CD2-CE2 3.78Å; F750-Y771 HydrophobicContact CE2-CD1 4.22Å; F750-Y771 HydrophobicContact CE2-CD2 4.42Å; F750-Y771 AromaticContact CE2-CG 3.93Å; F750-Y771 HydrophobicContact CE2-CG 3.93Å; F750-Y771 HydrophobicContact CZ-CD2 4.47Å; F750-Y771 HydrophobicContact CZ-CG 4.15Å; S767-Y771 WeakPolarHBondContact O-CB 3.44Å; S767-Y771 PolarHBondContact O-N 3.03Å; I768-Y771 PolarHBondContact O-N 3.07Å; Y771-C774 PolarHBondContact O-N 3.1Å; Y771-S775 PolarHBondContact O-N 2.75Å; Y771-W837 AromaticContact CD2-CH2 3.95Å; Y771-W837 HydrophobicContact CD2-CH2 3.95Å; Y771-W837 HydrophobicContact CD2-CZ2 4.5Å; Y771-W837 HydrophobicContact CD2-CZ3 4.49Å
772	A	89	Confident	85.6	Confident	48 Å²	48	24.5 Å²	24.5	40%	0.397	15%	0.149	S	C	.	.	H	α-helix	trans	-60.7	-46.8	176.1	0	0	0	0	0	111.5	I768 V769 L770 C774 S775 V776	I768-A772 WeakPolarHBondContact O-CB 3.47Å; I768-A772 PolarHBondContact O-N 3.26Å; V769-A772 PolarHBondContact O-N 2.99Å; L770-A772 PolarHBondContact O-N 3.26Å; A772-C774 PolarHBondContact O-N 3.42Å; A772-S775 PolarHBondContact O-N 3.31Å; A772-S775 PolarHBondContact O-OG 3.46Å; A772-V776 PolarHBondContact O-N 3.2Å
773	S	90.3	Very high	86.7	Confident	7 Å²	7	23.5 Å²	23.5	5%	0.049	14%	0.135	C	C	.	.	H	α-helix	trans	-63.7	-40.9	177.6	70.7	0	0	0	0	112.8	V769 L770 S775 V776 A777 L878	V769-S773 PolarHBondContact O-N 3.15Å; V769-S773 PolarHBondContact O-OG 3.36Å; L770-S773 PolarHBondContact O-N 3.17Å; L770-S773 PolarHBondContact O-OG 2.68Å; S773-S775 PolarHBondContact O-N 2.75Å; S773-V776 PolarHBondContact O-N 3.16Å; S773-A777 PolarHBondContact O-N 3.38Å; S773-A777 VanDerWaalsContact O-N 3.12Å; S773-L878 VanDerWaalsContact OG-CD1 3.28Å; S773-L878 WeakPolarHBondContact OG-CD1 3.41Å
774	C	89.3	Confident	87.4	Confident	7 Å²	7	24.7 Å²	24.7	5%	0.047	14%	0.141	C	C	.	.	H	α-helix	trans	-60.6	-41.6	172.6	-177.4	0	0	0	0	112	F697 L770 Y771 A772 V776 A777 A778 W837 L878	F697-C774 HydrophobicContact CE2-CB 4.46Å; F697-C774 HydrophobicContact CZ-CB 4.02Å; F697-C774 VanDerWaalsContact CZ-SG 3.57Å; L770-C774 WeakPolarHBondContact O-CB 3.32Å; L770-C774 PolarHBondContact O-N 2.97Å; Y771-C774 PolarHBondContact O-N 3.1Å; A772-C774 PolarHBondContact O-N 3.42Å; C774-V776 VanDerWaalsContact C-N 3.28Å; C774-V776 PolarHBondContact O-N 3.14Å; C774-A777 PolarHBondContact O-N 3.36Å; C774-A778 WeakPolarHBondContact O-CB 3.45Å; C774-A778 PolarHBondContact O-N 2.9Å; C774-W837 HydrophobicContact CB-CB 4.5Å; C774-W837 HydrophobicContact CB-CD2 4.1Å; C774-W837 HydrophobicContact CB-CE3 3.58Å; C774-W837 HydrophobicContact CB-CG 4.48Å; C774-W837 HydrophobicContact CB-CZ3 4.26Å; C774-L878 HydrophobicContact CB-CD1 4.43Å
775	S	90	Very high	87.9	Confident	11 Å²	11	24.2 Å²	24.2	8%	0.077	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-35.7	179.2	80.9	0	0	0	0	113.1	Y771 A772 S773 A779	Y771-S775 PolarHBondContact O-N 2.75Å; A772-S775 PolarHBondContact O-N 3.31Å; A772-S775 PolarHBondContact O-OG 3.46Å; S773-S775 PolarHBondContact O-N 2.75Å; S775-A779 VanDerWaalsContact O-CB 3.25Å; S775-A779 WeakPolarHBondContact O-CB 3.47Å; S775-A779 PolarHBondContact O-N 3.41Å
776	V	91.7	Very high	88.2	Confident	48 Å²	48	20.4 Å²	20.4	29%	0.291	12%	0.115	S	C	.	.	H	α-helix	trans	-71.1	-45	175	179.3	0	0	0	0	110.7	L739 A772 S773 C774 A779 T780	L739-V776 HydrophobicContact CD2-CG2 3.88Å; A772-V776 PolarHBondContact O-N 3.2Å; S773-V776 PolarHBondContact O-N 3.16Å; C774-V776 VanDerWaalsContact C-N 3.28Å; C774-V776 PolarHBondContact O-N 3.14Å; V776-A779 PolarHBondContact O-N 3.03Å; V776-T780 WeakPolarHBondContact O-CG2 3.48Å; V776-T780 PolarHBondContact O-N 3.45Å; V776-T780 PolarHBondContact O-OG1 3.02Å
777	A	91.3	Very high	88.3	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60	-48.9	175.4	0	0	0	0	0	111.6	S773 C774 A779 T780 Q781 P833 L878	S773-A777 PolarHBondContact O-N 3.38Å; S773-A777 VanDerWaalsContact O-N 3.12Å; C774-A777 PolarHBondContact O-N 3.36Å; A777-A779 PolarHBondContact O-N 3.37Å; A777-T780 PolarHBondContact O-N 2.88Å; A777-T780 PolarHBondContact O-OG1 3.08Å; A777-Q781 WeakPolarHBondContact O-CB 3.02Å; A777-Q781 PolarHBondContact O-N 3.49Å; A777-P833 HydrophobicContact CB-CB 3.83Å; A777-P833 HydrophobicContact CB-CG 4.45Å; A777-L878 HydrophobicContact CB-CD2 3.94Å
778	A	89.7	Confident	88.3	Confident	4 Å²	4	22 Å²	22	3%	0.033	13%	0.128	C	C	.	.	H	α-helix	trans	-61.3	-40.3	176.8	0	0	0	0	0	112.7	F697 Y742 C774 C782	F697-A778 HydrophobicContact CD1-CB 4.5Å; Y742-A778 HydrophobicContact CE2-CB 4.3Å; C774-A778 WeakPolarHBondContact O-CB 3.45Å; C774-A778 PolarHBondContact O-N 2.9Å; A778-C782 WeakPolarHBondContact O-CB 2.98Å; A778-C782 PolarHBondContact O-N 2.67Å; A778-C782 PolarHBondContact O-SG 3.4Å
779	A	90.7	Very high	88	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-63	-46.9	175.5	0	0	0	0	0	112	F734 L735 A738 Y742 S775 V776 A777 C782 Y783	F734-A779 WeakPolarHBondContact CE1-O 3.28Å; L735-A779 HydrophobicContact CD2-CB 4.03Å; A738-A779 HydrophobicContact CB-CB 3.63Å; Y742-A779 HydrophobicContact CE2-CB 4.26Å; S775-A779 VanDerWaalsContact O-CB 3.25Å; S775-A779 WeakPolarHBondContact O-CB 3.47Å; S775-A779 PolarHBondContact O-N 3.41Å; V776-A779 PolarHBondContact O-N 3.03Å; A777-A779 PolarHBondContact O-N 3.37Å; A779-C782 PolarHBondContact O-N 3.46Å; A779-Y783 PolarHBondContact O-N 2.89Å; A779-Y783 VanDerWaalsContact O-N 3.11Å
780	T	90.8	Very high	87.1	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-67.8	-38	179.1	58.9	0	0	0	0	112.3	L735 V776 A777 C782 Y783 L784 S882 N885 I886	L735-T780 HydrophobicContact CD2-CG2 4.17Å; V776-T780 WeakPolarHBondContact O-CG2 3.48Å; V776-T780 PolarHBondContact O-N 3.45Å; V776-T780 PolarHBondContact O-OG1 3.02Å; A777-T780 PolarHBondContact O-N 2.88Å; A777-T780 PolarHBondContact O-OG1 3.08Å; T780-C782 VanDerWaalsContact C-N 3.35Å; T780-C782 PolarHBondContact O-N 2.83Å; T780-Y783 WeakPolarHBondContact O-CB 3.4Å; T780-Y783 PolarHBondContact O-N 3.29Å; T780-Y783 VanDerWaalsContact O-N 3.15Å; T780-L784 PolarHBondContact O-N 3.39Å; T780-S882 WeakPolarHBondContact OG1-CA 3.41Å; T780-N885 PolarHBondContact OG1-ND2 3.45Å; T780-N885 VanDerWaalsContact OG1-ND2 3.1Å; T780-I886 HydrophobicContact CG2-CD1 3.71Å; T780-I886 HydrophobicContact CG2-CG1 3.6Å
781	Q	90.6	Very high	86.3	Confident	12 Å²	12	26.3 Å²	26.3	6%	0.056	16%	0.156	C	C	.	.	H	α-helix	trans	-62.6	-40.7	174.1	-164.2	-176.4	41.8	0	0	111.4	A777 Y783 L784 L785 N885	A777-Q781 WeakPolarHBondContact O-CB 3.02Å; A777-Q781 PolarHBondContact O-N 3.49Å; Q781-Y783 VanDerWaalsContact C-N 3.32Å; Q781-Y783 PolarHBondContact O-N 3.17Å; Q781-L784 PolarHBondContact O-N 3.32Å; Q781-L785 WeakPolarHBondContact O-CG 3.24Å; Q781-L785 PolarHBondContact O-N 2.86Å; Q781-N885 PolarHBondContact N-ND2 2.76Å
782	C	90.4	Very high	85.4	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.014	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-37.6	173.5	-70.1	0	0	0	0	112.5	S701 L705 F734 A778 A779 T780 Y786	S701-C782 VanDerWaalsContact CB-SG 3.56Å; L705-C782 HydrophobicContact CD2-CB 4.07Å; L705-C782 VanDerWaalsContact CD2-O 3.28Å; L705-C782 WeakPolarHBondContact CD2-O 3.26Å; L705-C782 HydrophobicContact CG-CB 4.4Å; F734-C782 HydrophobicContact CE1-CB 4.32Å; F734-C782 HydrophobicContact CZ-CB 3.9Å; A778-C782 WeakPolarHBondContact O-CB 2.98Å; A778-C782 PolarHBondContact O-N 2.67Å; A778-C782 PolarHBondContact O-SG 3.4Å; A779-C782 PolarHBondContact O-N 3.46Å; T780-C782 VanDerWaalsContact C-N 3.35Å; T780-C782 PolarHBondContact O-N 2.83Å; C782-Y786 WeakPolarHBondContact O-CB 3.23Å; C782-Y786 PolarHBondContact O-N 2.91Å
783	Y	88.9	Confident	84.4	Confident	13 Å²	13	29.1 Å²	29.1	5%	0.051	17%	0.17	C	C	.	.	H	α-helix	trans	-65.9	-41.6	176	-169	-102.5	0	0	0	112	L731 F734 A779 T780 Q781 Y786 T787 A889 D893	L731-Y783 HydrophobicContact CB-CE2 4.44Å; L731-Y783 HydrophobicContact CD1-CD1 3.78Å; L731-Y783 HydrophobicContact CD1-CD2 3.98Å; L731-Y783 HydrophobicContact CD1-CE1 3.7Å; L731-Y783 HydrophobicContact CD1-CE2 3.89Å; L731-Y783 HydrophobicContact CD1-CG 3.92Å; F734-Y783 HydrophobicContact CB-CD2 4.35Å; F734-Y783 AromaticContact CD1-CD2 3.67Å; F734-Y783 HydrophobicContact CD1-CD2 3.67Å; F734-Y783 HydrophobicContact CD1-CG 4.31Å; F734-Y783 HydrophobicContact CE1-CD2 4.08Å; F734-Y783 HydrophobicContact CE1-CG 4.43Å; F734-Y783 AromaticContact CG-CD2 3.92Å; F734-Y783 HydrophobicContact CG-CD2 3.92Å; A779-Y783 PolarHBondContact O-N 2.89Å; A779-Y783 VanDerWaalsContact O-N 3.11Å; T780-Y783 WeakPolarHBondContact O-CB 3.4Å; T780-Y783 PolarHBondContact O-N 3.29Å; T780-Y783 VanDerWaalsContact O-N 3.15Å; Q781-Y783 VanDerWaalsContact C-N 3.32Å; Q781-Y783 PolarHBondContact O-N 3.17Å; Y783-Y786 HydrophobicContact CD2-CD1 4.3Å; Y783-Y786 HydrophobicContact CE2-CD1 4.32Å; Y783-Y786 WeakPolarHBondContact O-CB 3.36Å; Y783-Y786 PolarHBondContact O-N 3.49Å; Y783-T787 HydrophobicContact CD1-CG2 4.17Å; Y783-T787 HydrophobicContact CE1-CG2 3.8Å; Y783-T787 WeakPolarHBondContact O-CG2 3.43Å; Y783-T787 PolarHBondContact O-N 3.23Å; Y783-T787 PolarHBondContact O-OG1 2.77Å; Y783-A889 HydrophobicContact CD1-CB 3.55Å; Y783-A889 HydrophobicContact CE1-CB 3.76Å; Y783-D893 PolarHBondContact OH-OD2 3.14Å
784	L	88.4	Confident	83.3	Confident	28 Å²	28	29.5 Å²	29.5	15%	0.147	17%	0.173	C	C	.	.	H	α-helix	trans	-61.9	-44	175.3	178.7	62.1	0	0	0	112.5	T780 Q781 Y786 T787 T788 N885 V888 A889 I892	T780-L784 PolarHBondContact O-N 3.39Å; Q781-L784 PolarHBondContact O-N 3.32Å; L784-Y786 VanDerWaalsContact C-N 3.31Å; L784-Y786 PolarHBondContact O-N 3.08Å; L784-T787 PolarHBondContact O-N 2.66Å; L784-T787 PolarHBondContact O-OG1 3.32Å; L784-T787 VanDerWaalsContact O-OG1 3.06Å; L784-T788 HydrophobicContact CD1-CG2 4.08Å; L784-T788 WeakPolarHBondContact O-CB 3.32Å; L784-T788 VanDerWaalsContact O-CG2 3.29Å; L784-T788 WeakPolarHBondContact O-CG2 3.47Å; L784-T788 PolarHBondContact O-N 3.11Å; L784-T788 VanDerWaalsContact O-N 3.15Å; L784-T788 PolarHBondContact O-OG1 3.21Å; L784-N885 WeakPolarHBondContact CD2-OD1 3.22Å; L784-V888 HydrophobicContact CD1-CB 4.02Å; L784-V888 HydrophobicContact CD1-CG1 3.59Å; L784-A889 HydrophobicContact CD1-CB 4.42Å; L784-I892 HydrophobicContact CD1-CD1 4.01Å
785	L	87.9	Confident	82.8	Confident	18 Å²	18	29.3 Å²	29.3	9%	0.094	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-35.5	175.1	-70.8	171.4	0	0	0	112.4	L705 Q781 T788 F789 A798 V802	L705-L785 HydrophobicContact CD1-CD1 4.33Å; L705-L785 HydrophobicContact CD2-CB 4.04Å; Q781-L785 WeakPolarHBondContact O-CG 3.24Å; Q781-L785 PolarHBondContact O-N 2.86Å; L785-T788 WeakPolarHBondContact CA-OG1 3.43Å; L785-T788 PolarHBondContact O-OG1 3.32Å; L785-F789 HydrophobicContact CD2-CD2 4.49Å; L785-F789 HydrophobicContact CD2-CE2 4.08Å; L785-F789 PolarHBondContact O-N 3.46Å; L785-A798 HydrophobicContact CD2-CB 4.29Å; L785-V802 HydrophobicContact CD1-CG2 4.49Å; L785-V802 HydrophobicContact CD2-CG2 4.26Å
786	Y	86.2	Confident	82.2	Confident	36 Å²	36	32 Å²	32	14%	0.141	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-40.1	176	161.3	-100.6	0	0	0	113.2	A708 R712 C782 Y783 L784	A708-Y786 HydrophobicContact CB-CD2 3.62Å; A708-Y786 HydrophobicContact CB-CE2 3.93Å; A708-Y786 HydrophobicContact CB-CG 4.14Å; A708-Y786 VanDerWaalsContact O-CE2 3.31Å; A708-Y786 WeakPolarHBondContact O-CE2 3.44Å; R712-Y786 HydrophobicContact CB-CE2 3.71Å; R712-Y786 HydrophobicContact CG-CE2 4.27Å; R712-Y786 PolarHBondContact NH1-O 3.45Å; C782-Y786 WeakPolarHBondContact O-CB 3.23Å; C782-Y786 PolarHBondContact O-N 2.91Å; Y783-Y786 HydrophobicContact CD2-CD1 4.3Å; Y783-Y786 HydrophobicContact CE2-CD1 4.32Å; Y783-Y786 WeakPolarHBondContact O-CB 3.36Å; Y783-Y786 PolarHBondContact O-N 3.49Å; L784-Y786 VanDerWaalsContact C-N 3.31Å; L784-Y786 PolarHBondContact O-N 3.08Å
787	T	81.4	Confident	81.1	Confident	6 Å²	6	30.9 Å²	30.9	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-73	-46	-179	53	0	0	0	0	111.7	R712 Y783 L784	R712-T787 PolarHBondContact NH1-O 2.7Å; Y783-T787 HydrophobicContact CD1-CG2 4.17Å; Y783-T787 HydrophobicContact CE1-CG2 3.8Å; Y783-T787 WeakPolarHBondContact O-CG2 3.43Å; Y783-T787 PolarHBondContact O-N 3.23Å; Y783-T787 PolarHBondContact O-OG1 2.77Å; L784-T787 PolarHBondContact O-N 2.66Å; L784-T787 PolarHBondContact O-OG1 3.32Å; L784-T787 VanDerWaalsContact O-OG1 3.06Å
788	T	79.9	Confident	80.6	Confident	65 Å²	65	31.6 Å²	31.6	40%	0.399	19%	0.185	S	C	.	.	H	α-helix	trans	-61	-46.5	-176.6	47.4	0	0	0	0	114.4	L784 L785 I892	L784-T788 HydrophobicContact CD1-CG2 4.08Å; L784-T788 WeakPolarHBondContact O-CB 3.32Å; L784-T788 VanDerWaalsContact O-CG2 3.29Å; L784-T788 WeakPolarHBondContact O-CG2 3.47Å; L784-T788 PolarHBondContact O-N 3.11Å; L784-T788 VanDerWaalsContact O-N 3.15Å; L784-T788 PolarHBondContact O-OG1 3.21Å; L785-T788 WeakPolarHBondContact CA-OG1 3.43Å; L785-T788 PolarHBondContact O-OG1 3.32Å; T788-I892 HydrophobicContact CG2-CD1 3.58Å
789	F	78.4	Confident	80.4	Confident	54 Å²	54	31.4 Å²	31.4	24%	0.237	18%	0.183	C	C	.	.			trans	-96.5	126.9	-172.2	-68.7	-77.6	0	0	0	113.2	R712 L785 V795 A798 W1359	R712-F789 PolarHBondContact NH1-O 3.21Å; L785-F789 HydrophobicContact CD2-CD2 4.49Å; L785-F789 HydrophobicContact CD2-CE2 4.08Å; L785-F789 PolarHBondContact O-N 3.46Å; F789-V795 HydrophobicContact CB-CB 4.48Å; F789-V795 HydrophobicContact CB-CG2 3.62Å; F789-V795 WeakPolarHBondContact O-CG2 2.99Å; F789-A798 HydrophobicContact CD2-CB 3.83Å; F789-A798 HydrophobicContact CE1-CB 4.38Å; F789-A798 HydrophobicContact CE2-CB 3.4Å; F789-A798 HydrophobicContact CG-CB 4.49Å; F789-A798 HydrophobicContact CZ-CB 3.71Å; F789-W1359 HydrophobicContact CE1-CH2 4.21Å
790	P	69.3	Low	79.8	Confident	100 Å²	100	33 Å²	33	65%	0.649	20%	0.195	S	C	*	.			trans	-86.5	-12.8	-172.1	32.7	-36.1	0	0	0	115.3
791	T	69.2	Low	79.3	Confident	77 Å²	77	34.8 Å²	34.8	47%	0.472	20%	0.204	S	C	.	.	S	Bend	trans	-117.7	146.4	-178.9	81.8	0	0	0	0	112.1	C793 S794 V795	T791-C793 VanDerWaalsContact C-N 3.32Å; T791-C793 PolarHBondContact O-N 2.79Å; T791-S794 PolarHBondContact N-OG 3.32Å; T791-S794 PolarHBondContact O-N 3.1Å; T791-S794 PolarHBondContact O-OG 3.47Å; T791-S794 WeakPolarHBondContact OG1-CB 3.49Å; T791-S794 PolarHBondContact OG1-N 3.48Å; T791-S794 PolarHBondContact OG1-OG 2.81Å; T791-V795 WeakPolarHBondContact O-CG2 3.35Å; T791-V795 PolarHBondContact O-N 3.33Å
792	L	71.2	Confident	79.1	Confident	40 Å²	40	35.7 Å²	35.7	21%	0.209	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-41.2	-178.6	-178	146.1	0	0	0	112.7	L706 A709 R710 V795 M796	L706-L792 HydrophobicContact CD1-CD1 4.22Å; L706-L792 HydrophobicContact CD1-CD2 4.42Å; A709-L792 HydrophobicContact CB-CB 4.21Å; A709-L792 HydrophobicContact CB-CD1 4.14Å; A709-L792 HydrophobicContact CB-CG 4.01Å; R710-L792 HydrophobicContact CB-CD1 4.27Å; L792-V795 PolarHBondContact O-N 3.17Å; L792-M796 HydrophobicContact CD2-SD 3.8Å; L792-M796 WeakPolarHBondContact O-CG 3.29Å; L792-M796 PolarHBondContact O-N 3.49Å; L792-M796 VanDerWaalsContact O-N 3.15Å
793	C	66.7	Low	78.7	Confident	79 Å²	79	36.3 Å²	36.3	53%	0.534	21%	0.212	S	C	.	.	H	α-helix	trans	-66.1	-40.6	177.7	-56.2	0	0	0	0	112.4	T791 M796 A797	T791-C793 VanDerWaalsContact C-N 3.32Å; T791-C793 PolarHBondContact O-N 2.79Å; C793-M796 PolarHBondContact O-N 2.79Å; C793-A797 WeakPolarHBondContact O-CB 3.28Å; C793-A797 PolarHBondContact O-N 3.18Å
794	S	67.8	Low	78.3	Confident	16 Å²	16	40.2 Å²	40.2	11%	0.112	23%	0.233	C	C	.	.	H	α-helix	trans	-67.2	-38	177.4	53	0	0	0	0	112.6	T791 A798	T791-S794 PolarHBondContact N-OG 3.32Å; T791-S794 PolarHBondContact O-N 3.1Å; T791-S794 PolarHBondContact O-OG 3.47Å; T791-S794 WeakPolarHBondContact OG1-CB 3.49Å; T791-S794 PolarHBondContact OG1-N 3.48Å; T791-S794 PolarHBondContact OG1-OG 2.81Å; S794-A798 VanDerWaalsContact O-CB 3.24Å; S794-A798 WeakPolarHBondContact O-CB 3.45Å; S794-A798 PolarHBondContact O-N 3.46Å
795	V	78	Confident	78	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-47.8	176.2	175	0	0	0	0	110.5	L705 A709 F789 T791 L792 G799	L705-V795 HydrophobicContact CB-CG1 4.08Å; L705-V795 HydrophobicContact CD2-CG1 3.89Å; L705-V795 HydrophobicContact CG-CG1 4.43Å; A709-V795 HydrophobicContact CB-CB 4.37Å; A709-V795 HydrophobicContact CB-CG1 4.34Å; A709-V795 HydrophobicContact CB-CG2 4.42Å; F789-V795 HydrophobicContact CB-CB 4.48Å; F789-V795 HydrophobicContact CB-CG2 3.62Å; F789-V795 WeakPolarHBondContact O-CG2 2.99Å; T791-V795 WeakPolarHBondContact O-CG2 3.35Å; T791-V795 PolarHBondContact O-N 3.33Å; L792-V795 PolarHBondContact O-N 3.17Å; V795-G799 PolarHBondContact O-N 3.44Å
796	M	77.2	Confident	77.9	Confident	68 Å²	68	42.3 Å²	42.3	34%	0.335	24%	0.244	S	C	.	.	H	α-helix	trans	-66.2	-43.8	-179.9	-67.9	-177.7	73.6	0	0	112.6	L706 L792 C793 G799 S800	L706-M796 HydrophobicContact CD1-CE 4.4Å; L706-M796 HydrophobicContact CD1-SD 3.85Å; L792-M796 HydrophobicContact CD2-SD 3.8Å; L792-M796 WeakPolarHBondContact O-CG 3.29Å; L792-M796 PolarHBondContact O-N 3.49Å; L792-M796 VanDerWaalsContact O-N 3.15Å; C793-M796 PolarHBondContact O-N 2.79Å; M796-G799 PolarHBondContact O-N 3.43Å; M796-S800 PolarHBondContact O-N 2.81Å; M796-S800 PolarHBondContact O-OG 2.77Å
797	A	69.7	Low	77.8	Confident	25 Å²	25	42.8 Å²	42.8	21%	0.207	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-47.5	178.4	0	0	0	0	0	111.5	C793 G799 S800 L801 F1363	C793-A797 WeakPolarHBondContact O-CB 3.28Å; C793-A797 PolarHBondContact O-N 3.18Å; A797-G799 PolarHBondContact O-N 2.82Å; A797-S800 PolarHBondContact O-N 3.5Å; A797-S800 PolarHBondContact O-OG 3.25Å; A797-L801 WeakPolarHBondContact O-CG 3.45Å; A797-L801 PolarHBondContact O-N 2.8Å; A797-F1363 HydrophobicContact CB-CZ 4.25Å
798	A	80.7	Confident	77.7	Confident	14 Å²	14	46.2 Å²	46.2	12%	0.116	27%	0.266	C	S	.	.	H	α-helix	trans	-60.6	-45.6	176.6	0	0	0	0	0	111.9	L785 F789 S794 S800 L801 V802	L785-A798 HydrophobicContact CD2-CB 4.29Å; F789-A798 HydrophobicContact CD2-CB 3.83Å; F789-A798 HydrophobicContact CE1-CB 4.38Å; F789-A798 HydrophobicContact CE2-CB 3.4Å; F789-A798 HydrophobicContact CG-CB 4.49Å; F789-A798 HydrophobicContact CZ-CB 3.71Å; S794-A798 VanDerWaalsContact O-CB 3.24Å; S794-A798 WeakPolarHBondContact O-CB 3.45Å; S794-A798 PolarHBondContact O-N 3.46Å; A798-S800 VanDerWaalsContact C-N 3.34Å; A798-S800 PolarHBondContact O-N 3.34Å; A798-L801 PolarHBondContact O-N 3.38Å; A798-V802 WeakPolarHBondContact O-CG2 3.23Å; A798-V802 PolarHBondContact O-N 2.86Å
799	G	84.3	Confident	77.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.4	-45.9	174.4	0	0	0	0	0	112.7	M702 V795 M796 A797 L801 V802 Y803	M702-G799 WeakPolarHBondContact CE-O 3.34Å; V795-G799 PolarHBondContact O-N 3.44Å; M796-G799 PolarHBondContact O-N 3.43Å; A797-G799 PolarHBondContact O-N 2.82Å; G799-L801 PolarHBondContact O-N 2.75Å; G799-V802 PolarHBondContact O-N 2.84Å; G799-Y803 PolarHBondContact O-N 3.35Å
800	S	79	Confident	78	Confident	36 Å²	36	42.3 Å²	42.3	25%	0.252	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-38.1	179	63.3	0	0	0	0	113.6	M796 A797 A798 I804	M796-S800 PolarHBondContact O-N 2.81Å; M796-S800 PolarHBondContact O-OG 2.77Å; A797-S800 PolarHBondContact O-N 3.5Å; A797-S800 PolarHBondContact O-OG 3.25Å; A798-S800 VanDerWaalsContact C-N 3.34Å; A798-S800 PolarHBondContact O-N 3.34Å; S800-I804 WeakPolarHBondContact O-CD1 3.3Å; S800-I804 VanDerWaalsContact O-CG1 3.31Å; S800-I804 WeakPolarHBondContact O-CG1 3.4Å; S800-I804 PolarHBondContact O-N 2.85Å
801	L	80	Confident	78.3	Confident	39 Å²	39	40.4 Å²	40.4	20%	0.204	23%	0.229	C	C	.	.	H	α-helix	trans	-68.5	-39.1	177.9	-73.2	172.5	0	0	0	112.4	A797 A798 G799 Y803 I804 I805 F1363 F1367	A797-L801 WeakPolarHBondContact O-CG 3.45Å; A797-L801 PolarHBondContact O-N 2.8Å; A798-L801 PolarHBondContact O-N 3.38Å; G799-L801 PolarHBondContact O-N 2.75Å; L801-Y803 VanDerWaalsContact C-N 3.34Å; L801-Y803 PolarHBondContact O-N 2.74Å; L801-I804 PolarHBondContact O-N 3.02Å; L801-I805 HydrophobicContact CB-CD1 4.29Å; L801-I805 VanDerWaalsContact O-CB 3.27Å; L801-I805 WeakPolarHBondContact O-CB 3.45Å; L801-I805 WeakPolarHBondContact O-CD1 3.24Å; L801-I805 WeakPolarHBondContact O-CG1 3.46Å; L801-I805 PolarHBondContact O-N 2.96Å; L801-F1363 HydrophobicContact CD1-CE1 3.98Å; L801-F1367 HydrophobicContact CD2-CE2 3.66Å; L801-F1367 HydrophobicContact CD2-CZ 3.81Å
802	V	86.1	Confident	78.7	Confident	32 Å²	32	40.1 Å²	40.1	19%	0.194	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-42.2	179.2	167.4	0	0	0	0	111.7	L785 A798 G799 G806	L785-V802 HydrophobicContact CD1-CG2 4.49Å; L785-V802 HydrophobicContact CD2-CG2 4.26Å; A798-V802 WeakPolarHBondContact O-CG2 3.23Å; A798-V802 PolarHBondContact O-N 2.86Å; G799-V802 PolarHBondContact O-N 2.84Å; V802-G806 PolarHBondContact O-N 3.31Å
803	Y	83.4	Confident	79	Confident	14 Å²	14	38.5 Å²	38.5	6%	0.055	22%	0.219	C	C	.	.	H	α-helix	trans	-70.4	-43	176.9	-84.9	-92.9	0	0	0	112.9	F697 F698 S701 M702 G799 L801 G806 Y807 Q834	F697-Y803 HydrophobicContact CB-CE1 3.96Å; F698-Y803 HydrophobicContact CB-CD1 3.94Å; F698-Y803 HydrophobicContact CB-CE1 4.41Å; F698-Y803 HydrophobicContact CB-CG 4.25Å; F698-Y803 HydrophobicContact CD2-CD1 4.48Å; F698-Y803 HydrophobicContact CD2-CD2 4.35Å; F698-Y803 AromaticContact CD2-CG 3.94Å; F698-Y803 HydrophobicContact CD2-CG 3.94Å; S701-Y803 WeakPolarHBondContact CB-OH 3.33Å; S701-Y803 WeakPolarHBondContact OG-CE2 3.4Å; S701-Y803 VanDerWaalsContact OG-CZ 3.24Å; S701-Y803 PolarHBondContact OG-OH 2.93Å; M702-Y803 HydrophobicContact CE-CD2 3.94Å; M702-Y803 HydrophobicContact CE-CE2 4.25Å; G799-Y803 PolarHBondContact O-N 3.35Å; L801-Y803 VanDerWaalsContact C-N 3.34Å; L801-Y803 PolarHBondContact O-N 2.74Å; Y803-G806 PolarHBondContact O-N 3.45Å; Y803-Y807 PolarHBondContact O-N 3.42Å; Y803-Q834 HydrophobicContact CD1-CG 4.29Å; Y803-Q834 HydrophobicContact CE1-CG 4.49Å
804	I	79.1	Confident	79.3	Confident	96 Å²	96	37 Å²	37	49%	0.492	21%	0.205	S	C	.	.	H	α-helix	trans	-63.6	-48.2	177.9	-66.9	166.4	0	0	0	110.7	S800 L801 G806 Y807 V808	S800-I804 WeakPolarHBondContact O-CD1 3.3Å; S800-I804 VanDerWaalsContact O-CG1 3.31Å; S800-I804 WeakPolarHBondContact O-CG1 3.4Å; S800-I804 PolarHBondContact O-N 2.85Å; L801-I804 PolarHBondContact O-N 3.02Å; I804-G806 VanDerWaalsContact C-N 3.33Å; I804-G806 PolarHBondContact O-N 3.46Å; I804-Y807 PolarHBondContact O-N 3.47Å; I804-V808 HydrophobicContact CG2-CG2 4.36Å; I804-V808 WeakPolarHBondContact O-CB 3.41Å; I804-V808 WeakPolarHBondContact O-CG2 3.3Å; I804-V808 PolarHBondContact O-N 3.44Å
805	I	83.8	Confident	79.4	Confident	90 Å²	90	44 Å²	44	46%	0.462	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-42.3	177.5	-66.8	166.6	0	0	0	110	L801 Y807 V808 T809	L801-I805 HydrophobicContact CB-CD1 4.29Å; L801-I805 VanDerWaalsContact O-CB 3.27Å; L801-I805 WeakPolarHBondContact O-CB 3.45Å; L801-I805 WeakPolarHBondContact O-CD1 3.24Å; L801-I805 WeakPolarHBondContact O-CG1 3.46Å; L801-I805 PolarHBondContact O-N 2.96Å; I805-Y807 PolarHBondContact O-N 3.2Å; I805-V808 PolarHBondContact O-N 3.41Å; I805-T809 WeakPolarHBondContact O-CB 3.34Å; I805-T809 PolarHBondContact O-N 2.96Å; I805-T809 PolarHBondContact O-OG1 2.68Å
806	G	84.3	Confident	79	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-44	177.5	0	0	0	0	0	113.5	V802 Y803 I804 F810 L835	V802-G806 PolarHBondContact O-N 3.31Å; Y803-G806 PolarHBondContact O-N 3.45Å; I804-G806 VanDerWaalsContact C-N 3.33Å; I804-G806 PolarHBondContact O-N 3.46Å; G806-F810 PolarHBondContact O-N 2.93Å; G806-L835 WeakPolarHBondContact O-CD2 3.46Å
807	Y	83.6	Confident	78.5	Confident	45 Å²	45	45.9 Å²	45.9	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-72	-46.8	177.1	180	-105.2	0	0	0	112.7	F691 Y803 I804 I805 T809 F810 E811	F691-Y807 HydrophobicContact CB-CE2 3.88Å; F691-Y807 HydrophobicContact CD2-CD1 4.15Å; F691-Y807 HydrophobicContact CD2-CD2 4.41Å; F691-Y807 AromaticContact CD2-CE1 3.59Å; F691-Y807 HydrophobicContact CD2-CE1 3.59Å; F691-Y807 AromaticContact CD2-CE2 3.92Å; F691-Y807 HydrophobicContact CD2-CE2 3.92Å; F691-Y807 AromaticContact CD2-CZ 3.49Å; F691-Y807 VanDerWaalsContact CD2-CZ 3.49Å; F691-Y807 HydrophobicContact CE2-CE1 4.08Å; F691-Y807 HydrophobicContact CG-CE2 4.39Å; Y803-Y807 PolarHBondContact O-N 3.42Å; I804-Y807 PolarHBondContact O-N 3.47Å; I805-Y807 PolarHBondContact O-N 3.2Å; Y807-T809 VanDerWaalsContact C-N 3.27Å; Y807-T809 PolarHBondContact O-N 2.82Å; Y807-F810 HydrophobicContact CD2-CD1 4.49Å; Y807-F810 HydrophobicContact CE2-CD1 4.29Å; Y807-F810 WeakPolarHBondContact O-CB 3.29Å; Y807-F810 PolarHBondContact O-N 3.48Å; Y807-E811 HydrophobicContact CE1-CG 3.97Å; Y807-E811 HydrophobicContact CE2-CG 4.29Å; Y807-E811 WeakPolarHBondContact CE2-OE1 3.32Å; Y807-E811 PolarHBondContact O-N 2.96Å; Y807-E811 VanDerWaalsContact O-N 3.14Å; Y807-E811 PolarHBondContact OH-OE1 3.17Å
808	V	79.5	Confident	78	Confident	79 Å²	79	48.5 Å²	48.5	48%	0.479	25%	0.253	S	S	.	.	H	α-helix	trans	-62.3	-35.8	177.7	173.2	0	0	0	0	111.7	I804 I805 F810 E811 V812	I804-V808 HydrophobicContact CG2-CG2 4.36Å; I804-V808 WeakPolarHBondContact O-CB 3.41Å; I804-V808 WeakPolarHBondContact O-CG2 3.3Å; I804-V808 PolarHBondContact O-N 3.44Å; I805-V808 PolarHBondContact O-N 3.41Å; V808-F810 VanDerWaalsContact C-N 3.3Å; V808-F810 PolarHBondContact O-N 3.2Å; V808-E811 PolarHBondContact O-N 2.88Å; V808-V812 HydrophobicContact CG1-CG2 4.44Å; V808-V812 VanDerWaalsContact O-CG2 3.3Å; V808-V812 WeakPolarHBondContact O-CG2 3.24Å; V808-V812 PolarHBondContact O-N 2.63Å
809	T	81.7	Confident	77.3	Confident	36 Å²	36	54.1 Å²	54.1	22%	0.221	28%	0.282	C	S	.	.	H	α-helix	trans	-68.2	-31.8	176	-53.8	0	0	0	0	111.4	I805 Y807 I813 L835	I805-T809 WeakPolarHBondContact O-CB 3.34Å; I805-T809 PolarHBondContact O-N 2.96Å; I805-T809 PolarHBondContact O-OG1 2.68Å; Y807-T809 VanDerWaalsContact C-N 3.27Å; Y807-T809 PolarHBondContact O-N 2.82Å; T809-I813 HydrophobicContact CG2-CD1 3.81Å; T809-I813 HydrophobicContact CG2-CG1 4.37Å; T809-I813 WeakPolarHBondContact O-CD1 3.47Å; T809-I813 WeakPolarHBondContact O-CG1 3.34Å; T809-I813 PolarHBondContact O-N 3.33Å; T809-L835 HydrophobicContact CG2-CD1 4.14Å; T809-L835 HydrophobicContact CG2-CD2 4.05Å
810	F	83.6	Confident	76.5	Confident	1 Å²	1	56 Å²	56	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-51.1	173.4	163	-103.6	0	0	0	111.3	P690 G806 Y807 V808 V812 I813 L814 L835 N838 F839 V842	P690-F810 HydrophobicContact CB-CE1 4.34Å; P690-F810 HydrophobicContact CG-CZ 4.47Å; G806-F810 PolarHBondContact O-N 2.93Å; Y807-F810 HydrophobicContact CD2-CD1 4.49Å; Y807-F810 HydrophobicContact CE2-CD1 4.29Å; Y807-F810 WeakPolarHBondContact O-CB 3.29Å; Y807-F810 PolarHBondContact O-N 3.48Å; V808-F810 VanDerWaalsContact C-N 3.3Å; V808-F810 PolarHBondContact O-N 3.2Å; F810-V812 VanDerWaalsContact C-N 3.31Å; F810-V812 PolarHBondContact O-N 2.88Å; F810-I813 PolarHBondContact O-N 3.02Å; F810-I813 VanDerWaalsContact O-N 3.17Å; F810-L814 HydrophobicContact CE1-CD1 4.32Å; F810-L814 HydrophobicContact CE2-CD1 3.97Å; F810-L814 HydrophobicContact CZ-CD1 3.6Å; F810-L814 WeakPolarHBondContact O-CB 3.39Å; F810-L814 PolarHBondContact O-N 3.28Å; F810-L835 VanDerWaalsContact CA-CD2 3.5Å; F810-L835 HydrophobicContact CB-CD2 3.68Å; F810-L835 VanDerWaalsContact N-CD2 3.31Å; F810-N838 HydrophobicContact CB-CB 4.3Å; F810-N838 HydrophobicContact CD1-CB 3.93Å; F810-N838 VanDerWaalsContact CD1-ND2 3.34Å; F810-N838 WeakPolarHBondContact CD1-ND2 3.31Å; F810-N838 HydrophobicContact CD2-CB 3.35Å; F810-N838 HydrophobicContact CE1-CB 4.04Å; F810-N838 HydrophobicContact CE2-CB 3.49Å; F810-N838 VanDerWaalsContact CE2-CB 3.49Å; F810-N838 HydrophobicContact CG-CB 3.57Å; F810-N838 VanDerWaalsContact CG-ND2 3.33Å; F810-N838 WeakPolarHBondContact CG-ND2 3.48Å; F810-N838 HydrophobicContact CZ-CB 3.83Å; F810-F839 HydrophobicContact CD2-CD1 4.37Å; F810-F839 HydrophobicContact CD2-CD2 4.45Å; F810-F839 HydrophobicContact CD2-CE1 4.08Å; F810-F839 HydrophobicContact CD2-CE2 4.17Å; F810-F839 AromaticContact CD2-CZ 3.96Å; F810-F839 HydrophobicContact CD2-CZ 3.96Å; F810-F839 AromaticContact CE2-CD1 3.98Å; F810-F839 HydrophobicContact CE2-CD1 3.98Å; F810-F839 AromaticContact CE2-CE1 3.92Å; F810-F839 HydrophobicContact CE2-CE1 3.92Å; F810-F839 HydrophobicContact CE2-CG 4.38Å; F810-F839 HydrophobicContact CE2-CZ 4.28Å; F810-V842 HydrophobicContact CE2-CG2 4.3Å; F810-V842 HydrophobicContact CZ-CG2 3.76Å
811	E	76.1	Confident	76.1	Confident	59 Å²	59	56.5 Å²	56.5	28%	0.276	30%	0.301	S	S	.	.	H	α-helix	trans	-57.2	-43.2	177.6	-65.1	-63.3	154.6	0	0	111.9	Y807 V808 L814 Y815	Y807-E811 HydrophobicContact CE1-CG 3.97Å; Y807-E811 HydrophobicContact CE2-CG 4.29Å; Y807-E811 WeakPolarHBondContact CE2-OE1 3.32Å; Y807-E811 PolarHBondContact O-N 2.96Å; Y807-E811 VanDerWaalsContact O-N 3.14Å; Y807-E811 PolarHBondContact OH-OE1 3.17Å; V808-E811 PolarHBondContact O-N 2.88Å; E811-L814 PolarHBondContact O-N 3.24Å; E811-Y815 PolarHBondContact O-N 3.29Å
812	V	76.1	Confident	75.9	Confident	72 Å²	72	60.3 Å²	60.3	44%	0.436	31%	0.314	S	S	.	.	H	α-helix	trans	-65.3	-40.9	177	172.4	0	0	0	0	112.2	V808 F810 L814 F816	V808-V812 HydrophobicContact CG1-CG2 4.44Å; V808-V812 VanDerWaalsContact O-CG2 3.3Å; V808-V812 WeakPolarHBondContact O-CG2 3.24Å; V808-V812 PolarHBondContact O-N 2.63Å; F810-V812 VanDerWaalsContact C-N 3.31Å; F810-V812 PolarHBondContact O-N 2.88Å; V812-L814 VanDerWaalsContact C-N 3.34Å; V812-F816 HydrophobicContact CG1-CD2 3.93Å; V812-F816 HydrophobicContact CG1-CE2 4.27Å; V812-F816 VanDerWaalsContact O-CD2 3.32Å; V812-F816 WeakPolarHBondContact O-CD2 3.02Å; V812-F816 PolarHBondContact O-N 3.44Å; V812-F816 VanDerWaalsContact O-N 3.08Å
813	I	77.5	Confident	75.5	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-70.4	-33.3	176.8	-63.4	164.6	0	0	0	110.9	T809 F810 F816 F817 I820 Q825 L828 L835 F839	T809-I813 HydrophobicContact CG2-CD1 3.81Å; T809-I813 HydrophobicContact CG2-CG1 4.37Å; T809-I813 WeakPolarHBondContact O-CD1 3.47Å; T809-I813 WeakPolarHBondContact O-CG1 3.34Å; T809-I813 PolarHBondContact O-N 3.33Å; F810-I813 PolarHBondContact O-N 3.02Å; F810-I813 VanDerWaalsContact O-N 3.17Å; I813-F816 CarbonylContact O-C 3.47Å; I813-F816 PolarHBondContact O-N 3.48Å; I813-F817 HydrophobicContact CG2-CD2 4.47Å; I813-F817 WeakPolarHBondContact O-CA 3.12Å; I813-F817 WeakPolarHBondContact O-CB 3.38Å; I813-F817 PolarHBondContact O-N 2.94Å; I813-I820 HydrophobicContact CB-CD1 4.39Å; I813-I820 HydrophobicContact CG1-CD1 4.15Å; I813-I820 HydrophobicContact CG2-CD1 4.22Å; I813-Q825 HydrophobicContact CG2-CG 4.3Å; I813-L828 HydrophobicContact CD1-CD1 3.93Å; I813-L835 HydrophobicContact CD1-CD1 4.05Å; I813-L835 HydrophobicContact CD1-CD2 4.19Å; I813-F839 HydrophobicContact CB-CZ 4.04Å; I813-F839 HydrophobicContact CG2-CE2 4.31Å; I813-F839 HydrophobicContact CG2-CZ 3.61Å
814	L	74.5	Confident	75.4	Confident	46 Å²	46	66 Å²	66	24%	0.241	35%	0.346	C	S	.	.	H	α-helix	trans	-67.3	-39.1	176.7	-172	136.4	0	0	0	111.6	M687 F810 E811 V812	M687-L814 HydrophobicContact CE-CD1 4.26Å; M687-L814 HydrophobicContact CE-CD2 3.94Å; F810-L814 HydrophobicContact CE1-CD1 4.32Å; F810-L814 HydrophobicContact CE2-CD1 3.97Å; F810-L814 HydrophobicContact CZ-CD1 3.6Å; F810-L814 WeakPolarHBondContact O-CB 3.39Å; F810-L814 PolarHBondContact O-N 3.28Å; E811-L814 PolarHBondContact O-N 3.24Å; V812-L814 VanDerWaalsContact C-N 3.34Å
815	Y	68.6	Low	75.3	Confident	163 Å²	163	61.5 Å²	61.5	64%	0.639	32%	0.323	S	S	*	.	H	α-helix	trans	-67.4	-39.6	172.8	-173.7	-94	0	0	0	113.1	E811	E811-Y815 PolarHBondContact O-N 3.29Å
816	F	69.8	Low	75	Confident	90 Å²	90	60 Å²	60	40%	0.395	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	25.3	179.9	-68.8	-68.4	0	0	0	113.8	V812 I813 S818 N819 I820	V812-F816 HydrophobicContact CG1-CD2 3.93Å; V812-F816 HydrophobicContact CG1-CE2 4.27Å; V812-F816 VanDerWaalsContact O-CD2 3.32Å; V812-F816 WeakPolarHBondContact O-CD2 3.02Å; V812-F816 PolarHBondContact O-N 3.44Å; V812-F816 VanDerWaalsContact O-N 3.08Å; I813-F816 CarbonylContact O-C 3.47Å; I813-F816 PolarHBondContact O-N 3.48Å; F816-S818 VanDerWaalsContact C-N 3.32Å; F816-S818 PolarHBondContact O-N 2.91Å; F816-N819 PolarHBondContact O-N 3.42Å; F816-N819 VanDerWaalsContact O-N 3.07Å; F816-I820 HydrophobicContact CB-CD1 3.74Å; F816-I820 HydrophobicContact CB-CG1 4.16Å; F816-I820 WeakPolarHBondContact O-CG1 3.35Å; F816-I820 PolarHBondContact O-N 3.25Å
817	F	66.1	Low	75	Confident	21 Å²	21	63.8 Å²	63.8	9%	0.092	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-33.6	-165.5	-164.4	-85.7	0	0	0	114.3	I813 F839 F864 N866	I813-F817 HydrophobicContact CG2-CD2 4.47Å; I813-F817 WeakPolarHBondContact O-CA 3.12Å; I813-F817 WeakPolarHBondContact O-CB 3.38Å; I813-F817 PolarHBondContact O-N 2.94Å; F817-F839 HydrophobicContact CD2-CE1 4.03Å; F817-F839 HydrophobicContact CE2-CD1 4.3Å; F817-F839 AromaticContact CE2-CE1 3.74Å; F817-F839 HydrophobicContact CE2-CE1 3.74Å; F817-F839 HydrophobicContact CE2-CZ 4.36Å; F817-F864 HydrophobicContact CD1-CB 4.07Å; F817-F864 HydrophobicContact CD1-CD1 4.39Å; F817-F864 HydrophobicContact CD1-CG 4.43Å; F817-F864 HydrophobicContact CE1-CB 3.26Å; F817-F864 HydrophobicContact CE1-CD1 4.08Å; F817-F864 HydrophobicContact CE1-CD2 4.42Å; F817-F864 AromaticContact CE1-CG 3.7Å; F817-F864 HydrophobicContact CE1-CG 3.7Å; F817-F864 HydrophobicContact CE2-CD1 4.28Å; F817-F864 HydrophobicContact CE2-CD2 4.43Å; F817-F864 HydrophobicContact CE2-CG 4.21Å; F817-F864 HydrophobicContact CZ-CB 3.6Å; F817-F864 HydrophobicContact CZ-CD1 4.01Å; F817-F864 AromaticContact CZ-CD2 3.86Å; F817-F864 HydrophobicContact CZ-CD2 3.86Å; F817-F864 AromaticContact CZ-CG 3.56Å; F817-F864 HydrophobicContact CZ-CG 3.56Å; F817-N866 HydrophobicContact CE1-CB 4.03Å; F817-N866 PolarHBondContact O-ND2 2.87Å; F817-N866 VanDerWaalsContact O-ND2 3.17Å
818	S	61.2	Low	75	Confident	79 Å²	79	64.4 Å²	64.4	55%	0.552	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-37	175.6	52.3	0	0	0	0	112.7	F816 N866	F816-S818 VanDerWaalsContact C-N 3.32Å; F816-S818 PolarHBondContact O-N 2.91Å; S818-N866 PolarHBondContact O-ND2 3.46Å
819	N	64.9	Low	75	Confident	133 Å²	133	60.7 Å²	60.7	71%	0.711	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-15	-170.8	-71.6	-32	0	0	0	114.7	F816	F816-N819 PolarHBondContact O-N 3.42Å; F816-N819 VanDerWaalsContact O-N 3.07Å
820	I	68.7	Low	75.1	Confident	40 Å²	40	60.9 Å²	60.9	21%	0.205	32%	0.317	C	S	.	.	S	Bend	trans	-101	112.9	-174.8	-60.3	171.1	0	0	0	110.9	I813 F816 V824 Q825	I813-I820 HydrophobicContact CB-CD1 4.39Å; I813-I820 HydrophobicContact CG1-CD1 4.15Å; I813-I820 HydrophobicContact CG2-CD1 4.22Å; F816-I820 HydrophobicContact CB-CD1 3.74Å; F816-I820 HydrophobicContact CB-CG1 4.16Å; F816-I820 WeakPolarHBondContact O-CG1 3.35Å; F816-I820 PolarHBondContact O-N 3.25Å; I820-V824 HydrophobicContact CG2-CB 4.11Å; I820-V824 HydrophobicContact CG2-CG1 4.17Å; I820-Q825 HydrophobicContact CG2-CG 3.85Å; I820-Q825 PolarHBondContact O-NE2 3.34Å
821	G	70.1	Confident	75.1	Confident	45 Å²	45	66.3 Å²	66.3	46%	0.464	34%	0.341	S	S	.	.			trans	-59	140.1	179.4	0	0	0	0	0	114.6	I823 V824 Q825	G821-I823 VanDerWaalsContact C-N 3.26Å; G821-I823 PolarHBondContact O-N 2.93Å; G821-I823 VanDerWaalsContact O-N 3.08Å; G821-V824 WeakPolarHBondContact O-CB 3.42Å; G821-V824 PolarHBondContact O-N 3.45Å; G821-Q825 PolarHBondContact O-N 3.33Å
822	Y	75.2	Confident	75.5	Confident	120 Å²	120	65 Å²	65	47%	0.471	34%	0.336	S	S	.	.	H	α-helix	trans	-53.9	-34.4	-170.7	81.4	-84.7	0	0	0	115	V824 Q825 M826 N868	Y822-V824 VanDerWaalsContact C-N 3.29Å; Y822-V824 PolarHBondContact O-N 2.75Å; Y822-Q825 WeakPolarHBondContact O-CB 3.09Å; Y822-Q825 PolarHBondContact O-N 3.28Å; Y822-M826 PolarHBondContact O-N 3.18Å; Y822-N868 HydrophobicContact CG-CB 4.35Å
823	I	78.3	Confident	76	Confident	86 Å²	86	61.8 Å²	61.8	44%	0.441	32%	0.316	S	S	.	.	H	α-helix	trans	-61.3	-40.7	178.4	-59.5	177.1	0	0	0	110.5	G821 M826 I827	G821-I823 VanDerWaalsContact C-N 3.26Å; G821-I823 PolarHBondContact O-N 2.93Å; G821-I823 VanDerWaalsContact O-N 3.08Å; I823-M826 PolarHBondContact O-N 3.33Å; I823-I827 HydrophobicContact CG2-CD1 3.78Å; I823-I827 HydrophobicContact CG2-CG1 4.4Å; I823-I827 WeakPolarHBondContact O-CB 3.38Å; I823-I827 VanDerWaalsContact O-CG1 3.29Å; I823-I827 WeakPolarHBondContact O-CG1 3.5Å; I823-I827 PolarHBondContact O-N 3.02Å
824	V	80.7	Confident	76.4	Confident	79 Å²	79	62.1 Å²	62.1	48%	0.479	32%	0.317	S	S	.	.	H	α-helix	trans	-67.3	-43.6	179.3	-178.3	0	0	0	0	110	I820 G821 Y822 M826 I827 L828	I820-V824 HydrophobicContact CG2-CB 4.11Å; I820-V824 HydrophobicContact CG2-CG1 4.17Å; G821-V824 WeakPolarHBondContact O-CB 3.42Å; G821-V824 PolarHBondContact O-N 3.45Å; Y822-V824 VanDerWaalsContact C-N 3.29Å; Y822-V824 PolarHBondContact O-N 2.75Å; V824-M826 VanDerWaalsContact C-N 3.34Å; V824-M826 PolarHBondContact O-N 2.79Å; V824-I827 PolarHBondContact O-N 2.98Å; V824-L828 HydrophobicContact CG1-CD1 3.87Å; V824-L828 HydrophobicContact CG1-CG 4.37Å; V824-L828 WeakPolarHBondContact O-CB 3.39Å; V824-L828 VanDerWaalsContact O-CG 3.26Å; V824-L828 WeakPolarHBondContact O-CG 3.43Å; V824-L828 PolarHBondContact O-N 3.05Å
825	Q	76.2	Confident	77	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-58.8	-44.6	175.2	-56	-179.5	-9.9	0	0	111.6	I813 I820 G821 Y822 S829 Y869	I813-Q825 HydrophobicContact CG2-CG 4.3Å; I820-Q825 HydrophobicContact CG2-CG 3.85Å; I820-Q825 PolarHBondContact O-NE2 3.34Å; G821-Q825 PolarHBondContact O-N 3.33Å; Y822-Q825 WeakPolarHBondContact O-CB 3.09Å; Y822-Q825 PolarHBondContact O-N 3.28Å; Q825-S829 VanDerWaalsContact O-CB 3.3Å; Q825-S829 WeakPolarHBondContact O-CB 3.07Å; Q825-S829 PolarHBondContact O-N 3.31Å; Q825-S829 PolarHBondContact O-OG 3.36Å; Q825-Y869 HydrophobicContact CB-CD2 4.32Å; Q825-Y869 HydrophobicContact CB-CE2 4.36Å
826	M	78.3	Confident	77.9	Confident	57 Å²	57	52.1 Å²	52.1	28%	0.281	28%	0.275	S	S	.	.	H	α-helix	trans	-65.3	-45.9	177.9	-172.1	-174.9	71	0	0	112.2	Y822 I823 V824 L828 S829 I830 W873	Y822-M826 PolarHBondContact O-N 3.18Å; I823-M826 PolarHBondContact O-N 3.33Å; V824-M826 VanDerWaalsContact C-N 3.34Å; V824-M826 PolarHBondContact O-N 2.79Å; M826-L828 PolarHBondContact O-N 3.34Å; M826-S829 WeakPolarHBondContact O-CB 3.26Å; M826-S829 PolarHBondContact O-N 3.35Å; M826-I830 HydrophobicContact CG-CD1 4.29Å; M826-I830 WeakPolarHBondContact O-CG1 3.13Å; M826-I830 PolarHBondContact O-N 3.42Å; M826-W873 HydrophobicContact SD-CE3 4.28Å; M826-W873 HydrophobicContact SD-CZ3 4.31Å
827	I	83.9	Confident	78.8	Confident	81 Å²	81	48.3 Å²	48.3	42%	0.415	26%	0.258	S	S	.	.	H	α-helix	trans	-62	-45.4	177.9	-70.5	170.3	0	0	0	110.7	I823 V824 S829 I830 F831	I823-I827 HydrophobicContact CG2-CD1 3.78Å; I823-I827 HydrophobicContact CG2-CG1 4.4Å; I823-I827 WeakPolarHBondContact O-CB 3.38Å; I823-I827 VanDerWaalsContact O-CG1 3.29Å; I823-I827 WeakPolarHBondContact O-CG1 3.5Å; I823-I827 PolarHBondContact O-N 3.02Å; V824-I827 PolarHBondContact O-N 2.98Å; I827-S829 VanDerWaalsContact C-N 3.32Å; I827-S829 PolarHBondContact O-N 3.3Å; I827-I830 PolarHBondContact O-N 2.78Å; I827-F831 HydrophobicContact CG2-CD2 4.02Å; I827-F831 HydrophobicContact CG2-CE2 3.83Å; I827-F831 VanDerWaalsContact O-CD2 3.28Å; I827-F831 WeakPolarHBondContact O-CD2 3.28Å; I827-F831 PolarHBondContact O-N 3.12Å
828	L	83.4	Confident	79.7	Confident	58 Å²	58	47.3 Å²	47.3	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-41.6	176.4	-70.1	171.3	0	0	0	111.3	I813 V824 M826 I830 F831 L832 L835	I813-L828 HydrophobicContact CD1-CD1 3.93Å; V824-L828 HydrophobicContact CG1-CD1 3.87Å; V824-L828 HydrophobicContact CG1-CG 4.37Å; V824-L828 WeakPolarHBondContact O-CB 3.39Å; V824-L828 VanDerWaalsContact O-CG 3.26Å; V824-L828 WeakPolarHBondContact O-CG 3.43Å; V824-L828 PolarHBondContact O-N 3.05Å; M826-L828 PolarHBondContact O-N 3.34Å; L828-I830 VanDerWaalsContact C-N 3.28Å; L828-I830 PolarHBondContact O-N 3.39Å; L828-F831 PolarHBondContact O-N 2.87Å; L828-F831 VanDerWaalsContact O-N 3.14Å; L828-L832 PolarHBondContact O-N 2.89Å; L828-L835 HydrophobicContact CB-CD1 3.64Å
829	S	80.7	Confident	80.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-31.5	175.8	-63.3	0	0	0	0	113.6	Q825 M826 I827 Y869	Q825-S829 VanDerWaalsContact O-CB 3.3Å; Q825-S829 WeakPolarHBondContact O-CB 3.07Å; Q825-S829 PolarHBondContact O-N 3.31Å; Q825-S829 PolarHBondContact O-OG 3.36Å; M826-S829 WeakPolarHBondContact O-CB 3.26Å; M826-S829 PolarHBondContact O-N 3.35Å; I827-S829 VanDerWaalsContact C-N 3.32Å; I827-S829 PolarHBondContact O-N 3.3Å; S829-Y869 PolarHBondContact OG-OH 3.34Å
830	I	84	Confident	81.7	Confident	41 Å²	41	37.3 Å²	37.3	21%	0.21	19%	0.194	C	C	.	.	H	α-helix	trans	-73.3	-32	175.5	-68.4	163.6	0	0	0	111.7	M826 I827 L828 A877 C880 N881	M826-I830 HydrophobicContact CG-CD1 4.29Å; M826-I830 WeakPolarHBondContact O-CG1 3.13Å; M826-I830 PolarHBondContact O-N 3.42Å; I827-I830 PolarHBondContact O-N 2.78Å; L828-I830 VanDerWaalsContact C-N 3.28Å; L828-I830 PolarHBondContact O-N 3.39Å; I830-A877 HydrophobicContact CG1-CB 4.3Å; I830-C880 HydrophobicContact CG1-CB 4.23Å; I830-C880 HydrophobicContact CG2-CB 4.31Å; I830-N881 WeakPolarHBondContact O-CB 3.5Å; I830-N881 PolarHBondContact O-ND2 2.76Å
831	F	82.9	Confident	82.3	Confident	115 Å²	115	35.7 Å²	35.7	50%	0.504	19%	0.186	S	C	.	.	H	α-helix	trans	-85.5	-34.6	177.5	-73.9	-67.1	0	0	0	113.6	I827 L828 F884	I827-F831 HydrophobicContact CG2-CD2 4.02Å; I827-F831 HydrophobicContact CG2-CE2 3.83Å; I827-F831 VanDerWaalsContact O-CD2 3.28Å; I827-F831 WeakPolarHBondContact O-CD2 3.28Å; I827-F831 PolarHBondContact O-N 3.12Å; L828-F831 PolarHBondContact O-N 2.87Å; L828-F831 VanDerWaalsContact O-N 3.14Å; F831-F884 HydrophobicContact CD1-CE1 4.25Å; F831-F884 HydrophobicContact CD1-CZ 4.44Å; F831-F884 HydrophobicContact CE1-CE1 4.15Å; F831-F884 HydrophobicContact CE1-CE2 4.47Å; F831-F884 AromaticContact CE1-CZ 3.88Å; F831-F884 HydrophobicContact CE1-CZ 3.88Å
832	L	84.4	Confident	82.7	Confident	32 Å²	32	33.8 Å²	33.8	17%	0.168	17%	0.166	C	C	.	.			trans	-119	92.9	-178.7	-63.3	175.4	0	0	0	109.5	L828 Q834 L835	L828-L832 PolarHBondContact O-N 2.89Å; L832-Q834 PolarHBondContact O-N 3.49Å; L832-L835 HydrophobicContact CB-CD1 3.97Å; L832-L835 HydrophobicContact CB-CG 3.95Å; L832-L835 HydrophobicContact CD1-CD1 4.17Å; L832-L835 WeakPolarHBondContact O-CB 3.46Å; L832-L835 PolarHBondContact O-N 2.89Å
833	P	85.7	Confident	82.8	Confident	4 Å²	4	28.5 Å²	28.5	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-61.5	-19.8	-178.8	26.9	-35.7	0	0	0	113	A777 L835 A836 W837 L878 N881	A777-P833 HydrophobicContact CB-CB 3.83Å; A777-P833 HydrophobicContact CB-CG 4.45Å; P833-L835 VanDerWaalsContact C-N 3.25Å; P833-L835 PolarHBondContact O-N 3.46Å; P833-A836 PolarHBondContact O-N 2.95Å; P833-W837 WeakPolarHBondContact O-CB 3.36Å; P833-W837 PolarHBondContact O-N 3.29Å; P833-L878 HydrophobicContact CB-CD2 3.72Å; P833-N881 HydrophobicContact CB-CB 4.44Å; P833-N881 WeakPolarHBondContact CG-OD1 3.43Å
834	Q	86.9	Confident	82.8	Confident	12 Å²	12	25 Å²	25	6%	0.056	13%	0.128	C	C	.	.	H	α-helix	trans	-55.1	-39	170	-67.2	75.8	13.4	0	0	112.3	Y803 L832 N838	Y803-Q834 HydrophobicContact CD1-CG 4.29Å; Y803-Q834 HydrophobicContact CE1-CG 4.49Å; L832-Q834 PolarHBondContact O-N 3.49Å; Q834-N838 WeakPolarHBondContact O-CB 3.44Å; Q834-N838 PolarHBondContact O-N 2.71Å; Q834-N838 VanDerWaalsContact O-N 3.07Å; Q834-N838 PolarHBondContact O-OD1 2.92Å
835	L	86.9	Confident	82.4	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-67.6	-50.7	178.3	-63.3	178.6	0	0	0	111.1	G806 T809 F810 I813 L828 L832 P833 W837 N838 F839	G806-L835 WeakPolarHBondContact O-CD2 3.46Å; T809-L835 HydrophobicContact CG2-CD1 4.14Å; T809-L835 HydrophobicContact CG2-CD2 4.05Å; F810-L835 VanDerWaalsContact CA-CD2 3.5Å; F810-L835 HydrophobicContact CB-CD2 3.68Å; F810-L835 VanDerWaalsContact N-CD2 3.31Å; I813-L835 HydrophobicContact CD1-CD1 4.05Å; I813-L835 HydrophobicContact CD1-CD2 4.19Å; L828-L835 HydrophobicContact CB-CD1 3.64Å; L832-L835 HydrophobicContact CB-CD1 3.97Å; L832-L835 HydrophobicContact CB-CG 3.95Å; L832-L835 HydrophobicContact CD1-CD1 4.17Å; L832-L835 WeakPolarHBondContact O-CB 3.46Å; L832-L835 PolarHBondContact O-N 2.89Å; P833-L835 VanDerWaalsContact C-N 3.25Å; P833-L835 PolarHBondContact O-N 3.46Å; L835-W837 VanDerWaalsContact C-N 3.32Å; L835-W837 PolarHBondContact O-N 2.99Å; L835-N838 PolarHBondContact O-N 3.48Å; L835-N838 VanDerWaalsContact O-N 3.16Å; L835-F839 HydrophobicContact CB-CE2 4.42Å; L835-F839 WeakPolarHBondContact O-CD2 3.48Å; L835-F839 PolarHBondContact O-N 3.2Å
836	A	87.2	Confident	82.1	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.7	-43.9	-180	0	0	0	0	0	111.7	P833 G840 A877 L878	P833-A836 PolarHBondContact O-N 2.95Å; A836-G840 PolarHBondContact O-N 3.28Å; A836-A877 HydrophobicContact CB-CB 4.05Å; A836-L878 HydrophobicContact CB-CD2 3.89Å; A836-L878 HydrophobicContact CB-CG 3.83Å
837	W	88.8	Confident	81.8	Confident	10 Å²	10	20.3 Å²	20.3	4%	0.038	10%	0.104	C	C	.	.	H	α-helix	trans	-60.2	-47.1	174.1	167.7	-103.3	0	0	0	112.3	F693 F697 L770 Y771 C774 P833 L835 G840 C841	F693-W837 HydrophobicContact CB-CZ2 3.75Å; F693-W837 AromaticContact CD2-CZ2 3.74Å; F693-W837 HydrophobicContact CD2-CZ2 3.74Å; F693-W837 AromaticContact CG-CZ2 3.87Å; F693-W837 HydrophobicContact CG-CZ2 3.87Å; F697-W837 HydrophobicContact CE2-CD2 4.22Å; F697-W837 AromaticContact CE2-CE2 3.86Å; F697-W837 HydrophobicContact CE2-CH2 4.47Å; F697-W837 HydrophobicContact CE2-CZ2 4Å; L770-W837 HydrophobicContact CB-CZ3 4.07Å; L770-W837 HydrophobicContact CD2-CE3 3.87Å; L770-W837 HydrophobicContact CD2-CH2 4.43Å; L770-W837 HydrophobicContact CD2-CZ3 3.64Å; L770-W837 HydrophobicContact CG-CE3 3.76Å; L770-W837 HydrophobicContact CG-CZ3 3.6Å; Y771-W837 AromaticContact CD2-CH2 3.95Å; Y771-W837 HydrophobicContact CD2-CH2 3.95Å; Y771-W837 HydrophobicContact CD2-CZ2 4.5Å; Y771-W837 HydrophobicContact CD2-CZ3 4.49Å; C774-W837 HydrophobicContact CB-CB 4.5Å; C774-W837 HydrophobicContact CB-CD2 4.1Å; C774-W837 HydrophobicContact CB-CE3 3.58Å; C774-W837 HydrophobicContact CB-CG 4.48Å; C774-W837 HydrophobicContact CB-CZ3 4.26Å; P833-W837 WeakPolarHBondContact O-CB 3.36Å; P833-W837 PolarHBondContact O-N 3.29Å; L835-W837 VanDerWaalsContact C-N 3.32Å; L835-W837 PolarHBondContact O-N 2.99Å; W837-G840 PolarHBondContact O-N 3.29Å; W837-C841 WeakPolarHBondContact O-CB 3.19Å; W837-C841 PolarHBondContact O-N 2.93Å
838	N	86.3	Confident	81	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.4	-42.9	-177.1	-71.7	-3.8	0	0	0	112.6	P690 T694 F810 Q834 L835 G840 C841 V842	P690-N838 HydrophobicContact CB-CB 4.2Å; T694-N838 WeakPolarHBondContact CG2-OD1 3.17Å; F810-N838 HydrophobicContact CB-CB 4.3Å; F810-N838 HydrophobicContact CD1-CB 3.93Å; F810-N838 VanDerWaalsContact CD1-ND2 3.34Å; F810-N838 WeakPolarHBondContact CD1-ND2 3.31Å; F810-N838 HydrophobicContact CD2-CB 3.35Å; F810-N838 HydrophobicContact CE1-CB 4.04Å; F810-N838 HydrophobicContact CE2-CB 3.49Å; F810-N838 VanDerWaalsContact CE2-CB 3.49Å; F810-N838 HydrophobicContact CG-CB 3.57Å; F810-N838 VanDerWaalsContact CG-ND2 3.33Å; F810-N838 WeakPolarHBondContact CG-ND2 3.48Å; F810-N838 HydrophobicContact CZ-CB 3.83Å; Q834-N838 WeakPolarHBondContact O-CB 3.44Å; Q834-N838 PolarHBondContact O-N 2.71Å; Q834-N838 VanDerWaalsContact O-N 3.07Å; Q834-N838 PolarHBondContact O-OD1 2.92Å; L835-N838 PolarHBondContact O-N 3.48Å; L835-N838 VanDerWaalsContact O-N 3.16Å; N838-G840 VanDerWaalsContact C-N 3.34Å; N838-G840 PolarHBondContact O-N 2.81Å; N838-C841 WeakPolarHBondContact O-CB 3.3Å; N838-C841 PolarHBondContact O-N 3.03Å; N838-V842 WeakPolarHBondContact O-CG2 3.42Å; N838-V842 PolarHBondContact O-N 3.46Å
839	F	83.2	Confident	80.1	Confident	2 Å²	2	20 Å²	20	1%	0.009	10%	0.095	C	C	.	.	H	α-helix	trans	-64	-38.5	174.1	-72.6	-62.1	0	0	0	112.4	F810 I813 F817 L835 C841 S843 F864 Y869	F810-F839 HydrophobicContact CD2-CD1 4.37Å; F810-F839 HydrophobicContact CD2-CD2 4.45Å; F810-F839 HydrophobicContact CD2-CE1 4.08Å; F810-F839 HydrophobicContact CD2-CE2 4.17Å; F810-F839 AromaticContact CD2-CZ 3.96Å; F810-F839 HydrophobicContact CD2-CZ 3.96Å; F810-F839 AromaticContact CE2-CD1 3.98Å; F810-F839 HydrophobicContact CE2-CD1 3.98Å; F810-F839 AromaticContact CE2-CE1 3.92Å; F810-F839 HydrophobicContact CE2-CE1 3.92Å; F810-F839 HydrophobicContact CE2-CG 4.38Å; F810-F839 HydrophobicContact CE2-CZ 4.28Å; I813-F839 HydrophobicContact CB-CZ 4.04Å; I813-F839 HydrophobicContact CG2-CE2 4.31Å; I813-F839 HydrophobicContact CG2-CZ 3.61Å; F817-F839 HydrophobicContact CD2-CE1 4.03Å; F817-F839 HydrophobicContact CE2-CD1 4.3Å; F817-F839 AromaticContact CE2-CE1 3.74Å; F817-F839 HydrophobicContact CE2-CE1 3.74Å; F817-F839 HydrophobicContact CE2-CZ 4.36Å; L835-F839 HydrophobicContact CB-CE2 4.42Å; L835-F839 WeakPolarHBondContact O-CD2 3.48Å; L835-F839 PolarHBondContact O-N 3.2Å; F839-C841 VanDerWaalsContact C-N 3.33Å; F839-S843 PolarHBondContact O-N 3.04Å; F839-S843 VanDerWaalsContact O-N 3.13Å; F839-S843 PolarHBondContact O-OG 3.34Å; F839-F864 HydrophobicContact CD1-CE2 4.41Å; F839-F864 HydrophobicContact CD1-CZ 4.16Å; F839-Y869 HydrophobicContact CB-CD1 4.34Å; F839-Y869 HydrophobicContact CB-CE1 3.6Å; F839-Y869 HydrophobicContact CD2-CE1 4.38Å; F839-Y869 HydrophobicContact CG-CE1 4.1Å
840	G	83.7	Confident	79.3	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.6	-40.3	171.4	0	0	0	0	0	112.4	A836 W837 N838 S843 V844	A836-G840 PolarHBondContact O-N 3.28Å; W837-G840 PolarHBondContact O-N 3.29Å; N838-G840 VanDerWaalsContact C-N 3.34Å; N838-G840 PolarHBondContact O-N 2.81Å; G840-S843 WeakPolarHBondContact CA-OG 3.38Å; G840-S843 PolarHBondContact O-OG 3.1Å; G840-V844 VanDerWaalsContact O-CG2 3.32Å; G840-V844 WeakPolarHBondContact O-CG2 3.48Å; G840-V844 PolarHBondContact O-N 2.93Å
841	C	81.5	Confident	78.4	Confident	6 Å²	6	29.6 Å²	29.6	4%	0.041	14%	0.142	C	C	.	.	H	α-helix	trans	-64.4	-49.5	176.7	-174.5	0	0	0	0	112.3	P690 F693 W837 N838 F839 S843 V844 T845	P690-C841 HydrophobicContact CB-CB 4.48Å; P690-C841 HydrophobicContact CG-CB 4.12Å; F693-C841 VanDerWaalsContact CD2-SG 3.51Å; F693-C841 WeakPolarHBondContact CE2-SG 3.37Å; W837-C841 WeakPolarHBondContact O-CB 3.19Å; W837-C841 PolarHBondContact O-N 2.93Å; N838-C841 WeakPolarHBondContact O-CB 3.3Å; N838-C841 PolarHBondContact O-N 3.03Å; F839-C841 VanDerWaalsContact C-N 3.33Å; C841-S843 VanDerWaalsContact C-N 3.3Å; C841-S843 PolarHBondContact O-N 3.23Å; C841-V844 PolarHBondContact O-N 3.03Å; C841-T845 PolarHBondContact O-N 2.89Å; C841-T845 PolarHBondContact O-OG1 3.34Å; C841-T845 VanDerWaalsContact O-OG1 3.1Å
842	V	79.2	Confident	77.6	Confident	5 Å²	5	28.1 Å²	28.1	3%	0.03	14%	0.136	C	C	.	.	H	α-helix	trans	-58.2	-43.7	179.3	171.9	0	0	0	0	111.3	M687 P690 F810 N838 T845 A846 F864	M687-V842 HydrophobicContact SD-CG1 4.28Å; P690-V842 HydrophobicContact CG-CG2 3.91Å; F810-V842 HydrophobicContact CE2-CG2 4.3Å; F810-V842 HydrophobicContact CZ-CG2 3.76Å; N838-V842 WeakPolarHBondContact O-CG2 3.42Å; N838-V842 PolarHBondContact O-N 3.46Å; V842-T845 WeakPolarHBondContact CA-OG1 3.29Å; V842-T845 PolarHBondContact O-N 3.34Å; V842-T845 PolarHBondContact O-OG1 2.84Å; V842-A846 WeakPolarHBondContact O-CB 3.35Å; V842-A846 PolarHBondContact O-N 2.99Å; V842-F864 HydrophobicContact CB-CZ 4.36Å; V842-F864 HydrophobicContact CG1-CE1 4.14Å; V842-F864 HydrophobicContact CG1-CZ 3.85Å
843	S	76.9	Confident	76.7	Confident	8 Å²	8	33.8 Å²	33.8	6%	0.056	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-40.3	177.7	47.9	0	0	0	0	112.6	F839 G840 C841 A846 Y847 I871	F839-S843 PolarHBondContact O-N 3.04Å; F839-S843 VanDerWaalsContact O-N 3.13Å; F839-S843 PolarHBondContact O-OG 3.34Å; G840-S843 WeakPolarHBondContact CA-OG 3.38Å; G840-S843 PolarHBondContact O-OG 3.1Å; C841-S843 VanDerWaalsContact C-N 3.3Å; C841-S843 PolarHBondContact O-N 3.23Å; S843-A846 PolarHBondContact O-N 3.26Å; S843-Y847 WeakPolarHBondContact O-CD2 3.36Å; S843-Y847 PolarHBondContact O-N 3.41Å; S843-I871 VanDerWaalsContact OG-CG1 3.26Å; S843-I871 WeakPolarHBondContact OG-CG1 3.34Å
844	V	77.1	Confident	75.8	Confident	12 Å²	12	34 Å²	34	7%	0.073	16%	0.163	C	C	.	.	H	α-helix	trans	-63.2	-42.5	173.7	170.9	0	0	0	0	111.9	G840 C841 A846 Y847 A848 I871	G840-V844 VanDerWaalsContact O-CG2 3.32Å; G840-V844 WeakPolarHBondContact O-CG2 3.48Å; G840-V844 PolarHBondContact O-N 2.93Å; C841-V844 PolarHBondContact O-N 3.03Å; V844-A846 VanDerWaalsContact C-N 3.3Å; V844-A846 PolarHBondContact O-N 3.11Å; V844-Y847 PolarHBondContact O-N 3.09Å; V844-A848 PolarHBondContact O-N 2.88Å; V844-I871 HydrophobicContact CG2-CD1 4.3Å
845	T	72.7	Confident	75	Confident	23 Å²	23	36 Å²	36	14%	0.141	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-32.4	175.7	46.8	0	0	0	0	112.8	L689 C841 V842 R849	L689-T845 HydrophobicContact CD2-CG2 3.64Å; C841-T845 PolarHBondContact O-N 2.89Å; C841-T845 PolarHBondContact O-OG1 3.34Å; C841-T845 VanDerWaalsContact O-OG1 3.1Å; V842-T845 WeakPolarHBondContact CA-OG1 3.29Å; V842-T845 PolarHBondContact O-N 3.34Å; V842-T845 PolarHBondContact O-OG1 2.84Å; T845-R849 PolarHBondContact O-N 2.64Å; T845-R849 VanDerWaalsContact O-N 3.1Å
846	A	70.3	Confident	74.3	Confident	9 Å²	9	45.8 Å²	45.8	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-67.3	-46.2	175.2	0	0	0	0	0	112	V842 S843 V844 A848 R849 L850 F863	V842-A846 WeakPolarHBondContact O-CB 3.35Å; V842-A846 PolarHBondContact O-N 2.99Å; S843-A846 PolarHBondContact O-N 3.26Å; V844-A846 VanDerWaalsContact C-N 3.3Å; V844-A846 PolarHBondContact O-N 3.11Å; A846-A848 PolarHBondContact O-N 3.34Å; A846-R849 PolarHBondContact O-N 3.35Å; A846-L850 WeakPolarHBondContact O-CG 3.3Å; A846-L850 PolarHBondContact O-N 3.07Å; A846-L850 VanDerWaalsContact O-N 3.15Å; A846-F863 HydrophobicContact CB-CD1 3.78Å; A846-F863 HydrophobicContact CB-CD2 3.69Å; A846-F863 HydrophobicContact CB-CE1 3.69Å; A846-F863 HydrophobicContact CB-CE2 3.62Å; A846-F863 HydrophobicContact CB-CG 3.78Å; A846-F863 HydrophobicContact CB-CZ 3.62Å
847	Y	71.9	Confident	73.5	Confident	9 Å²	9	54.7 Å²	54.7	4%	0.035	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-36.9	175.4	-75.3	-67.4	0	0	0	112.8	S843 V844 R849 L850 E851 E852 L854 V861 I871	S843-Y847 WeakPolarHBondContact O-CD2 3.36Å; S843-Y847 PolarHBondContact O-N 3.41Å; V844-Y847 PolarHBondContact O-N 3.09Å; Y847-R849 PolarHBondContact O-N 3.11Å; Y847-L850 PolarHBondContact O-N 2.81Å; Y847-E851 PolarHBondContact O-N 2.91Å; Y847-E852 PolarHBondContact O-N 3.42Å; Y847-L854 HydrophobicContact CD1-CD1 4.13Å; Y847-L854 HydrophobicContact CD2-CD1 3.27Å; Y847-L854 HydrophobicContact CE2-CD1 3.84Å; Y847-L854 HydrophobicContact CG-CD1 3.45Å; Y847-L854 VanDerWaalsContact CG-CD1 3.45Å; Y847-V861 PolarHBondContact OH-O 2.79Å; Y847-I871 HydrophobicContact CD2-CD1 3.83Å; Y847-I871 HydrophobicContact CE2-CD1 3.76Å
848	A	67.5	Low	72.6	Confident	9 Å²	9	56.8 Å²	56.8	7%	0.074	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-41.7	173.5	0	0	0	0	0	112.2	N760 T763 V844 A846 L850 E851	N760-A848 PolarHBondContact ND2-O 3.06Å; T763-A848 HydrophobicContact CG2-CB 4.5Å; V844-A848 PolarHBondContact O-N 2.88Å; A846-A848 PolarHBondContact O-N 3.34Å; A848-L850 VanDerWaalsContact C-N 3.31Å; A848-L850 PolarHBondContact O-N 3.36Å; A848-E851 PolarHBondContact O-N 2.91Å
849	R	64.2	Low	71.8	Confident	122 Å²	122	57.5 Å²	57.5	46%	0.46	27%	0.267	S	S	.	.	H	α-helix	trans	-66.2	-28.3	176	-178.5	176.5	175.8	122.9	-5.5	113.6	T845 A846 Y847	T845-R849 PolarHBondContact O-N 2.64Å; T845-R849 VanDerWaalsContact O-N 3.1Å; A846-R849 PolarHBondContact O-N 3.35Å; Y847-R849 PolarHBondContact O-N 3.11Å
850	L	64.7	Low	71.2	Confident	100 Å²	100	63.2 Å²	63.2	52%	0.524	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-1.2	176.6	-67.7	171.4	0	0	0	113.2	A846 Y847 A848 E852	A846-L850 WeakPolarHBondContact O-CG 3.3Å; A846-L850 PolarHBondContact O-N 3.07Å; A846-L850 VanDerWaalsContact O-N 3.15Å; Y847-L850 PolarHBondContact O-N 2.81Å; A848-L850 VanDerWaalsContact C-N 3.31Å; A848-L850 PolarHBondContact O-N 3.36Å; L850-E852 HydrophobicContact CB-CG 4.08Å; L850-E852 PolarHBondContact O-N 3.37Å; L850-E852 VanDerWaalsContact O-N 3.1Å
851	E	64.6	Low	70.4	Confident	144 Å²	144	66.9 Å²	66.9	67%	0.673	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	19	-174.3	-61.4	-179.1	171.7	0	0	114	Y847 A848	Y847-E851 PolarHBondContact O-N 2.91Å; A848-E851 PolarHBondContact O-N 2.91Å
852	E	64.7	Low	69.6	Low	83 Å²	83	68 Å²	68	39%	0.388	33%	0.328	S	S	.	.			trans	-91.9	133.5	-177.3	-67.4	-154.4	120.8	0	0	113	Y847 L850 K858	Y847-E852 PolarHBondContact O-N 3.42Å; L850-E852 HydrophobicContact CB-CG 4.08Å; L850-E852 PolarHBondContact O-N 3.37Å; L850-E852 VanDerWaalsContact O-N 3.1Å; E852-K858 IonicContact OE1-NZ 3.5Å; E852-K858 PolarHBondContact OE1-NZ 2.88Å; E852-K858 IonicContact OE2-NZ 3.64Å; E852-K858 PolarHBondContact OE2-NZ 2.94Å
853	E	65.8	Low	68.9	Low	151 Å²	151	71.8 Å²	71.8	71%	0.706	34%	0.344	S	S	*	.			trans	-67.5	132.4	172	-64.9	-173.7	173.9	0	0	112.4	S855	E853-S855 VanDerWaalsContact C-N 3.33Å; E853-S855 PolarHBondContact O-N 3.41Å
854	L	67.8	Low	68.2	Low	9 Å²	9	72.9 Å²	72.9	5%	0.047	35%	0.348	C	S	.	.			trans	-82.2	76.9	-178.6	-152.3	97.2	0	0	0	111.3	W766 Y847 L859 I871	W766-L854 HydrophobicContact CB-CD2 3.59Å; W766-L854 VanDerWaalsContact CD1-CD2 3.48Å; W766-L854 HydrophobicContact CD2-CD2 4.04Å; W766-L854 HydrophobicContact CG-CB 4.46Å; W766-L854 HydrophobicContact CG-CD2 3.39Å; W766-L854 HydrophobicContact CG-CG 4.49Å; W766-L854 PolarHBondContact NE1-O 2.71Å; Y847-L854 HydrophobicContact CD1-CD1 4.13Å; Y847-L854 HydrophobicContact CD2-CD1 3.27Å; Y847-L854 HydrophobicContact CE2-CD1 3.84Å; Y847-L854 HydrophobicContact CG-CD1 3.45Å; Y847-L854 VanDerWaalsContact CG-CD1 3.45Å; L854-L859 HydrophobicContact CD2-CD2 3.65Å; L854-I871 HydrophobicContact CD1-CD1 3.78Å; L854-I871 HydrophobicContact CD2-CD1 3.93Å; L854-I871 HydrophobicContact CG-CD1 4.46Å
855	S	70.1	Confident	67	Low	54 Å²	54	80.8 Å²	80.8	38%	0.378	38%	0.384	S	S	.	.			trans	-72.1	158.8	175.7	71.3	0	0	0	0	112.8	E853 K857 K858 L859	E853-S855 VanDerWaalsContact C-N 3.33Å; E853-S855 PolarHBondContact O-N 3.41Å; S855-K857 PolarHBondContact O-N 2.84Å; S855-K858 PolarHBondContact O-N 3.18Å; S855-L859 PolarHBondContact O-N 3.15Å
856	W	71.5	Confident	66.1	Low	206 Å²	206	83 Å²	83	78%	0.78	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-31.9	178.2	-70.5	94.1	0	0	0	114.2	W766 L859	W766-W856 HydrophobicContact CH2-CD2 4.19Å; W766-W856 AromaticContact CH2-CE3 3.9Å; W766-W856 HydrophobicContact CH2-CE3 3.9Å; W766-W856 AromaticContact CH2-CH2 3.76Å; W766-W856 HydrophobicContact CH2-CH2 3.76Å; W766-W856 HydrophobicContact CH2-CZ2 4.03Å; W766-W856 AromaticContact CH2-CZ3 3.69Å; W766-W856 HydrophobicContact CH2-CZ3 3.69Å; W766-W856 HydrophobicContact CZ2-CD2 4.04Å; W766-W856 HydrophobicContact CZ2-CE3 4.21Å; W766-W856 HydrophobicContact CZ2-CH2 4.35Å; W766-W856 HydrophobicContact CZ2-CZ2 4.17Å; W766-W856 HydrophobicContact CZ2-CZ3 4.36Å; W856-L859 HydrophobicContact CD2-CD1 4.41Å; W856-L859 HydrophobicContact CE3-CD1 3.82Å; W856-L859 HydrophobicContact CZ3-CD1 4.44Å
857	K	70.4	Confident	65.4	Low	187 Å²	187	90.7 Å²	90.7	81%	0.813	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-33.9	176.5	-66.3	-175.4	179.6	-179.2	0	112.3	S855	S855-K857 PolarHBondContact O-N 2.84Å
858	K	70	Confident	65.1	Low	54 Å²	54	94.4 Å²	94.4	24%	0.235	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-78.9	-14.4	-178	-67.5	-172.6	175.4	-172.4	0	113.9	E852 S855 N860 V861	E852-K858 IonicContact OE1-NZ 3.5Å; E852-K858 PolarHBondContact OE1-NZ 2.88Å; E852-K858 IonicContact OE2-NZ 3.64Å; E852-K858 PolarHBondContact OE2-NZ 2.94Å; S855-K858 PolarHBondContact O-N 3.18Å; K858-N860 PolarHBondContact O-N 3.11Å; K858-V861 WeakPolarHBondContact O-CB 3.4Å; K858-V861 PolarHBondContact O-N 2.85Å
859	L	70.8	Confident	65.3	Low	14 Å²	14	94.5 Å²	94.5	7%	0.073	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-60.1	-26.9	174.6	-68.6	169	0	0	0	114.4	W766 L854 S855 W856 T870 I871 G872	W766-L859 HydrophobicContact CD2-CD2 3.99Å; W766-L859 HydrophobicContact CE3-CD2 3.91Å; W766-L859 HydrophobicContact CH2-CD1 3.47Å; W766-L859 VanDerWaalsContact CH2-CD1 3.47Å; W766-L859 HydrophobicContact CH2-CD2 4.28Å; W766-L859 HydrophobicContact CH2-CG 4.44Å; W766-L859 HydrophobicContact CZ2-CD1 3.71Å; W766-L859 HydrophobicContact CZ2-CD2 4.32Å; W766-L859 HydrophobicContact CZ2-CG 4.4Å; W766-L859 HydrophobicContact CZ3-CD1 3.93Å; W766-L859 HydrophobicContact CZ3-CD2 4.06Å; L854-L859 HydrophobicContact CD2-CD2 3.65Å; S855-L859 PolarHBondContact O-N 3.15Å; W856-L859 HydrophobicContact CD2-CD1 4.41Å; W856-L859 HydrophobicContact CE3-CD1 3.82Å; W856-L859 HydrophobicContact CZ3-CD1 4.44Å; L859-T870 WeakPolarHBondContact O-CB 3.24Å; L859-T870 PolarHBondContact O-OG1 3.24Å; L859-I871 HydrophobicContact CD2-CB 4.35Å; L859-I871 HydrophobicContact CD2-CG2 3.87Å; L859-G872 PolarHBondContact O-N 2.81Å; L859-G872 VanDerWaalsContact O-N 3.11Å
860	N	69.7	Low	65.9	Low	123 Å²	123	89.1 Å²	89.1	66%	0.658	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-98.6	5.2	177.4	-76.3	-9.3	0	0	0	113	K858 T870	K858-N860 PolarHBondContact O-N 3.11Å; N860-T870 WeakPolarHBondContact O-CG2 3.27Å
861	V	66.7	Low	66.8	Low	76 Å²	76	84.6 Å²	84.6	46%	0.461	40%	0.403	S	S	.	.			trans	-89.2	131.3	171.6	180	0	0	0	0	108.3	Y847 K858	Y847-V861 PolarHBondContact OH-O 2.79Å; K858-V861 WeakPolarHBondContact O-CB 3.4Å; K858-V861 PolarHBondContact O-N 2.85Å
862	S	65.3	Low	67.7	Low	31 Å²	31	78.6 Å²	78.6	22%	0.217	38%	0.379	C	S	.	.			trans	-86.2	137	176.8	39.9	0	0	0	0	110.1	K867 Y869	S862-K867 WeakPolarHBondContact CB-O 3.24Å; S862-K867 WeakPolarHBondContact OG-CA 3.5Å; S862-K867 PolarHBondContact OG-O 3.05Å; S862-Y869 WeakPolarHBondContact CB-O 3.24Å
863	F	63.2	Low	68.6	Low	83 Å²	83	80.4 Å²	80.4	36%	0.364	38%	0.383	S	S	.	.	S	Bend	trans	-87	-23.8	171.2	178.4	-104.6	0	0	0	112.1	A846	A846-F863 HydrophobicContact CB-CD1 3.78Å; A846-F863 HydrophobicContact CB-CD2 3.69Å; A846-F863 HydrophobicContact CB-CE1 3.69Å; A846-F863 HydrophobicContact CB-CE2 3.62Å; A846-F863 HydrophobicContact CB-CG 3.78Å; A846-F863 HydrophobicContact CB-CZ 3.62Å
864	F	63.1	Low	69.7	Low	31 Å²	31	73.2 Å²	73.2	14%	0.136	35%	0.349	C	S	.	.	S	Bend	trans	-92.6	145.3	-176.8	-52.5	-84	0	0	0	111.8	F817 F839 V842 N866	F817-F864 HydrophobicContact CD1-CB 4.07Å; F817-F864 HydrophobicContact CD1-CD1 4.39Å; F817-F864 HydrophobicContact CD1-CG 4.43Å; F817-F864 HydrophobicContact CE1-CB 3.26Å; F817-F864 HydrophobicContact CE1-CD1 4.08Å; F817-F864 HydrophobicContact CE1-CD2 4.42Å; F817-F864 AromaticContact CE1-CG 3.7Å; F817-F864 HydrophobicContact CE1-CG 3.7Å; F817-F864 HydrophobicContact CE2-CD1 4.28Å; F817-F864 HydrophobicContact CE2-CD2 4.43Å; F817-F864 HydrophobicContact CE2-CG 4.21Å; F817-F864 HydrophobicContact CZ-CB 3.6Å; F817-F864 HydrophobicContact CZ-CD1 4.01Å; F817-F864 AromaticContact CZ-CD2 3.86Å; F817-F864 HydrophobicContact CZ-CD2 3.86Å; F817-F864 AromaticContact CZ-CG 3.56Å; F817-F864 HydrophobicContact CZ-CG 3.56Å; F839-F864 HydrophobicContact CD1-CE2 4.41Å; F839-F864 HydrophobicContact CD1-CZ 4.16Å; V842-F864 HydrophobicContact CB-CZ 4.36Å; V842-F864 HydrophobicContact CG1-CE1 4.14Å; V842-F864 HydrophobicContact CG1-CZ 3.85Å; F864-N866 CarbonylContact O-C 3.4Å; F864-N866 PolarHBondContact O-N 2.92Å; F864-N866 VanDerWaalsContact O-N 3.14Å
865	E	52.2	Low	70.6	Confident	179 Å²	179	74.3 Å²	74.3	84%	0.836	36%	0.355	S	S	*	.	S	Bend	trans	-53	-37.1	-175.5	-62.1	175	144.7	0	0	113.9	K867	E865-K867 VanDerWaalsContact C-N 3.28Å; E865-K867 WeakPolarHBondContact O-CG 3.47Å; E865-K867 PolarHBondContact O-N 3.17Å
866	N	53.5	Low	71.6	Confident	70 Å²	70	75.2 Å²	75.2	37%	0.374	36%	0.358	S	S	.	.	S	Bend	trans	-70	87.6	166.1	-90.3	-37.7	0	0	0	109.2	F817 S818 F864 N868	F817-N866 HydrophobicContact CE1-CB 4.03Å; F817-N866 PolarHBondContact O-ND2 2.87Å; F817-N866 VanDerWaalsContact O-ND2 3.17Å; S818-N866 PolarHBondContact O-ND2 3.46Å; F864-N866 CarbonylContact O-C 3.4Å; F864-N866 PolarHBondContact O-N 2.92Å; F864-N866 VanDerWaalsContact O-N 3.14Å; N866-N868 PolarHBondContact O-N 3.4Å
867	K	56.2	Low	72.4	Confident	170 Å²	170	65.6 Å²	65.6	74%	0.739	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.6	-0.4	-168.2	-60	-177.8	179	176.8	0	119.1	S862 E865	S862-K867 WeakPolarHBondContact CB-O 3.24Å; S862-K867 WeakPolarHBondContact OG-CA 3.5Å; S862-K867 PolarHBondContact OG-O 3.05Å; E865-K867 VanDerWaalsContact C-N 3.28Å; E865-K867 WeakPolarHBondContact O-CG 3.47Å; E865-K867 PolarHBondContact O-N 3.17Å
868	N	65.7	Low	73.4	Confident	87 Å²	87	56.7 Å²	56.7	47%	0.465	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-20.2	-164.5	-63.8	-13.4	0	0	0	116.2	Y822 N866 W873	Y822-N868 HydrophobicContact CG-CB 4.35Å; N866-N868 PolarHBondContact O-N 3.4Å; N868-W873 PolarHBondContact O-NE1 3.49Å
869	Y	71.9	Confident	74.4	Confident	11 Å²	11	58.4 Å²	58.4	4%	0.043	29%	0.292	C	S	.	.			trans	-91.2	122.2	180	-158.4	-77.9	0	0	0	111.1	Q825 S829 F839 S862	Q825-Y869 HydrophobicContact CB-CD2 4.32Å; Q825-Y869 HydrophobicContact CB-CE2 4.36Å; S829-Y869 PolarHBondContact OG-OH 3.34Å; F839-Y869 HydrophobicContact CB-CD1 4.34Å; F839-Y869 HydrophobicContact CB-CE1 3.6Å; F839-Y869 HydrophobicContact CD2-CE1 4.38Å; F839-Y869 HydrophobicContact CG-CE1 4.1Å; S862-Y869 WeakPolarHBondContact CB-O 3.24Å
870	T	76.9	Confident	75.4	Confident	9 Å²	9	60.2 Å²	60.2	6%	0.055	31%	0.306	C	S	.	.			trans	-131.4	166.3	-169	72.7	0	0	0	0	111.9	L859 N860 G872 W873 S874	L859-T870 WeakPolarHBondContact O-CB 3.24Å; L859-T870 PolarHBondContact O-OG1 3.24Å; N860-T870 WeakPolarHBondContact O-CG2 3.27Å; T870-G872 PolarHBondContact O-N 3.24Å; T870-G872 PolarHBondContact OG1-N 3.09Å; T870-W873 PolarHBondContact O-N 3.4Å; T870-W873 VanDerWaalsContact O-N 3.15Å; T870-W873 PolarHBondContact OG1-N 3.28Å; T870-S874 PolarHBondContact O-N 3.45Å; T870-S874 VanDerWaalsContact O-N 3.15Å
871	I	82.3	Confident	76.4	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-58.2	-40.3	172.9	-66.8	169.9	0	0	0	110.1	S843 V844 Y847 L854 L859 W873 S874 L875	S843-I871 VanDerWaalsContact OG-CG1 3.26Å; S843-I871 WeakPolarHBondContact OG-CG1 3.34Å; V844-I871 HydrophobicContact CG2-CD1 4.3Å; Y847-I871 HydrophobicContact CD2-CD1 3.83Å; Y847-I871 HydrophobicContact CE2-CD1 3.76Å; L854-I871 HydrophobicContact CD1-CD1 3.78Å; L854-I871 HydrophobicContact CD2-CD1 3.93Å; L854-I871 HydrophobicContact CG-CD1 4.46Å; L859-I871 HydrophobicContact CD2-CB 4.35Å; L859-I871 HydrophobicContact CD2-CG2 3.87Å; I871-W873 VanDerWaalsContact C-N 3.35Å; I871-W873 PolarHBondContact O-N 3.3Å; I871-S874 PolarHBondContact O-N 2.87Å; I871-S874 VanDerWaalsContact O-N 3.14Å; I871-S874 PolarHBondContact O-OG 3.09Å; I871-L875 HydrophobicContact CG2-CD1 4.42Å; I871-L875 PolarHBondContact O-N 2.93Å; I871-L875 VanDerWaalsContact O-N 3.16Å
872	G	83.5	Confident	77.6	Confident	17 Å²	17	51.1 Å²	51.1	18%	0.175	26%	0.255	C	S	.	.	H	α-helix	trans	-54.5	-47	174.2	0	0	0	0	0	113	L859 T870 S874 L875 V876	L859-G872 PolarHBondContact O-N 2.81Å; L859-G872 VanDerWaalsContact O-N 3.11Å; T870-G872 PolarHBondContact O-N 3.24Å; T870-G872 PolarHBondContact OG1-N 3.09Å; G872-S874 VanDerWaalsContact C-N 3.34Å; G872-S874 PolarHBondContact O-N 3.09Å; G872-L875 PolarHBondContact O-N 3.24Å; G872-V876 WeakPolarHBondContact O-CG2 3.36Å; G872-V876 PolarHBondContact O-N 3.36Å; G872-V876 VanDerWaalsContact O-N 3.09Å
873	W	85	Confident	78.8	Confident	122 Å²	122	55.4 Å²	55.4	46%	0.462	28%	0.275	S	S	.	.	H	α-helix	trans	-64.4	-34.9	176.9	-72.2	118.8	0	0	0	113.4	M826 N868 T870 I871 V876 A877	M826-W873 HydrophobicContact SD-CE3 4.28Å; M826-W873 HydrophobicContact SD-CZ3 4.31Å; N868-W873 PolarHBondContact O-NE1 3.49Å; T870-W873 PolarHBondContact O-N 3.4Å; T870-W873 VanDerWaalsContact O-N 3.15Å; T870-W873 PolarHBondContact OG1-N 3.28Å; I871-W873 VanDerWaalsContact C-N 3.35Å; I871-W873 PolarHBondContact O-N 3.3Å; W873-V876 PolarHBondContact O-N 3Å; W873-A877 WeakPolarHBondContact O-CB 3.31Å; W873-A877 PolarHBondContact O-N 3.05Å
874	S	87	Confident	80	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-41.4	175.8	78.3	0	0	0	0	112.3	T870 I871 G872 A877 L878	T870-S874 PolarHBondContact O-N 3.45Å; T870-S874 VanDerWaalsContact O-N 3.15Å; I871-S874 PolarHBondContact O-N 2.87Å; I871-S874 VanDerWaalsContact O-N 3.14Å; I871-S874 PolarHBondContact O-OG 3.09Å; G872-S874 VanDerWaalsContact C-N 3.34Å; G872-S874 PolarHBondContact O-N 3.09Å; S874-A877 PolarHBondContact O-N 3.15Å; S874-L878 WeakPolarHBondContact O-CG 3.4Å; S874-L878 PolarHBondContact O-N 2.88Å; S874-L878 VanDerWaalsContact O-N 3.1Å
875	L	88.4	Confident	81.2	Confident	32 Å²	32	53.6 Å²	53.6	17%	0.168	27%	0.267	C	S	.	.	H	α-helix	trans	-66.6	-42.9	176.9	-70.3	169.8	0	0	0	111.4	V769 L770 I871 G872 L878 Q879	V769-L875 HydrophobicContact CG1-CD2 4.2Å; L770-L875 HydrophobicContact CD1-CD2 3.86Å; L770-L875 HydrophobicContact CD1-CG 4.35Å; I871-L875 HydrophobicContact CG2-CD1 4.42Å; I871-L875 PolarHBondContact O-N 2.93Å; I871-L875 VanDerWaalsContact O-N 3.16Å; G872-L875 PolarHBondContact O-N 3.24Å; L875-L878 PolarHBondContact O-N 3.44Å; L875-Q879 WeakPolarHBondContact O-CG 3.36Å; L875-Q879 PolarHBondContact O-N 3.42Å
876	V	89.5	Confident	82.8	Confident	73 Å²	73	47.5 Å²	47.5	44%	0.442	24%	0.24	S	C	.	.	H	α-helix	trans	-60.9	-46.6	175.4	172.8	0	0	0	0	110.8	G872 W873 L878 Q879 C880	G872-V876 WeakPolarHBondContact O-CG2 3.36Å; G872-V876 PolarHBondContact O-N 3.36Å; G872-V876 VanDerWaalsContact O-N 3.09Å; W873-V876 PolarHBondContact O-N 3Å; V876-L878 VanDerWaalsContact C-N 3.34Å; V876-L878 PolarHBondContact O-N 3.08Å; V876-Q879 PolarHBondContact O-N 3.38Å; V876-C880 PolarHBondContact O-N 3.3Å; V876-C880 PolarHBondContact O-SG 3.08Å; V876-C880 VanDerWaalsContact O-SG 3.39Å
877	A	88.7	Confident	84.3	Confident	3 Å²	3	49 Å²	49	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-41.3	179.1	0	0	0	0	0	112.7	I830 A836 W873 S874 Q879 C880 N881	I830-A877 HydrophobicContact CG1-CB 4.3Å; A836-A877 HydrophobicContact CB-CB 4.05Å; W873-A877 WeakPolarHBondContact O-CB 3.31Å; W873-A877 PolarHBondContact O-N 3.05Å; S874-A877 PolarHBondContact O-N 3.15Å; A877-Q879 PolarHBondContact O-N 2.7Å; A877-C880 PolarHBondContact O-N 3.41Å; A877-N881 WeakPolarHBondContact O-CB 3.38Å; A877-N881 PolarHBondContact O-N 3.02Å
878	L	91.4	Very high	85.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-37.8	176.5	-72.1	171.1	0	0	0	112.6	L770 S773 C774 A777 P833 A836 S874 L875 V876 S882	L770-L878 HydrophobicContact CD1-CD1 4.3Å; S773-L878 VanDerWaalsContact OG-CD1 3.28Å; S773-L878 WeakPolarHBondContact OG-CD1 3.41Å; C774-L878 HydrophobicContact CB-CD1 4.43Å; A777-L878 HydrophobicContact CB-CD2 3.94Å; P833-L878 HydrophobicContact CB-CD2 3.72Å; A836-L878 HydrophobicContact CB-CD2 3.89Å; A836-L878 HydrophobicContact CB-CG 3.83Å; S874-L878 WeakPolarHBondContact O-CG 3.4Å; S874-L878 PolarHBondContact O-N 2.88Å; S874-L878 VanDerWaalsContact O-N 3.1Å; L875-L878 PolarHBondContact O-N 3.44Å; V876-L878 VanDerWaalsContact C-N 3.34Å; V876-L878 PolarHBondContact O-N 3.08Å; L878-S882 PolarHBondContact O-N 3.3Å
879	Q	90.5	Very high	86.3	Confident	90 Å²	90	38.4 Å²	38.4	42%	0.421	20%	0.199	S	C	.	.	H	α-helix	trans	-73.6	-39.2	175.6	-61.3	-58.9	-11.6	0	0	112.5	L875 V876 A877 N881 S882 L883	L875-Q879 WeakPolarHBondContact O-CG 3.36Å; L875-Q879 PolarHBondContact O-N 3.42Å; V876-Q879 PolarHBondContact O-N 3.38Å; A877-Q879 PolarHBondContact O-N 2.7Å; Q879-N881 VanDerWaalsContact C-N 3.3Å; Q879-N881 PolarHBondContact O-N 3.33Å; Q879-S882 PolarHBondContact O-N 2.81Å; Q879-S882 PolarHBondContact O-OG 3.48Å; Q879-L883 WeakPolarHBondContact O-CG 2.8Å; Q879-L883 PolarHBondContact O-N 3.42Å; Q879-L883 VanDerWaalsContact O-N 3.09Å
880	C	92.1	Very high	86.5	Confident	53 Å²	53	40.1 Å²	40.1	36%	0.358	21%	0.208	S	C	.	.	H	α-helix	trans	-60.2	-41	171.7	-70.1	0	0	0	0	111.7	I830 V876 A877 F884	I830-C880 HydrophobicContact CG1-CB 4.23Å; I830-C880 HydrophobicContact CG2-CB 4.31Å; V876-C880 PolarHBondContact O-N 3.3Å; V876-C880 PolarHBondContact O-SG 3.08Å; V876-C880 VanDerWaalsContact O-SG 3.39Å; A877-C880 PolarHBondContact O-N 3.41Å; C880-F884 VanDerWaalsContact O-CB 3.26Å; C880-F884 WeakPolarHBondContact O-CB 3.28Å; C880-F884 PolarHBondContact O-N 3.25Å
881	N	91.7	Very high	86.6	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-44.2	174.6	-177	-101.2	0	0	0	112.2	I830 P833 A877 Q879 L883 F884 N885	I830-N881 WeakPolarHBondContact O-CB 3.5Å; I830-N881 PolarHBondContact O-ND2 2.76Å; P833-N881 HydrophobicContact CB-CB 4.44Å; P833-N881 WeakPolarHBondContact CG-OD1 3.43Å; A877-N881 WeakPolarHBondContact O-CB 3.38Å; A877-N881 PolarHBondContact O-N 3.02Å; Q879-N881 VanDerWaalsContact C-N 3.3Å; Q879-N881 PolarHBondContact O-N 3.33Å; N881-L883 PolarHBondContact O-N 3.05Å; N881-F884 PolarHBondContact O-N 2.99Å; N881-N885 WeakPolarHBondContact O-CB 3.32Å; N881-N885 PolarHBondContact O-N 3.39Å; N881-N885 PolarHBondContact O-ND2 3.1Å; N881-N885 PolarHBondContact OD1-ND2 3.16Å
882	S	90.6	Very high	86.2	Confident	7 Å²	7	44.3 Å²	44.3	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-43.5	-178.5	81.9	0	0	0	0	112.3	T780 L878 Q879 I886	T780-S882 WeakPolarHBondContact OG1-CA 3.41Å; L878-S882 PolarHBondContact O-N 3.3Å; Q879-S882 PolarHBondContact O-N 2.81Å; Q879-S882 PolarHBondContact O-OG 3.48Å; S882-I886 VanDerWaalsContact O-CG1 3.32Å; S882-I886 WeakPolarHBondContact O-CG1 3.37Å; S882-I886 PolarHBondContact O-N 2.96Å; S882-I886 VanDerWaalsContact O-N 3.1Å
883	L	91	Very high	85.6	Confident	120 Å²	120	46.9 Å²	46.9	63%	0.628	24%	0.24	S	C	*	.	H	α-helix	trans	-64.2	-44	174.5	-67.9	173.9	0	0	0	111.9	Q879 N881 I886 M887	Q879-L883 WeakPolarHBondContact O-CG 2.8Å; Q879-L883 PolarHBondContact O-N 3.42Å; Q879-L883 VanDerWaalsContact O-N 3.09Å; N881-L883 PolarHBondContact O-N 3.05Å; L883-I886 PolarHBondContact O-N 3.07Å; L883-M887 WeakPolarHBondContact O-CB 3.37Å; L883-M887 PolarHBondContact O-N 3.24Å
884	F	89.4	Confident	84.7	Confident	71 Å²	71	45.9 Å²	45.9	31%	0.311	24%	0.243	S	C	.	.	H	α-helix	trans	-61	-48.5	177	177.6	-98.8	0	0	0	112	F831 C880 N881 I886 M887 V888	F831-F884 HydrophobicContact CD1-CE1 4.25Å; F831-F884 HydrophobicContact CD1-CZ 4.44Å; F831-F884 HydrophobicContact CE1-CE1 4.15Å; F831-F884 HydrophobicContact CE1-CE2 4.47Å; F831-F884 AromaticContact CE1-CZ 3.88Å; F831-F884 HydrophobicContact CE1-CZ 3.88Å; C880-F884 VanDerWaalsContact O-CB 3.26Å; C880-F884 WeakPolarHBondContact O-CB 3.28Å; C880-F884 PolarHBondContact O-N 3.25Å; N881-F884 PolarHBondContact O-N 2.99Å; F884-I886 VanDerWaalsContact C-N 3.35Å; F884-I886 PolarHBondContact O-N 3.42Å; F884-M887 HydrophobicContact CD2-CE 4.09Å; F884-M887 HydrophobicContact CE2-CE 4.5Å; F884-M887 PolarHBondContact O-N 3.45Å; F884-V888 HydrophobicContact CD1-CG2 4.33Å; F884-V888 HydrophobicContact CD2-CG2 4.2Å; F884-V888 HydrophobicContact CE1-CG2 3.96Å; F884-V888 HydrophobicContact CE2-CG2 3.82Å; F884-V888 HydrophobicContact CG-CG2 4.44Å; F884-V888 HydrophobicContact CZ-CG2 3.7Å; F884-V888 WeakPolarHBondContact O-CG2 3.26Å; F884-V888 PolarHBondContact O-N 3.03Å
885	N	87.4	Confident	83.5	Confident	5 Å²	5	47 Å²	47	3%	0.027	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-44.2	178.4	-71.3	-29.6	0	0	0	112	T780 Q781 L784 N881 A889	T780-N885 PolarHBondContact OG1-ND2 3.45Å; T780-N885 VanDerWaalsContact OG1-ND2 3.1Å; Q781-N885 PolarHBondContact N-ND2 2.76Å; L784-N885 WeakPolarHBondContact CD2-OD1 3.22Å; N881-N885 WeakPolarHBondContact O-CB 3.32Å; N881-N885 PolarHBondContact O-N 3.39Å; N881-N885 PolarHBondContact O-ND2 3.1Å; N881-N885 PolarHBondContact OD1-ND2 3.16Å; N885-A889 VanDerWaalsContact O-CB 3.26Å; N885-A889 WeakPolarHBondContact O-CB 3.37Å; N885-A889 PolarHBondContact O-N 3.27Å
886	I	85.7	Confident	82	Confident	52 Å²	52	48.3 Å²	48.3	27%	0.267	26%	0.263	S	S	.	.	H	α-helix	trans	-62	-52.4	175.6	-69.6	168.2	0	0	0	109.6	T780 S882 L883 F884 V888 A889 L890	T780-I886 HydrophobicContact CG2-CD1 3.71Å; T780-I886 HydrophobicContact CG2-CG1 3.6Å; S882-I886 VanDerWaalsContact O-CG1 3.32Å; S882-I886 WeakPolarHBondContact O-CG1 3.37Å; S882-I886 PolarHBondContact O-N 2.96Å; S882-I886 VanDerWaalsContact O-N 3.1Å; L883-I886 PolarHBondContact O-N 3.07Å; F884-I886 VanDerWaalsContact C-N 3.35Å; F884-I886 PolarHBondContact O-N 3.42Å; I886-V888 PolarHBondContact O-N 3Å; I886-A889 PolarHBondContact O-N 3.49Å; I886-L890 HydrophobicContact CG2-CD1 3.79Å; I886-L890 HydrophobicContact CG2-CG 4.1Å; I886-L890 WeakPolarHBondContact O-CB 2.82Å; I886-L890 VanDerWaalsContact O-CG 3.23Å; I886-L890 WeakPolarHBondContact O-CG 3.37Å; I886-L890 PolarHBondContact O-N 2.81Å
887	M	85.3	Confident	80.2	Confident	101 Å²	101	48 Å²	48	50%	0.498	26%	0.259	S	S	.	.	H	α-helix	trans	-55.5	-48.3	-179.4	-178	-175.6	66.7	0	0	112.2	L883 F884 L890 L891	L883-M887 WeakPolarHBondContact O-CB 3.37Å; L883-M887 PolarHBondContact O-N 3.24Å; F884-M887 HydrophobicContact CD2-CE 4.09Å; F884-M887 HydrophobicContact CE2-CE 4.5Å; F884-M887 PolarHBondContact O-N 3.45Å; M887-L890 PolarHBondContact O-N 3.25Å; M887-L891 HydrophobicContact CG-CD1 4.2Å; M887-L891 VanDerWaalsContact O-CG 3.31Å; M887-L891 WeakPolarHBondContact O-CG 3.49Å; M887-L891 PolarHBondContact O-N 3.42Å
888	V	83.7	Confident	78.4	Confident	34 Å²	34	51.5 Å²	51.5	21%	0.206	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-41.3	179.5	178.2	0	0	0	0	111.1	L784 F884 I886 L890 L891 I892	L784-V888 HydrophobicContact CD1-CB 4.02Å; L784-V888 HydrophobicContact CD1-CG1 3.59Å; F884-V888 HydrophobicContact CD1-CG2 4.33Å; F884-V888 HydrophobicContact CD2-CG2 4.2Å; F884-V888 HydrophobicContact CE1-CG2 3.96Å; F884-V888 HydrophobicContact CE2-CG2 3.82Å; F884-V888 HydrophobicContact CG-CG2 4.44Å; F884-V888 HydrophobicContact CZ-CG2 3.7Å; F884-V888 WeakPolarHBondContact O-CG2 3.26Å; F884-V888 PolarHBondContact O-N 3.03Å; I886-V888 PolarHBondContact O-N 3Å; V888-L890 PolarHBondContact O-N 3.05Å; V888-L891 PolarHBondContact O-N 3.48Å; V888-I892 HydrophobicContact CG1-CD1 4.06Å; V888-I892 VanDerWaalsContact O-CG1 3.32Å; V888-I892 WeakPolarHBondContact O-CG1 3.26Å; V888-I892 PolarHBondContact O-N 3.11Å; V888-I892 VanDerWaalsContact O-N 3.09Å
889	A	79.4	Confident	76.4	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-39.2	176.4	0	0	0	0	0	112.4	Y783 L784 N885 I886 I892 D893	Y783-A889 HydrophobicContact CD1-CB 3.55Å; Y783-A889 HydrophobicContact CE1-CB 3.76Å; L784-A889 HydrophobicContact CD1-CB 4.42Å; N885-A889 VanDerWaalsContact O-CB 3.26Å; N885-A889 WeakPolarHBondContact O-CB 3.37Å; N885-A889 PolarHBondContact O-N 3.27Å; I886-A889 PolarHBondContact O-N 3.49Å; A889-I892 WeakPolarHBondContact O-CB 3.49Å; A889-I892 PolarHBondContact O-N 3.45Å; A889-D893 PolarHBondContact O-N 2.87Å
890	L	77.9	Confident	74.6	Confident	46 Å²	46	58.1 Å²	58.1	24%	0.241	32%	0.316	C	S	.	.	H	α-helix	trans	-61.7	-43.6	173.2	-68.6	179.2	0	0	0	111.9	W727 I886 M887 V888 I892 D893 L894	W727-L890 HydrophobicContact CE3-CD2 4.19Å; W727-L890 HydrophobicContact CH2-CD2 3.13Å; W727-L890 HydrophobicContact CZ2-CD2 4.07Å; W727-L890 HydrophobicContact CZ3-CD2 3.2Å; I886-L890 HydrophobicContact CG2-CD1 3.79Å; I886-L890 HydrophobicContact CG2-CG 4.1Å; I886-L890 WeakPolarHBondContact O-CB 2.82Å; I886-L890 VanDerWaalsContact O-CG 3.23Å; I886-L890 WeakPolarHBondContact O-CG 3.37Å; I886-L890 PolarHBondContact O-N 2.81Å; M887-L890 PolarHBondContact O-N 3.25Å; V888-L890 PolarHBondContact O-N 3.05Å; L890-I892 PolarHBondContact O-N 2.84Å; L890-D893 PolarHBondContact O-N 3.44Å; L890-L894 VanDerWaalsContact O-CB 3.24Å; L890-L894 WeakPolarHBondContact O-CB 3.29Å; L890-L894 VanDerWaalsContact O-CG 3.23Å; L890-L894 WeakPolarHBondContact O-CG 3.4Å; L890-L894 PolarHBondContact O-N 3.33Å
891	L	78.3	Confident	72.7	Confident	58 Å²	58	59.5 Å²	59.5	30%	0.304	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-30.5	176.6	-71.6	168.5	0	0	0	112.7	M887 V888 V896 L897	M887-L891 HydrophobicContact CG-CD1 4.2Å; M887-L891 VanDerWaalsContact O-CG 3.31Å; M887-L891 WeakPolarHBondContact O-CG 3.49Å; M887-L891 PolarHBondContact O-N 3.42Å; V888-L891 PolarHBondContact O-N 3.48Å; L891-V896 HydrophobicContact CD2-CB 4.25Å; L891-V896 HydrophobicContact CD2-CG1 4.14Å; L891-V896 PolarHBondContact O-N 3.02Å; L891-L897 PolarHBondContact O-N 3.49Å
892	I	74.1	Confident	70.6	Confident	45 Å²	45	64.1 Å²	64.1	23%	0.231	34%	0.34	C	S	.	.	H	α-helix	trans	-74.2	-51.1	173.6	-67.5	163.8	0	0	0	110.8	L784 T788 V888 A889 L890 G895 L897	L784-I892 HydrophobicContact CD1-CD1 4.01Å; T788-I892 HydrophobicContact CG2-CD1 3.58Å; V888-I892 HydrophobicContact CG1-CD1 4.06Å; V888-I892 VanDerWaalsContact O-CG1 3.32Å; V888-I892 WeakPolarHBondContact O-CG1 3.26Å; V888-I892 PolarHBondContact O-N 3.11Å; V888-I892 VanDerWaalsContact O-N 3.09Å; A889-I892 WeakPolarHBondContact O-CB 3.49Å; A889-I892 PolarHBondContact O-N 3.45Å; L890-I892 PolarHBondContact O-N 2.84Å; I892-G895 PolarHBondContact O-N 3.27Å; I892-L897 HydrophobicContact CG1-CD2 3.97Å
893	D	69.6	Low	68.4	Low	71 Å²	71	67 Å²	67	38%	0.38	36%	0.36	S	S	.	.	H	α-helix	trans	-71	-32.6	-175.2	-86.8	-32.7	0	0	0	113.8	Y783 A889 L890 G895	Y783-D893 PolarHBondContact OH-OD2 3.14Å; A889-D893 PolarHBondContact O-N 2.87Å; L890-D893 PolarHBondContact O-N 3.44Å; D893-G895 PolarHBondContact O-N 3.04Å
894	L	66.5	Low	66.5	Low	101 Å²	101	63.5 Å²	63.5	53%	0.529	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-7.3	170.5	-66.4	170	0	0	0	112.4	L890 V896	L890-L894 VanDerWaalsContact O-CB 3.24Å; L890-L894 WeakPolarHBondContact O-CB 3.29Å; L890-L894 VanDerWaalsContact O-CG 3.23Å; L890-L894 WeakPolarHBondContact O-CG 3.4Å; L890-L894 PolarHBondContact O-N 3.33Å; L894-V896 HydrophobicContact CB-CG2 3.85Å; L894-V896 PolarHBondContact O-N 2.79Å; L894-V896 VanDerWaalsContact O-N 3.11Å
895	G	62.3	Low	64.6	Low	23 Å²	23	66.7 Å²	66.7	24%	0.237	36%	0.362	C	S	.	.	S	Bend	trans	68.9	2.8	-177.5	0	0	0	0	0	114.4	I892 D893 L897 S898 H899	I892-G895 PolarHBondContact O-N 3.27Å; D893-G895 PolarHBondContact O-N 3.04Å; G895-L897 PolarHBondContact O-N 2.98Å; G895-S898 WeakPolarHBondContact O-CA 3.24Å; G895-S898 VanDerWaalsContact O-CB 3.31Å; G895-S898 WeakPolarHBondContact O-CB 3.44Å; G895-S898 PolarHBondContact O-N 3.49Å; G895-S898 PolarHBondContact O-OG 2.95Å; G895-H899 PolarHBondContact O-N 3.45Å
896	V	57.1	Low	62.8	Low	60 Å²	60	70.1 Å²	70.1	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-35.7	-179.9	178.6	0	0	0	0	110.7	L891 L894 S898 H899 L900	L891-V896 HydrophobicContact CD2-CB 4.25Å; L891-V896 HydrophobicContact CD2-CG1 4.14Å; L891-V896 PolarHBondContact O-N 3.02Å; L894-V896 HydrophobicContact CB-CG2 3.85Å; L894-V896 PolarHBondContact O-N 2.79Å; L894-V896 VanDerWaalsContact O-N 3.11Å; V896-S898 PolarHBondContact O-N 3.15Å; V896-H899 CarbonylContact O-C 3.56Å; V896-H899 WeakPolarHBondContact O-CA 3.3Å; V896-H899 WeakPolarHBondContact O-CB 3.44Å; V896-H899 PolarHBondContact O-N 3.41Å; V896-H899 VanDerWaalsContact O-N 3.08Å; V896-L900 HydrophobicContact CG1-CD1 3.96Å; V896-L900 HydrophobicContact CG1-CG 4.27Å; V896-L900 PolarHBondContact O-N 3.25Å
897	L	50.5	Low	61.1	Low	66 Å²	66	71.8 Å²	71.8	35%	0.346	39%	0.393	S	S	.	.	H	α-helix	trans	-62	-32.7	173.2	-160.5	76.7	0	0	0	112.2	L891 I892 G895 L900 I901	L891-L897 PolarHBondContact O-N 3.49Å; I892-L897 HydrophobicContact CG1-CD2 3.97Å; G895-L897 PolarHBondContact O-N 2.98Å; L897-L900 PolarHBondContact O-N 3.01Å; L897-I901 HydrophobicContact CD2-CD1 4.12Å; L897-I901 HydrophobicContact CG-CD1 3.87Å; L897-I901 HydrophobicContact CG-CG1 4.4Å; L897-I901 VanDerWaalsContact O-CB 3.3Å; L897-I901 WeakPolarHBondContact O-CB 3.46Å; L897-I901 WeakPolarHBondContact O-CD1 3.32Å; L897-I901 WeakPolarHBondContact O-CG1 3.43Å; L897-I901 PolarHBondContact O-N 3.24Å
898	S	52.1	Low	59.6	Low	77 Å²	77	73.2 Å²	73.2	54%	0.538	40%	0.402	S	S	.	.	H	α-helix	trans	-68.4	-38.2	173.8	82.6	0	0	0	0	111.4	G895 V896 H902	G895-S898 WeakPolarHBondContact O-CA 3.24Å; G895-S898 VanDerWaalsContact O-CB 3.31Å; G895-S898 WeakPolarHBondContact O-CB 3.44Å; G895-S898 PolarHBondContact O-N 3.49Å; G895-S898 PolarHBondContact O-OG 2.95Å; V896-S898 PolarHBondContact O-N 3.15Å; S898-H902 VanDerWaalsContact O-CB 3.23Å; S898-H902 WeakPolarHBondContact O-CB 3.13Å; S898-H902 PolarHBondContact O-N 2.92Å
899	H	49.9	Very low	57.8	Low	133 Å²	133	79.2 Å²	79.2	62%	0.616	43%	0.425	S	S	*	.	H	α-helix	trans	-68.1	-42.7	172.6	-90.8	-85.9	0	0	0	112.4	G895 V896 H902 C903	G895-H899 PolarHBondContact O-N 3.45Å; V896-H899 CarbonylContact O-C 3.56Å; V896-H899 WeakPolarHBondContact O-CA 3.3Å; V896-H899 WeakPolarHBondContact O-CB 3.44Å; V896-H899 PolarHBondContact O-N 3.41Å; V896-H899 VanDerWaalsContact O-N 3.08Å; H899-H902 CarbonylContact O-C 3.13Å; H899-H902 PolarHBondContact O-N 3.01Å; H899-C903 VanDerWaalsContact O-CB 3.32Å; H899-C903 WeakPolarHBondContact O-CB 3.32Å; H899-C903 PolarHBondContact O-N 2.98Å; H899-C903 PolarHBondContact O-SG 3Å
900	L	50.9	Low	56	Low	96 Å²	96	87.3 Å²	87.3	50%	0.503	46%	0.46	S	S	.	.	H	α-helix	trans	-64.6	-43.2	176	-76.9	166.9	0	0	0	111.9	V896 L897 H902 C903 A904	V896-L900 HydrophobicContact CG1-CD1 3.96Å; V896-L900 HydrophobicContact CG1-CG 4.27Å; V896-L900 PolarHBondContact O-N 3.25Å; L897-L900 PolarHBondContact O-N 3.01Å; L900-H902 VanDerWaalsContact C-N 3.31Å; L900-H902 PolarHBondContact O-N 3.27Å; L900-C903 PolarHBondContact O-N 3.48Å; L900-A904 VanDerWaalsContact O-CB 3.29Å; L900-A904 WeakPolarHBondContact O-CB 3.45Å; L900-A904 PolarHBondContact O-N 2.98Å
901	I	52.2	Low	54.6	Low	81 Å²	81	92.8 Å²	92.8	42%	0.415	49%	0.489	S	S	.	.	H	α-helix	trans	-68.1	-32.4	174.1	-66.7	166.5	0	0	0	110.9	L897 K905	L897-I901 HydrophobicContact CD2-CD1 4.12Å; L897-I901 HydrophobicContact CG-CD1 3.87Å; L897-I901 HydrophobicContact CG-CG1 4.4Å; L897-I901 VanDerWaalsContact O-CB 3.3Å; L897-I901 WeakPolarHBondContact O-CB 3.46Å; L897-I901 WeakPolarHBondContact O-CD1 3.32Å; L897-I901 WeakPolarHBondContact O-CG1 3.43Å; L897-I901 PolarHBondContact O-N 3.24Å; I901-K905 HydrophobicContact CG2-CD 4.08Å; I901-K905 VanDerWaalsContact O-CB 3.24Å; I901-K905 WeakPolarHBondContact O-CB 3.44Å; I901-K905 VanDerWaalsContact O-CG 3.26Å; I901-K905 WeakPolarHBondContact O-CG 3.45Å; I901-K905 PolarHBondContact O-N 3.46Å
902	H	48	Very low	52.7	Low	98 Å²	98	100.4 Å²	100.4	45%	0.454	51%	0.514	S	S	.	.	H	α-helix	trans	-70.2	-41.3	173	-150.8	70.9	0	0	0	111.3	S898 H899 L900 K905 L906	S898-H902 VanDerWaalsContact O-CB 3.23Å; S898-H902 WeakPolarHBondContact O-CB 3.13Å; S898-H902 PolarHBondContact O-N 2.92Å; H899-H902 CarbonylContact O-C 3.13Å; H899-H902 PolarHBondContact O-N 3.01Å; L900-H902 VanDerWaalsContact C-N 3.31Å; L900-H902 PolarHBondContact O-N 3.27Å; H902-K905 CarbonylContact O-C 3.44Å; H902-K905 PolarHBondContact O-N 3Å; H902-L906 VanDerWaalsContact O-CB 3.23Å; H902-L906 WeakPolarHBondContact O-CB 3.43Å; H902-L906 WeakPolarHBondContact O-CD1 3.42Å; H902-L906 VanDerWaalsContact O-CG 3.27Å; H902-L906 WeakPolarHBondContact O-CG 3.36Å; H902-L906 PolarHBondContact O-N 3.26Å
903	C	44.7	Very low	50.8	Low	67 Å²	67	109.5 Å²	109.5	45%	0.453	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-44	174.4	-75.1	0	0	0	0	111.9	H899 L900 L906 T907	H899-C903 VanDerWaalsContact O-CB 3.32Å; H899-C903 WeakPolarHBondContact O-CB 3.32Å; H899-C903 PolarHBondContact O-N 2.98Å; H899-C903 PolarHBondContact O-SG 3Å; L900-C903 PolarHBondContact O-N 3.48Å; C903-L906 CarbonylContact O-C 3.41Å; C903-L906 WeakPolarHBondContact O-CA 3.36Å; C903-L906 WeakPolarHBondContact O-CB 3.46Å; C903-L906 PolarHBondContact O-N 3.46Å; C903-L906 VanDerWaalsContact O-N 3.07Å; C903-T907 PolarHBondContact O-N 3.15Å; C903-T907 PolarHBondContact O-OG1 2.03Å
904	A	51.2	Low	48.9	Very low	48 Å²	48	117.7 Å²	117.7	40%	0.397	57%	0.571	S	S	.	*	H	α-helix	trans	-65.5	-38.9	174.3	0	0	0	0	0	112.1	L900 L906 T907 L908	L900-A904 VanDerWaalsContact O-CB 3.29Å; L900-A904 WeakPolarHBondContact O-CB 3.45Å; L900-A904 PolarHBondContact O-N 2.98Å; A904-L906 VanDerWaalsContact C-N 3.29Å; A904-L906 PolarHBondContact O-N 3.18Å; A904-T907 WeakPolarHBondContact CA-OG1 3.38Å; A904-T907 PolarHBondContact O-OG1 2.88Å; A904-L908 WeakPolarHBondContact O-CB 3.27Å; A904-L908 PolarHBondContact O-N 3.29Å
905	K	50.1	Low	47.2	Very low	137 Å²	137	123.9 Å²	123.9	60%	0.596	59%	0.587	S	S	*	*	H	α-helix	trans	-69.8	-24.8	170.1	-76	175.1	178.9	172.4	0	112.8	I901 H902 K909	I901-K905 HydrophobicContact CG2-CD 4.08Å; I901-K905 VanDerWaalsContact O-CB 3.24Å; I901-K905 WeakPolarHBondContact O-CB 3.44Å; I901-K905 VanDerWaalsContact O-CG 3.26Å; I901-K905 WeakPolarHBondContact O-CG 3.45Å; I901-K905 PolarHBondContact O-N 3.46Å; H902-K905 CarbonylContact O-C 3.44Å; H902-K905 PolarHBondContact O-N 3Å; K905-K909 WeakPolarHBondContact O-CB 3.43Å; K905-K909 WeakPolarHBondContact O-CG 3.33Å; K905-K909 PolarHBondContact O-N 3.42Å
906	L	49.6	Very low	45.5	Very low	78 Å²	78	129.4 Å²	129.4	41%	0.408	61%	0.611	S	S	.	*	H	α-helix	trans	-79.3	-37.5	174.7	-87.1	159.9	0	0	0	111.8	H902 C903 A904 K909 K910	H902-L906 VanDerWaalsContact O-CB 3.23Å; H902-L906 WeakPolarHBondContact O-CB 3.43Å; H902-L906 WeakPolarHBondContact O-CD1 3.42Å; H902-L906 VanDerWaalsContact O-CG 3.27Å; H902-L906 WeakPolarHBondContact O-CG 3.36Å; H902-L906 PolarHBondContact O-N 3.26Å; C903-L906 CarbonylContact O-C 3.41Å; C903-L906 WeakPolarHBondContact O-CA 3.36Å; C903-L906 WeakPolarHBondContact O-CB 3.46Å; C903-L906 PolarHBondContact O-N 3.46Å; C903-L906 VanDerWaalsContact O-N 3.07Å; A904-L906 VanDerWaalsContact C-N 3.29Å; A904-L906 PolarHBondContact O-N 3.18Å; L906-K909 PolarHBondContact O-N 3.31Å; L906-K910 WeakPolarHBondContact O-CB 3.3Å; L906-K910 VanDerWaalsContact O-CG 3.26Å; L906-K910 WeakPolarHBondContact O-CG 3.46Å; L906-K910 PolarHBondContact O-N 3.06Å
907	T	50	Low	44.2	Very low	86 Å²	86	136 Å²	136	53%	0.528	64%	0.638	S	S	.	*	H	α-helix	trans	-68.2	-44.8	172.2	49.8	0	0	0	0	110.6	C903 A904 K909 K910 L911	C903-T907 PolarHBondContact O-N 3.15Å; C903-T907 PolarHBondContact O-OG1 2.03Å; A904-T907 WeakPolarHBondContact CA-OG1 3.38Å; A904-T907 PolarHBondContact O-OG1 2.88Å; T907-K909 VanDerWaalsContact C-N 3.31Å; T907-K909 PolarHBondContact O-N 2.76Å; T907-K910 PolarHBondContact O-N 3.32Å; T907-L911 PolarHBondContact O-N 3.42Å
908	L	52.9	Low	43.1	Very low	132 Å²	132	139.1 Å²	139.1	69%	0.691	66%	0.659	S	S	*	*	H	α-helix	trans	-67.9	-23.3	173.5	-76.2	160	0	0	0	114.1	A904	A904-L908 WeakPolarHBondContact O-CB 3.27Å; A904-L908 PolarHBondContact O-N 3.29Å
909	K	47.2	Very low	41.8	Very low	159 Å²	159	145.4 Å²	145.4	69%	0.691	67%	0.671	S	S	*	*	H	α-helix	trans	-85.6	-34.8	169.8	-89	-171.9	163.9	-169.9	0	113.9	K905 L906 T907 L911 R912 R913	K905-K909 WeakPolarHBondContact O-CB 3.43Å; K905-K909 WeakPolarHBondContact O-CG 3.33Å; K905-K909 PolarHBondContact O-N 3.42Å; L906-K909 PolarHBondContact O-N 3.31Å; T907-K909 VanDerWaalsContact C-N 3.31Å; T907-K909 PolarHBondContact O-N 2.76Å; K909-L911 PolarHBondContact O-N 3.15Å; K909-R912 PolarHBondContact O-N 2.98Å; K909-R913 PolarHBondContact O-N 2.98Å
910	K	41.6	Very low	40.8	Very low	172 Å²	172	143.9 Å²	143.9	75%	0.748	68%	0.676	S	S	*	*	H	α-helix	trans	-60.4	-28.6	-180	-89.2	-178.2	171.8	-172.9	0	112	L906 T907	L906-K910 WeakPolarHBondContact O-CB 3.3Å; L906-K910 VanDerWaalsContact O-CG 3.26Å; L906-K910 WeakPolarHBondContact O-CG 3.46Å; L906-K910 PolarHBondContact O-N 3.06Å; T907-K910 PolarHBondContact O-N 3.32Å
911	L	47.4	Very low	39.6	Very low	160 Å²	160	145.4 Å²	145.4	84%	0.838	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-10.2	173	-82	158.1	0	0	0	115.2	T907 K909	T907-L911 PolarHBondContact O-N 3.42Å; K909-L911 PolarHBondContact O-N 3.15Å
912	R	39.4	Very low	38.4	Very low	219 Å²	219	148 Å²	148	83%	0.826	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	6.7	-167.9	-145.8	176	-180	168.9	2.3	117.4	K909	K909-R912 PolarHBondContact O-N 2.98Å
913	R	33.7	Very low	37.3	Very low	235 Å²	235	146.1 Å²	146.1	89%	0.887	71%	0.711	S	S	*	*			trans	-162	89.1	164.6	-109.9	154.8	-165	-175.6	3.6	113.2	K909	K909-R913 PolarHBondContact O-N 2.98Å
914	R	30	Very low	36.4	Very low	244 Å²	244	150 Å²	150	92%	0.921	73%	0.726	S	S	*	*			trans	-64.8	162.5	140.3	-82.6	-180	167.6	176.6	-4.4	108.7
915	R	29.9	Very low	35.2	Very low	230 Å²	230	156 Å²	156	87%	0.868	75%	0.746	S	S	*	*	S	Bend	trans	96.1	106.5	169.4	-153.3	171.8	-73.1	172.4	-3.5	115.6
916	N	27.5	Very low	34.2	Very low	140 Å²	140	156.9 Å²	156.9	75%	0.749	75%	0.75	S	S	*	*			trans	81	73.2	157.8	-56.5	8.8	0	0	0	119.1
917	E	29.8	Very low	33.1	Very low	199 Å²	199	159.4 Å²	159.4	93%	0.93	77%	0.769	S	S	*	*			trans	-82.4	113	140.9	-78.6	-178.2	147.4	0	0	108.3
918	V	27.6	Very low	32.4	Very low	130 Å²	130	163.6 Å²	163.6	79%	0.788	78%	0.78	S	S	*	*			trans	-84.2	114	167.4	174.5	0	0	0	0	107.6
919	R	24.5	Very low	31.8	Very low	210 Å²	210	163.9 Å²	163.9	79%	0.792	79%	0.787	S	S	*	*			trans	-81.6	123.3	175.1	-174.2	177.9	-175.3	164.5	1.4	108.9	D921	R919-D921 IonicContact CZ-OD2 3.46Å; R919-D921 IonicContact NE-OD2 3.03Å; R919-D921 PolarHBondContact NE-OD2 2.64Å; R919-D921 IonicContact NH2-OD2 2.75Å; R919-D921 PolarHBondContact NH2-OD2 2.94Å; R919-D921 VanDerWaalsContact NH2-OD2 3.16Å
920	S	27.5	Very low	32	Very low	101 Å²	101	158.2 Å²	158.2	71%	0.706	76%	0.764	S	S	*	*			trans	-130.5	78.8	169.1	63.7	0	0	0	0	109.4	V922	S920-V922 PolarHBondContact O-N 3.07Å; S920-V922 VanDerWaalsContact O-N 3.12Å
921	D	26.3	Very low	32.5	Very low	127 Å²	127	153 Å²	153	68%	0.679	75%	0.748	S	S	*	*			trans	-72.3	91.1	167.4	-74.1	-43.7	0	0	0	108.8	R919	R919-D921 IonicContact CZ-OD2 3.46Å; R919-D921 IonicContact NE-OD2 3.03Å; R919-D921 PolarHBondContact NE-OD2 2.64Å; R919-D921 IonicContact NH2-OD2 2.75Å; R919-D921 PolarHBondContact NH2-OD2 2.94Å; R919-D921 VanDerWaalsContact NH2-OD2 3.16Å
922	V	26.6	Very low	32.9	Very low	135 Å²	135	148.3 Å²	148.3	82%	0.818	72%	0.722	S	S	*	*			trans	-145.6	124.6	164.4	-169.4	0	0	0	0	105.7	S920	S920-V922 PolarHBondContact O-N 3.07Å; S920-V922 VanDerWaalsContact O-N 3.12Å
923	G	24.8	Very low	34.2	Very low	60 Å²	60	141.4 Å²	141.4	62%	0.619	70%	0.699	S	S	*	*			cis	130.1	99.7	13.9	0	0	0	0	0	108.2
924	L	26.8	Very low	35.5	Very low	147 Å²	147	137 Å²	137	77%	0.77	69%	0.691	S	S	*	*			trans	-179.8	124.1	141	-121.2	76	0	0	0	110.5	F926	L924-F926 HydrophobicContact CB-CD2 4.46Å; L924-F926 HydrophobicContact CD2-CD2 4.11Å; L924-F926 HydrophobicContact CD2-CE2 3.75Å; L924-F926 PolarHBondContact O-N 3.3Å
925	H	26	Very low	37	Very low	176 Å²	176	126.7 Å²	126.7	82%	0.815	66%	0.656	S	S	*	*			trans	-69.3	112.5	162.9	-86.3	-100.8	0	0	0	109.2
926	F	29.2	Very low	38.6	Very low	154 Å²	154	124.7 Å²	124.7	68%	0.675	66%	0.662	S	S	*	*			trans	-100.7	73.5	167.9	-110.1	-79.3	0	0	0	111.1	L924 K928	L924-F926 HydrophobicContact CB-CD2 4.46Å; L924-F926 HydrophobicContact CD2-CD2 4.11Å; L924-F926 HydrophobicContact CD2-CE2 3.75Å; L924-F926 PolarHBondContact O-N 3.3Å; F926-K928 VanDerWaalsContact C-N 3.31Å; F926-K928 HydrophobicContact CE1-CD 4.34Å; F926-K928 PolarHBondContact O-N 3Å
927	T	27.1	Very low	40.7	Very low	131 Å²	131	119.4 Å²	119.4	80%	0.804	64%	0.637	S	S	*	*			trans	-82.6	76.8	162.3	47.5	0	0	0	0	109.4
928	K	35.5	Very low	43	Very low	174 Å²	174	113.7 Å²	113.7	76%	0.757	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-102.4	119.7	156.1	-87.7	-172.2	174.1	-179.8	0	108	F926 L930	F926-K928 VanDerWaalsContact C-N 3.31Å; F926-K928 HydrophobicContact CE1-CD 4.34Å; F926-K928 PolarHBondContact O-N 3Å; K928-L930 PolarHBondContact O-N 3.19Å
929	T	39.4	Very low	45.5	Very low	138 Å²	138	110.1 Å²	110.1	85%	0.847	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-53.5	117.3	177.1	31.8	0	0	0	0	109.9
930	L	51.6	Low	48	Very low	40 Å²	40	100.2 Å²	100.2	21%	0.209	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-54.7	124.4	165.5	-88.8	149.4	0	0	0	107.4	K928 H932 T965 L1150 L1151	K928-L930 PolarHBondContact O-N 3.19Å; L930-H932 VanDerWaalsContact CB-CD2 3.49Å; L930-H932 WeakPolarHBondContact CB-CD2 3.08Å; L930-H932 WeakPolarHBondContact CB-NE2 3.32Å; L930-H932 PolarHBondContact O-CD2 3.31Å; L930-H932 PolarHBondContact O-N 3.5Å; L930-T965 WeakPolarHBondContact CD1-OG1 3.5Å; L930-L1150 HydrophobicContact CD1-CD2 3.92Å; L930-L1150 HydrophobicContact CD2-CD2 3.95Å; L930-L1151 WeakPolarHBondContact CD2-O 3.08Å
931	P	52.8	Low	50.7	Low	64 Å²	64	95.4 Å²	95.4	42%	0.416	53%	0.525	S	S	.	.			trans	-72.9	101.5	178.7	31.9	-34.9	0	0	0	107.1	F1158 Q1162	P931-F1158 HydrophobicContact CB-CZ 4.47Å; P931-F1158 WeakPolarHBondContact O-CE1 3.43Å; P931-F1158 VanDerWaalsContact O-CZ 3.3Å; P931-F1158 WeakPolarHBondContact O-CZ 3.15Å; P931-Q1162 VanDerWaalsContact CB-NE2 3.33Å
932	H	55.6	Low	53.4	Low	61 Å²	61	90.8 Å²	90.8	28%	0.282	50%	0.503	S	S	.	.	B	Isolated β-bridge	trans	-109.9	128.9	-178	-77.6	-63.8	0	0	0	110.4	L930 I934 C1153	L930-H932 VanDerWaalsContact CB-CD2 3.49Å; L930-H932 WeakPolarHBondContact CB-CD2 3.08Å; L930-H932 WeakPolarHBondContact CB-NE2 3.32Å; L930-H932 PolarHBondContact O-CD2 3.31Å; L930-H932 PolarHBondContact O-N 3.5Å; H932-I934 PolarHBondContact O-N 2.85Å; H932-C1153 PolarHBondContact ND1-O 2.79Å; H932-C1153 VanDerWaalsContact ND1-O 3.16Å
933	E	65.7	Low	56.1	Low	73 Å²	73	84.5 Å²	84.5	34%	0.341	47%	0.465	S	S	.	.			trans	-72.7	116.5	164.4	-177.3	173.5	-152.2	0	0	108.3	P935 R1141 S1155 F1158	E933-P935 WeakPolarHBondContact O-CD 3.24Å; E933-R1141 VanDerWaalsContact O-CZ 3.22Å; E933-R1141 PolarHBondContact O-NH1 2.98Å; E933-R1141 PolarHBondContact O-NH2 3.35Å; E933-S1155 PolarHBondContact OE1-OG 3.01Å; E933-S1155 WeakPolarHBondContact OE2-CB 3.33Å; E933-S1155 PolarHBondContact OE2-N 3.29Å; E933-S1155 PolarHBondContact OE2-OG 2.88Å; E933-F1158 HydrophobicContact CB-CD1 4.21Å; E933-F1158 HydrophobicContact CB-CD2 4.04Å; E933-F1158 HydrophobicContact CB-CE1 4.1Å; E933-F1158 HydrophobicContact CB-CE2 3.99Å; E933-F1158 HydrophobicContact CB-CG 4.13Å; E933-F1158 HydrophobicContact CB-CZ 3.98Å; E933-F1158 VanDerWaalsContact N-CZ 3.33Å; E933-F1158 WeakPolarHBondContact OE2-CB 3.26Å
934	I	60.3	Low	58.8	Low	143 Å²	143	83.9 Å²	83.9	73%	0.733	45%	0.451	S	S	*	.			trans	-88.1	112.1	176.7	-54.2	173.6	0	0	0	107.9	H932	H932-I934 PolarHBondContact O-N 2.85Å
935	P	61.8	Low	61.2	Low	27 Å²	27	79.5 Å²	79.5	18%	0.175	43%	0.432	C	S	.	.			trans	-82.7	158.4	175.9	35.6	-31.5	0	0	0	111	E933 A937 Y969	E933-P935 WeakPolarHBondContact O-CD 3.24Å; P935-A937 PolarHBondContact O-N 3.35Å; P935-A937 VanDerWaalsContact O-N 3.1Å; P935-Y969 HydrophobicContact CG-CD1 3.54Å; P935-Y969 HydrophobicContact CG-CD2 3.55Å; P935-Y969 HydrophobicContact CG-CE1 3.6Å; P935-Y969 HydrophobicContact CG-CE2 3.63Å; P935-Y969 HydrophobicContact CG-CG 3.51Å
936	L	64.7	Low	63.8	Low	189 Å²	189	71.1 Å²	71.1	99%	0.99	39%	0.394	S	S	*	.	S	Bend	trans	-70.1	1.4	173.5	-76.6	82.6	0	0	0	114.1
937	A	70.8	Confident	66.2	Low	28 Å²	28	65.5 Å²	65.5	23%	0.231	37%	0.374	C	S	.	.	S	Bend	trans	-84	146.8	-178.7	0	0	0	0	0	111.5	P935 Y969	P935-A937 PolarHBondContact O-N 3.35Å; P935-A937 VanDerWaalsContact O-N 3.1Å; A937-Y969 WeakPolarHBondContact O-CD1 3.45Å
938	P	79.3	Confident	68.8	Low	79 Å²	79	59.8 Å²	59.8	51%	0.513	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-65	146.5	176.1	27.5	-33.4	0	0	0	111.5	G940 Y969 E970	P938-G940 PolarHBondContact O-N 2.98Å; P938-Y969 WeakPolarHBondContact O-CA 3.28Å; P938-E970 HydrophobicContact CG-CB 4.14Å; P938-E970 HydrophobicContact CG-CG 4.26Å; P938-E970 PolarHBondContact O-N 2.77Å
939	V	78.4	Confident	70.7	Confident	56 Å²	56	52.6 Å²	52.6	34%	0.339	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	121.9	173.6	178.9	0	0	0	0	108.5	D967 F968 Y969 P1005	V939-D967 HydrophobicContact CG1-CB 4.26Å; V939-D967 HydrophobicContact CG2-CB 4.45Å; V939-F968 CarbonylContact C-O 3.6Å; V939-Y969 HydrophobicContact CG2-CD1 3.95Å; V939-Y969 HydrophobicContact CG2-CE1 3.63Å; V939-P1005 WeakPolarHBondContact O-CG 3.35Å
940	G	77.8	Confident	72	Confident	2 Å²	2	50 Å²	50	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-19.8	177.4	0	0	0	0	0	114.4	P938 F968 P1005	P938-G940 PolarHBondContact O-N 2.98Å; G940-F968 PolarHBondContact N-O 3.02Å; G940-P1005 WeakPolarHBondContact O-CD 3.43Å
941	L	84	Confident	72.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	131.3	169.9	-169.9	152.7	0	0	0	109.6	V943 F968 L991 I1002 V1004 I1019 V1094	L941-V943 HydrophobicContact CD2-CG2 3.57Å; L941-F968 HydrophobicContact CB-CB 4.33Å; L941-F968 HydrophobicContact CB-CD2 4.24Å; L941-F968 HydrophobicContact CD2-CD2 3.65Å; L941-F968 HydrophobicContact CD2-CE2 3.98Å; L941-F968 PolarHBondContact N-O 3.26Å; L941-F968 VanDerWaalsContact N-O 3.13Å; L941-F968 PolarHBondContact O-N 3.16Å; L941-L991 HydrophobicContact CD1-CD2 4.23Å; L941-L991 HydrophobicContact CD2-CD2 3.52Å; L941-I1002 HydrophobicContact CD1-CG2 4.5Å; L941-I1002 HydrophobicContact CD2-CG2 4.01Å; L941-I1002 HydrophobicContact CG-CG2 4.32Å; L941-V1004 HydrophobicContact CD1-CG2 4.34Å; L941-I1019 HydrophobicContact CD1-CD1 4.38Å; L941-V1094 HydrophobicContact CD1-CG1 4.15Å
942	S	83	Confident	71.8	Confident	30 Å²	30	61.7 Å²	61.7	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.7	175.5	-179	0	0	0	0	111.3	D967 I1002 L1003	S942-D967 WeakPolarHBondContact CA-OD1 3.43Å; S942-D967 WeakPolarHBondContact CB-OD1 3.41Å; S942-D967 PolarHBondContact OG-OD1 3.31Å; S942-I1002 WeakPolarHBondContact O-CA 3.45Å; S942-L1003 PolarHBondContact N-O 2.74Å; S942-L1003 PolarHBondContact O-N 2.9Å
943	V	84.1	Confident	71.3	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.018	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.8	177.1	-175.9	0	0	0	0	108.8	L941 L946 T965 V966 F968 L991	L941-V943 HydrophobicContact CD2-CG2 3.57Å; V943-L946 HydrophobicContact CG1-CB 3.64Å; V943-L946 HydrophobicContact CG1-CD1 4.26Å; V943-L946 HydrophobicContact CG1-CD2 4.12Å; V943-L946 HydrophobicContact CG1-CG 4.23Å; V943-T965 CarbonylContact O-C 3.58Å; V943-T965 VanDerWaalsContact O-CA 3.26Å; V943-T965 WeakPolarHBondContact O-CA 3.43Å; V943-V966 WeakPolarHBondContact CB-O 2.88Å; V943-V966 PolarHBondContact N-O 3Å; V943-V966 PolarHBondContact O-N 3.31Å; V943-F968 HydrophobicContact CG2-CD2 4.48Å; V943-F968 HydrophobicContact CG2-CE2 3.87Å; V943-L991 HydrophobicContact CG2-CD2 3.62Å
944	S	80.3	Confident	70.3	Confident	46 Å²	46	66.9 Å²	66.9	32%	0.322	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	128.5	176.1	65.3	0	0	0	0	112.1	L946 G1000 S1001	S944-L946 PolarHBondContact O-N 3.34Å; S944-G1000 CarbonylContact O-C 3.55Å; S944-G1000 WeakPolarHBondContact O-CA 3.48Å; S944-S1001 PolarHBondContact N-O 2.92Å; S944-S1001 PolarHBondContact O-N 2.86Å; S944-S1001 PolarHBondContact OG-OG 3.46Å
945	S	78	Confident	69.6	Low	55 Å²	55	67.8 Å²	67.8	39%	0.385	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.8	33.7	169	-51.1	0	0	0	0	116.4	S947 N963 V964 T965 G1000	S945-S947 PolarHBondContact O-N 3.14Å; S945-N963 WeakPolarHBondContact CA-OD1 3.26Å; S945-N963 WeakPolarHBondContact CB-OD1 3.38Å; S945-N963 PolarHBondContact OG-OD1 2.82Å; S945-V964 PolarHBondContact N-O 3.34Å; S945-T965 VanDerWaalsContact N-CG2 3.33Å; S945-G1000 WeakPolarHBondContact O-CA 3.44Å
946	L	80.8	Confident	68.7	Low	0 Å²	0	72.9 Å²	72.9	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	124.1	-170.4	-163.4	86	0	0	0	111.7	V943 S944 L961 N963 V964 L987 L990 P997 G999 I1002	V943-L946 HydrophobicContact CG1-CB 3.64Å; V943-L946 HydrophobicContact CG1-CD1 4.26Å; V943-L946 HydrophobicContact CG1-CD2 4.12Å; V943-L946 HydrophobicContact CG1-CG 4.23Å; S944-L946 PolarHBondContact O-N 3.34Å; L946-L961 HydrophobicContact CD2-CD1 4.48Å; L946-N963 PolarHBondContact O-N 2.94Å; L946-V964 HydrophobicContact CB-CB 4.27Å; L946-V964 WeakPolarHBondContact CB-O 3.15Å; L946-V964 PolarHBondContact N-O 3.44Å; L946-V964 PolarHBondContact O-N 3.35Å; L946-L987 HydrophobicContact CD2-CD1 3.42Å; L946-L987 VanDerWaalsContact CD2-CD1 3.42Å; L946-L990 HydrophobicContact CD2-CB 4Å; L946-L990 HydrophobicContact CD2-CD1 3.68Å; L946-L990 HydrophobicContact CD2-CG 4.41Å; L946-L990 HydrophobicContact CG-CD1 4.26Å; L946-P997 HydrophobicContact CD1-CB 3.82Å; L946-G999 WeakPolarHBondContact CA-O 3.5Å; L946-I1002 HydrophobicContact CD1-CD1 3.94Å; L946-I1002 HydrophobicContact CD1-CG1 3.85Å
947	S	80.1	Confident	68.3	Low	37 Å²	37	67.2 Å²	67.2	26%	0.259	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143	178.4	58.7	0	0	0	0	112	S945 L961 H998 G999	S945-S947 PolarHBondContact O-N 3.14Å; S947-L961 WeakPolarHBondContact CA-O 3.24Å; S947-H998 PolarHBondContact O-N 3.02Å; S947-G999 PolarHBondContact N-O 2.85Å; S947-G999 PolarHBondContact O-N 2.84Å; S947-G999 WeakPolarHBondContact OG-CA 3.44Å; S947-G999 PolarHBondContact OG-N 2.93Å; S947-G999 PolarHBondContact OG-O 3.02Å
948	H	81.2	Confident	67.6	Low	10 Å²	10	68 Å²	68	5%	0.046	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	136.1	-179.8	-167.4	94.4	0	0	0	112.5	F950 I960 L961 L990 T996 H998	H948-F950 AromaticContact CD2-CD2 3.77Å; H948-F950 AromaticContact CD2-CE2 3.4Å; H948-F950 WeakPolarHBondContact CD2-CE2 3.42Å; H948-F950 AromaticContact CD2-CZ 3.96Å; H948-F950 AromaticContact NE2-CD2 3.84Å; H948-F950 AromaticContact NE2-CE1 3.96Å; H948-F950 AromaticContact NE2-CE2 3.37Å; H948-F950 WeakPolarHBondContact NE2-CE2 3.44Å; H948-F950 AromaticContact NE2-CZ 3.44Å; H948-F950 WeakPolarHBondContact NE2-CZ 3.39Å; H948-I960 PolarHBondContact O-N 3.24Å; H948-L961 PolarHBondContact N-O 2.91Å; H948-L961 PolarHBondContact O-N 3.26Å; H948-L990 HydrophobicContact CB-CD1 3.92Å; H948-T996 PolarHBondContact CE1-O 2.88Å; H948-T996 PolarHBondContact ND1-O 2.94Å; H948-H998 AromaticContact CE1-CE1 3.54Å; H948-H998 AromaticContact CE1-ND1 3.52Å; H948-H998 AromaticContact CG-ND1 3.5Å; H948-H998 AromaticContact ND1-CE1 3.64Å; H948-H998 AromaticContact ND1-ND1 3.12Å; H948-H998 PolarHBondContact ND1-ND1 3.12Å; H948-H998 VanDerWaalsContact ND1-ND1 3.12Å; H948-H998 AromaticContact NE2-CE1 3.93Å
949	S	74.4	Confident	67	Low	24 Å²	24	66.9 Å²	66.9	17%	0.168	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145.2	177.8	78	0	0	0	0	111.6	A958 H998	S949-A958 CarbonylContact C-O 3.49Å; S949-A958 WeakPolarHBondContact CA-O 3.3Å; S949-H998 PolarHBondContact N-ND1 3.31Å; S949-H998 PolarHBondContact O-CE1 3.17Å; S949-H998 PolarHBondContact O-NE2 2.94Å
950	F	66.6	Low	66.7	Low	82 Å²	82	66.4 Å²	66.4	36%	0.36	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	122	174	-74	-95.8	0	0	0	110.1	H948 K952 A958 I960 T986 L995	H948-F950 AromaticContact CD2-CD2 3.77Å; H948-F950 AromaticContact CD2-CE2 3.4Å; H948-F950 WeakPolarHBondContact CD2-CE2 3.42Å; H948-F950 AromaticContact CD2-CZ 3.96Å; H948-F950 AromaticContact NE2-CD2 3.84Å; H948-F950 AromaticContact NE2-CE1 3.96Å; H948-F950 AromaticContact NE2-CE2 3.37Å; H948-F950 WeakPolarHBondContact NE2-CE2 3.44Å; H948-F950 AromaticContact NE2-CZ 3.44Å; H948-F950 WeakPolarHBondContact NE2-CZ 3.39Å; F950-K952 PolarHBondContact O-N 3.17Å; F950-A958 PolarHBondContact N-O 2.83Å; F950-A958 WeakPolarHBondContact O-CB 3.44Å; F950-A958 PolarHBondContact O-N 3.06Å; F950-I960 HydrophobicContact CD2-CD1 3.36Å; F950-I960 HydrophobicContact CD2-CG1 3.91Å; F950-I960 HydrophobicContact CE2-CD1 3.72Å; F950-I960 HydrophobicContact CE2-CG1 4.43Å; F950-I960 HydrophobicContact CG-CD1 4.37Å; F950-T986 HydrophobicContact CE2-CG2 4.02Å; F950-L995 HydrophobicContact CZ-CD1 3.99Å; F950-L995 HydrophobicContact CZ-CD2 4.28Å
951	R	55.9	Low	66.8	Low	207 Å²	207	66.3 Å²	66.3	78%	0.781	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	109.6	172.2	-75.4	-177.4	172.7	-177.8	-2.8	110
952	K	44.9	Very low	66.6	Low	143 Å²	143	68.9 Å²	68.9	62%	0.622	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	124.2	174	-161.9	-180	-173.1	-177.5	0	108.8	F950 G954	F950-K952 PolarHBondContact O-N 3.17Å; K952-G954 PolarHBondContact O-N 3.44Å
953	N	44.6	Very low	66.3	Low	175 Å²	175	72.2 Å²	72.2	94%	0.936	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-9.1	81.7	-178.7	-73.7	-0.2	0	0	0	116.6
954	G	45.2	Very low	66.2	Low	68 Å²	68	72.1 Å²	72.1	70%	0.701	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.6	-35.6	152.4	0	0	0	0	0	119	K952	K952-G954 PolarHBondContact O-N 3.44Å
955	N	44.8	Very low	66.3	Low	162 Å²	162	72.1 Å²	72.1	87%	0.866	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.4	-14.3	-167.8	-98.2	-6.2	0	0	0	120.2
956	I	45	Very low	66.7	Low	135 Å²	135	69.8 Å²	69.8	69%	0.692	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	128.3	175.9	-49.7	-179.7	0	0	0	110.8	A958	I956-A958 PolarHBondContact O-N 3.06Å
957	P	54.8	Low	66.9	Low	70 Å²	70	72.5 Å²	72.5	46%	0.455	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	119.6	172.3	29.6	-32.3	0	0	0	110.7	V959	P957-V959 PolarHBondContact O-N 3.38Å
958	A	57.4	Low	67.3	Low	44 Å²	44	70.9 Å²	70.9	36%	0.364	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	90.7	173.6	0	0	0	0	0	109.2	S949 F950 I956 I960	S949-A958 CarbonylContact C-O 3.49Å; S949-A958 WeakPolarHBondContact CA-O 3.3Å; F950-A958 PolarHBondContact N-O 2.83Å; F950-A958 WeakPolarHBondContact O-CB 3.44Å; F950-A958 PolarHBondContact O-N 3.06Å; I956-A958 PolarHBondContact O-N 3.06Å; A958-I960 WeakPolarHBondContact O-CG1 3.46Å; A958-I960 PolarHBondContact O-N 2.91Å
959	V	65.2	Low	67.6	Low	56 Å²	56	71 Å²	71	34%	0.339	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	129.9	172.7	-172.1	0	0	0	0	109.3	P957 T962 K1148	P957-V959 PolarHBondContact O-N 3.38Å; V959-T962 HydrophobicContact CG1-CG2 3.41Å; V959-T962 VanDerWaalsContact CG1-CG2 3.41Å; V959-K1148 VanDerWaalsContact O-CD 3.26Å; V959-K1148 WeakPolarHBondContact O-CD 3.39Å; V959-K1148 WeakPolarHBondContact O-CE 3.5Å; V959-K1148 PolarHBondContact O-NZ 3.22Å
960	I	72.5	Confident	68.2	Low	46 Å²	46	72.8 Å²	72.8	24%	0.236	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-30.3	-179.2	-58.9	-160.9	0	0	0	112.4	H948 F950 A958 T986 K1148	H948-I960 PolarHBondContact O-N 3.24Å; F950-I960 HydrophobicContact CD2-CD1 3.36Å; F950-I960 HydrophobicContact CD2-CG1 3.91Å; F950-I960 HydrophobicContact CE2-CD1 3.72Å; F950-I960 HydrophobicContact CE2-CG1 4.43Å; F950-I960 HydrophobicContact CG-CD1 4.37Å; A958-I960 WeakPolarHBondContact O-CG1 3.46Å; A958-I960 PolarHBondContact O-N 2.91Å; I960-T986 HydrophobicContact CG2-CG2 4.24Å; I960-K1148 VanDerWaalsContact O-CB 3.25Å; I960-K1148 WeakPolarHBondContact O-CB 3.21Å; I960-K1148 WeakPolarHBondContact O-CG 3.49Å
961	L	80.1	Confident	69.1	Low	0 Å²	0	70 Å²	70	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.4	174.3	-65.1	170.5	0	0	0	109.3	L946 S947 H948 V964 T986 L987 L990 L1145 K1148	L946-L961 HydrophobicContact CD2-CD1 4.48Å; S947-L961 WeakPolarHBondContact CA-O 3.24Å; H948-L961 PolarHBondContact N-O 2.91Å; H948-L961 PolarHBondContact O-N 3.26Å; L961-V964 HydrophobicContact CB-CG2 4.45Å; L961-V964 HydrophobicContact CD2-CG2 4.27Å; L961-T986 HydrophobicContact CD1-CG2 4.08Å; L961-L987 HydrophobicContact CD1-CB 3.95Å; L961-L987 HydrophobicContact CD1-CD1 4.5Å; L961-L990 HydrophobicContact CD1-CD1 3.56Å; L961-L1145 HydrophobicContact CD2-CD1 4.27Å; L961-L1145 HydrophobicContact CD2-CD2 4.19Å; L961-K1148 WeakPolarHBondContact CA-O 3.32Å
962	T	79	Confident	70.6	Confident	53 Å²	53	61.8 Å²	61.8	33%	0.325	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	116.4	179.9	43.4	0	0	0	0	110.2	V959 V964 K1148 T1149	V959-T962 HydrophobicContact CG1-CG2 3.41Å; V959-T962 VanDerWaalsContact CG1-CG2 3.41Å; T962-V964 PolarHBondContact O-N 3.2Å; T962-K1148 PolarHBondContact N-O 3.23Å; T962-K1148 PolarHBondContact OG1-O 3.41Å; T962-T1149 WeakPolarHBondContact OG1-CG2 3.13Å
963	N	77.9	Confident	72.9	Confident	100 Å²	100	55 Å²	55	54%	0.535	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.3	49	170.6	-158.7	31.2	0	0	0	114.7	S945 L946 T965	S945-N963 WeakPolarHBondContact CA-OD1 3.26Å; S945-N963 WeakPolarHBondContact CB-OD1 3.38Å; S945-N963 PolarHBondContact OG-OD1 2.82Å; L946-N963 PolarHBondContact O-N 2.94Å; N963-T965 PolarHBondContact O-N 2.88Å
964	V	81.7	Confident	75.1	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.8	-179.3	175.7	0	0	0	0	110.4	S945 L946 L961 T962 V966 L987 L1145 L1150	S945-V964 PolarHBondContact N-O 3.34Å; L946-V964 HydrophobicContact CB-CB 4.27Å; L946-V964 WeakPolarHBondContact CB-O 3.15Å; L946-V964 PolarHBondContact N-O 3.44Å; L946-V964 PolarHBondContact O-N 3.35Å; L961-V964 HydrophobicContact CB-CG2 4.45Å; L961-V964 HydrophobicContact CD2-CG2 4.27Å; T962-V964 PolarHBondContact O-N 3.2Å; V964-V966 HydrophobicContact CG1-CG2 4.12Å; V964-L987 HydrophobicContact CG1-CD1 4.45Å; V964-L987 HydrophobicContact CG1-CD2 4.41Å; V964-L1145 HydrophobicContact CG2-CD1 4.27Å; V964-L1150 HydrophobicContact CG1-CB 4.38Å
965	T	82.9	Confident	77.4	Confident	46 Å²	46	43.6 Å²	43.6	28%	0.282	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	120.6	175	48.4	0	0	0	0	110.2	L930 V943 S945 N963 L1150	L930-T965 WeakPolarHBondContact CD1-OG1 3.5Å; V943-T965 CarbonylContact O-C 3.58Å; V943-T965 VanDerWaalsContact O-CA 3.26Å; V943-T965 WeakPolarHBondContact O-CA 3.43Å; S945-T965 VanDerWaalsContact N-CG2 3.33Å; N963-T965 PolarHBondContact O-N 2.88Å; T965-L1150 WeakPolarHBondContact O-CD2 3.19Å
966	V	84.7	Confident	79.6	Confident	6 Å²	6	36 Å²	36	4%	0.036	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	132.5	179.4	-178	0	0	0	0	110.7	V943 V964 F968 L1150	V943-V966 WeakPolarHBondContact CB-O 2.88Å; V943-V966 PolarHBondContact N-O 3Å; V943-V966 PolarHBondContact O-N 3.31Å; V964-V966 HydrophobicContact CG1-CG2 4.12Å; V966-F968 HydrophobicContact CB-CE2 4.04Å; V966-F968 HydrophobicContact CB-CZ 4.06Å; V966-F968 HydrophobicContact CG1-CD1 4.11Å; V966-F968 HydrophobicContact CG1-CD2 4.15Å; V966-F968 HydrophobicContact CG1-CE1 3.7Å; V966-F968 HydrophobicContact CG1-CE2 3.74Å; V966-F968 HydrophobicContact CG1-CG 4.34Å; V966-F968 HydrophobicContact CG1-CZ 3.51Å; V966-L1150 HydrophobicContact CG2-CD1 3.97Å; V966-L1150 HydrophobicContact CG2-CD2 3.54Å; V966-L1150 HydrophobicContact CG2-CG 4.29Å
967	D	85.8	Confident	81.7	Confident	58 Å²	58	30.8 Å²	30.8	31%	0.31	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.9	163.9	-62.4	-38.1	0	0	0	111.3	V939 S942 Y969	V939-D967 HydrophobicContact CG1-CB 4.26Å; V939-D967 HydrophobicContact CG2-CB 4.45Å; S942-D967 WeakPolarHBondContact CA-OD1 3.43Å; S942-D967 WeakPolarHBondContact CB-OD1 3.41Å; S942-D967 PolarHBondContact OG-OD1 3.31Å; D967-Y969 HydrophobicContact CB-CE2 4.43Å
968	F	88.1	Confident	83.1	Confident	3 Å²	3	27.6 Å²	27.6	1%	0.013	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	135.6	176.9	-56.4	-83.5	0	0	0	109.1	V939 G940 L941 V943 V966 T974 I976 L991 T1124 I1126	V939-F968 CarbonylContact C-O 3.6Å; G940-F968 PolarHBondContact N-O 3.02Å; L941-F968 HydrophobicContact CB-CB 4.33Å; L941-F968 HydrophobicContact CB-CD2 4.24Å; L941-F968 HydrophobicContact CD2-CD2 3.65Å; L941-F968 HydrophobicContact CD2-CE2 3.98Å; L941-F968 PolarHBondContact N-O 3.26Å; L941-F968 VanDerWaalsContact N-O 3.13Å; L941-F968 PolarHBondContact O-N 3.16Å; V943-F968 HydrophobicContact CG2-CD2 4.48Å; V943-F968 HydrophobicContact CG2-CE2 3.87Å; V966-F968 HydrophobicContact CB-CE2 4.04Å; V966-F968 HydrophobicContact CB-CZ 4.06Å; V966-F968 HydrophobicContact CG1-CD1 4.11Å; V966-F968 HydrophobicContact CG1-CD2 4.15Å; V966-F968 HydrophobicContact CG1-CE1 3.7Å; V966-F968 HydrophobicContact CG1-CE2 3.74Å; V966-F968 HydrophobicContact CG1-CG 4.34Å; V966-F968 HydrophobicContact CG1-CZ 3.51Å; F968-T974 HydrophobicContact CD1-CG2 3.98Å; F968-T974 VanDerWaalsContact CD1-OG1 3.27Å; F968-T974 WeakPolarHBondContact CD1-OG1 3.41Å; F968-I976 HydrophobicContact CE1-CD1 4.29Å; F968-I976 HydrophobicContact CE1-CG1 4.4Å; F968-I976 HydrophobicContact CZ-CD1 4.15Å; F968-L991 HydrophobicContact CE2-CD1 4.39Å; F968-L991 HydrophobicContact CE2-CD2 4.44Å; F968-L991 HydrophobicContact CZ-CD1 4.39Å; F968-T1124 HydrophobicContact CB-CG2 3.72Å; F968-I1126 HydrophobicContact CB-CD1 4.13Å; F968-I1126 HydrophobicContact CD1-CD1 3.64Å; F968-I1126 HydrophobicContact CD1-CG1 3.87Å; F968-I1126 HydrophobicContact CD1-CG2 4.43Å; F968-I1126 HydrophobicContact CD2-CD1 3.71Å; F968-I1126 HydrophobicContact CE1-CD1 3.84Å; F968-I1126 HydrophobicContact CE1-CG1 4.17Å; F968-I1126 HydrophobicContact CE1-CG2 3.91Å; F968-I1126 HydrophobicContact CE2-CD1 3.9Å; F968-I1126 HydrophobicContact CG-CD1 3.55Å; F968-I1126 HydrophobicContact CG-CG1 4.16Å; F968-I1126 HydrophobicContact CZ-CD1 3.96Å; F968-I1126 HydrophobicContact CZ-CG2 4.33Å
969	Y	87.7	Confident	83.9	Confident	13 Å²	13	30 Å²	30	5%	0.051	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	147.3	-169.9	-56.4	-85.2	0	0	0	112.4	P935 A937 P938 V939 D967	P935-Y969 HydrophobicContact CG-CD1 3.54Å; P935-Y969 HydrophobicContact CG-CD2 3.55Å; P935-Y969 HydrophobicContact CG-CE1 3.6Å; P935-Y969 HydrophobicContact CG-CE2 3.63Å; P935-Y969 HydrophobicContact CG-CG 3.51Å; A937-Y969 WeakPolarHBondContact O-CD1 3.45Å; P938-Y969 WeakPolarHBondContact O-CA 3.28Å; V939-Y969 HydrophobicContact CG2-CD1 3.95Å; V939-Y969 HydrophobicContact CG2-CE1 3.63Å; D967-Y969 HydrophobicContact CB-CE2 4.43Å
970	E	86.7	Confident	84	Confident	61 Å²	61	28.4 Å²	28.4	29%	0.285	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	147.5	175.7	-55.3	-169.5	151.9	0	0	111.3	P938 Q972 T1124	P938-E970 HydrophobicContact CG-CB 4.14Å; P938-E970 HydrophobicContact CG-CG 4.26Å; P938-E970 PolarHBondContact O-N 2.77Å; E970-Q972 PolarHBondContact O-N 3.13Å; E970-T1124 WeakPolarHBondContact CA-OG1 3.23Å
971	G	85.8	Confident	83.8	Confident	23 Å²	23	32 Å²	32	24%	0.237	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	-4.5	-177.3	0	0	0	0	0	114.7	R1120 R1123	G971-R1120 WeakPolarHBondContact CA-O 3.18Å; G971-R1123 WeakPolarHBondContact CA-O 3.49Å; G971-R1123 PolarHBondContact N-O 3.03Å
972	Q	88.8	Confident	83.6	Confident	34 Å²	34	32.4 Å²	32.4	16%	0.159	17%	0.17	C	C	.	.			trans	-117.6	145.7	-171.2	-62.3	-173.6	1.4	0	0	113.1	E970 I1125 D1140	E970-Q972 PolarHBondContact O-N 3.13Å; Q972-I1125 PolarHBondContact O-N 3.27Å; Q972-D1140 HydrophobicContact CB-CB 4.12Å; Q972-D1140 HydrophobicContact CG-CB 4.4Å
973	I	92.1	Very high	83.5	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114	169.5	-50.7	-177.9	0	0	0	109.4	V975 L1116 I1117 R1120 I1125 V1127 I1138 D1140 R1141	I973-V975 HydrophobicContact CG2-CG2 4.43Å; I973-L1116 HydrophobicContact CD1-CB 4.24Å; I973-I1117 HydrophobicContact CD1-CG1 4.23Å; I973-R1120 HydrophobicContact CD1-CB 4.18Å; I973-R1120 HydrophobicContact CG1-CB 3.9Å; I973-I1125 HydrophobicContact CG1-CB 4.2Å; I973-I1125 HydrophobicContact CG1-CD1 4.3Å; I973-I1125 HydrophobicContact CG2-CB 4.35Å; I973-I1125 HydrophobicContact CG2-CG2 4.2Å; I973-V1127 HydrophobicContact CG2-CG2 4.12Å; I973-I1138 HydrophobicContact CD1-CG2 3.77Å; I973-I1138 HydrophobicContact CG2-CG2 4.1Å; I973-D1140 PolarHBondContact N-OD2 3.45Å; I973-D1140 PolarHBondContact O-N 3.36Å; I973-R1141 PolarHBondContact O-N 2.83Å; I973-R1141 VanDerWaalsContact O-N 3.16Å
974	T	91.7	Very high	83.8	Confident	4 Å²	4	25.8 Å²	25.8	3%	0.025	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.1	178.6	60.2	0	0	0	0	109.8	F968 I1125 I1126 V1127 R1141	F968-T974 HydrophobicContact CD1-CG2 3.98Å; F968-T974 VanDerWaalsContact CD1-OG1 3.27Å; F968-T974 WeakPolarHBondContact CD1-OG1 3.41Å; T974-I1125 PolarHBondContact N-O 3.15Å; T974-I1125 PolarHBondContact OG1-O 3.38Å; T974-I1126 WeakPolarHBondContact O-CA 3.48Å; T974-V1127 PolarHBondContact O-N 3.2Å; T974-R1141 CarbonylContact C-O 3.51Å; T974-R1141 WeakPolarHBondContact CA-O 3.46Å; T974-R1141 HydrophobicContact CG2-CB 4.22Å
975	V	92.5	Very high	83.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	113	179.4	-177	0	0	0	0	110.1	I973 Y977 V1127 A1135 R1141 I1142 A1143	I973-V975 HydrophobicContact CG2-CG2 4.43Å; V975-Y977 PolarHBondContact O-N 3.02Å; V975-Y977 VanDerWaalsContact O-N 3.09Å; V975-V1127 CarbonylContact C-O 3.54Å; V975-V1127 VanDerWaalsContact CA-O 3.3Å; V975-V1127 WeakPolarHBondContact CA-O 3.39Å; V975-V1127 HydrophobicContact CG2-CB 4.27Å; V975-A1135 HydrophobicContact CB-CB 4.14Å; V975-A1135 HydrophobicContact CG1-CB 3.68Å; V975-R1141 PolarHBondContact N-O 2.94Å; V975-I1142 WeakPolarHBondContact O-CA 3.4Å; V975-A1143 PolarHBondContact O-N 2.82Å
976	I	91.6	Very high	83.9	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	93.5	170.6	-53.2	175.9	0	0	0	107.4	F968 K984 L987 M988 I1126 V1127 T1128 S1129 A1143 L1145	F968-I976 HydrophobicContact CE1-CD1 4.29Å; F968-I976 HydrophobicContact CE1-CG1 4.4Å; F968-I976 HydrophobicContact CZ-CD1 4.15Å; I976-K984 HydrophobicContact CG2-CG 4.07Å; I976-L987 HydrophobicContact CD1-CD2 3.95Å; I976-L987 HydrophobicContact CD1-CG 4.49Å; I976-L987 HydrophobicContact CG2-CD2 4.44Å; I976-M988 HydrophobicContact CD1-SD 4.26Å; I976-I1126 HydrophobicContact CD1-CG2 3.57Å; I976-I1126 HydrophobicContact CG1-CG2 4.01Å; I976-V1127 PolarHBondContact N-O 3.17Å; I976-T1128 HydrophobicContact CB-CG2 4.3Å; I976-S1129 PolarHBondContact O-N 2.99Å; I976-S1129 VanDerWaalsContact O-N 3.15Å; I976-A1143 CarbonylContact C-O 3.55Å; I976-A1143 WeakPolarHBondContact CA-O 3.07Å; I976-A1143 HydrophobicContact CG1-CB 4.41Å; I976-L1145 HydrophobicContact CG2-CB 4.29Å
977	Y	89.4	Confident	84	Confident	26 Å²	26	25.2 Å²	25.2	10%	0.102	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	153.5	173.6	-178.7	-96.4	0	0	0	110.6	V975 A1135 A1143 I1144 L1145 L1250 V1254	V975-Y977 PolarHBondContact O-N 3.02Å; V975-Y977 VanDerWaalsContact O-N 3.09Å; Y977-A1135 HydrophobicContact CD2-CB 4.41Å; Y977-A1143 PolarHBondContact N-O 3.16Å; Y977-A1143 VanDerWaalsContact O-O 3.13Å; Y977-I1144 HydrophobicContact CD1-CG1 4.39Å; Y977-L1145 PolarHBondContact O-N 3.5Å; Y977-L1250 HydrophobicContact CD2-CD2 4.4Å; Y977-L1250 HydrophobicContact CG-CD2 4.35Å; Y977-V1254 HydrophobicContact CD1-CG2 3.8Å; Y977-V1254 HydrophobicContact CE1-CB 4.33Å; Y977-V1254 HydrophobicContact CE1-CG1 4.07Å; Y977-V1254 HydrophobicContact CE1-CG2 3.51Å
978	G	83.1	Confident	84	Confident	3 Å²	3	22.4 Å²	22.4	3%	0.031	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.3	174.3	175.1	0	0	0	0	0	111.3	K984 L1145	G978-K984 PolarHBondContact O-NZ 3.18Å; G978-L1145 VanDerWaalsContact CA-O 3.25Å; G978-L1145 WeakPolarHBondContact CA-O 3.49Å
979	E	75.1	Confident	83.8	Confident	95 Å²	95	26.9 Å²	26.9	44%	0.444	13%	0.133	S	C	.	.			trans	-71.7	170.7	175.6	-67.3	-158.1	-140.7	0	0	112.5	S982 K984 R1960	E979-S982 PolarHBondContact O-OG 2.97Å; E979-K984 WeakPolarHBondContact O-CE 3.33Å; E979-K984 PolarHBondContact O-NZ 3.01Å; E979-R1960 IonicContact OE2-CZ 3.51Å; E979-R1960 IonicContact OE2-NH1 2.75Å; E979-R1960 PolarHBondContact OE2-NH1 3.29Å; E979-R1960 IonicContact OE2-NH2 3.58Å; E979-R1960 PolarHBondContact OE2-NH2 3.34Å
980	E	66.7	Low	83.6	Confident	23 Å²	23	26.4 Å²	26.4	11%	0.107	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	152.2	161.7	-64.9	-136.1	149.6	0	0	108.1	S982 K1102 R1959	E980-S982 PolarHBondContact O-N 3.27Å; E980-K1102 IonicContact OE1-NZ 2.85Å; E980-R1959 IonicContact OE1-NH1 3.69Å
981	H	68.1	Low	83.3	Confident	122 Å²	122	23.5 Å²	23.5	57%	0.565	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.2	-1.3	-176.8	-39.1	82.8	0	0	0	117.3	G983 S1931 M1934	H981-G983 PolarHBondContact O-N 2.96Å; H981-G983 VanDerWaalsContact O-N 3.13Å; H981-S1931 PolarHBondContact CE1-OG 3.05Å; H981-S1931 WeakPolarHBondContact NE2-CB 3.28Å; H981-S1931 PolarHBondContact NE2-OG 3.27Å; H981-M1934 PolarHBondContact NE2-SD 3.03Å
982	S	76.3	Confident	83	Confident	8 Å²	8	22.7 Å²	22.7	6%	0.056	11%	0.109	C	C	.	.	S	Bend	trans	-69.1	-9.3	179.2	74.6	0	0	0	0	115.4	E979 E980 L1145	E979-S982 PolarHBondContact O-OG 2.97Å; E980-S982 PolarHBondContact O-N 3.27Å; S982-L1145 WeakPolarHBondContact CB-O 3.38Å; S982-L1145 VanDerWaalsContact O-CD2 3.26Å; S982-L1145 WeakPolarHBondContact O-CD2 3.49Å; S982-L1145 PolarHBondContact OG-O 3.49Å
983	G	76.7	Confident	82.2	Confident	5 Å²	5	22.7 Å²	22.7	5%	0.052	12%	0.119	C	C	.	.	S	Bend	trans	113.3	-4.1	176.4	0	0	0	0	0	115.3	H981 S985 T986 L987	H981-G983 PolarHBondContact O-N 2.96Å; H981-G983 VanDerWaalsContact O-N 3.13Å; G983-S985 PolarHBondContact O-N 2.96Å; G983-T986 CarbonylContact O-C 3.45Å; G983-T986 WeakPolarHBondContact O-CA 3.28Å; G983-T986 VanDerWaalsContact O-CB 3.24Å; G983-T986 WeakPolarHBondContact O-CB 3.23Å; G983-T986 PolarHBondContact O-N 3.46Å; G983-L987 PolarHBondContact O-N 2.78Å
984	K	85	Confident	81.3	Confident	8 Å²	8	25.5 Å²	25.5	4%	0.035	13%	0.133	C	C	.	.	H	α-helix	trans	-47.4	-55.6	-173.7	-62.8	179.6	-64.1	-171.9	0	114.9	I976 G978 E979 T986 L987 M988 T1128 S1129 L1145	I976-K984 HydrophobicContact CG2-CG 4.07Å; G978-K984 PolarHBondContact O-NZ 3.18Å; E979-K984 WeakPolarHBondContact O-CE 3.33Å; E979-K984 PolarHBondContact O-NZ 3.01Å; K984-T986 PolarHBondContact O-N 2.85Å; K984-L987 WeakPolarHBondContact O-CB 3.28Å; K984-L987 PolarHBondContact O-N 2.87Å; K984-M988 WeakPolarHBondContact O-CG 3.15Å; K984-M988 PolarHBondContact O-N 3.01Å; K984-T1128 HydrophobicContact CB-CG2 3.99Å; K984-S1129 PolarHBondContact NZ-O 3.38Å; K984-L1145 HydrophobicContact CB-CD2 4.44Å; K984-L1145 HydrophobicContact CG-CD2 3.77Å
985	S	82	Confident	80.5	Confident	22 Å²	22	27.3 Å²	27.3	15%	0.154	14%	0.143	C	C	.	.	H	α-helix	trans	-71.8	-18.3	-179.5	-52.9	0	0	0	0	113.1	G983 R989 D1098	G983-S985 PolarHBondContact O-N 2.96Å; S985-R989 WeakPolarHBondContact O-CD 3.48Å; S985-R989 WeakPolarHBondContact O-CG 3.1Å; S985-R989 PolarHBondContact O-N 2.86Å; S985-D1098 WeakPolarHBondContact CB-OD2 3.43Å; S985-D1098 PolarHBondContact OG-OD1 2.96Å; S985-D1098 PolarHBondContact OG-OD2 3.03Å; S985-D1098 VanDerWaalsContact OG-OD2 3.05Å
986	T	83.9	Confident	79.5	Confident	16 Å²	16	32.6 Å²	32.6	10%	0.098	18%	0.175	C	C	.	.	H	α-helix	trans	-73.9	-43.9	169.1	-53.1	0	0	0	0	110	F950 I960 L961 G983 K984 R989 L990 L995	F950-T986 HydrophobicContact CE2-CG2 4.02Å; I960-T986 HydrophobicContact CG2-CG2 4.24Å; L961-T986 HydrophobicContact CD1-CG2 4.08Å; G983-T986 CarbonylContact O-C 3.45Å; G983-T986 WeakPolarHBondContact O-CA 3.28Å; G983-T986 VanDerWaalsContact O-CB 3.24Å; G983-T986 WeakPolarHBondContact O-CB 3.23Å; G983-T986 PolarHBondContact O-N 3.46Å; K984-T986 PolarHBondContact O-N 2.85Å; T986-R989 PolarHBondContact O-N 3.32Å; T986-R989 VanDerWaalsContact O-N 3.16Å; T986-L990 HydrophobicContact CG2-CD1 4.22Å; T986-L990 WeakPolarHBondContact O-CG 3.47Å; T986-L990 PolarHBondContact O-N 3.5Å; T986-L995 HydrophobicContact CG2-CD1 3.86Å
987	L	86.5	Confident	78.6	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-59.5	-46.5	173.9	179.3	57.8	0	0	0	110.9	L946 L961 V964 I976 G983 K984 R989 L990 L991	L946-L987 HydrophobicContact CD2-CD1 3.42Å; L946-L987 VanDerWaalsContact CD2-CD1 3.42Å; L961-L987 HydrophobicContact CD1-CB 3.95Å; L961-L987 HydrophobicContact CD1-CD1 4.5Å; V964-L987 HydrophobicContact CG1-CD1 4.45Å; V964-L987 HydrophobicContact CG1-CD2 4.41Å; I976-L987 HydrophobicContact CD1-CD2 3.95Å; I976-L987 HydrophobicContact CD1-CG 4.49Å; I976-L987 HydrophobicContact CG2-CD2 4.44Å; G983-L987 PolarHBondContact O-N 2.78Å; K984-L987 WeakPolarHBondContact O-CB 3.28Å; K984-L987 PolarHBondContact O-N 2.87Å; L987-R989 VanDerWaalsContact C-N 3.27Å; L987-R989 PolarHBondContact O-N 2.84Å; L987-L990 PolarHBondContact O-N 3.03Å; L987-L990 VanDerWaalsContact O-N 3.13Å; L987-L991 HydrophobicContact CD1-CD1 4.45Å; L987-L991 HydrophobicContact CD1-CG 4.37Å; L987-L991 HydrophobicContact CG-CD1 4.24Å; L987-L991 WeakPolarHBondContact O-CB 3.42Å; L987-L991 WeakPolarHBondContact O-CG 3.41Å; L987-L991 PolarHBondContact O-N 3.23Å
988	M	87.3	Confident	77.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-32.7	174.8	-66.6	-61	-88.9	0	0	113.9	I976 K984 L991 G992 Y1021 L1096 L1097 I1126 T1128	I976-M988 HydrophobicContact CD1-SD 4.26Å; K984-M988 WeakPolarHBondContact O-CG 3.15Å; K984-M988 PolarHBondContact O-N 3.01Å; M988-L991 HydrophobicContact SD-CD1 4.21Å; M988-G992 PolarHBondContact O-N 3.26Å; M988-Y1021 HydrophobicContact CB-CE2 4.44Å; M988-L1096 VanDerWaalsContact CE-C 3.48Å; M988-L1096 HydrophobicContact CE-CB 3.74Å; M988-L1096 HydrophobicContact CE-CD2 4.3Å; M988-L1096 HydrophobicContact SD-CD2 4.49Å; M988-L1097 VanDerWaalsContact CE-N 3.29Å; M988-I1126 HydrophobicContact CE-CG2 4.42Å; M988-I1126 HydrophobicContact SD-CG2 4.02Å; M988-T1128 HydrophobicContact CE-CG2 4.15Å; M988-T1128 HydrophobicContact CG-CG2 3.2Å; M988-T1128 HydrophobicContact SD-CG2 3.68Å
989	R	82.7	Confident	77.2	Confident	96 Å²	96	40.3 Å²	40.3	36%	0.362	22%	0.221	S	C	.	.	H	α-helix	trans	-75.8	-32	175.8	-74.1	172.1	-163.5	163.3	9.3	112.7	S985 T986 L987 G993 L994 L995	S985-R989 WeakPolarHBondContact O-CD 3.48Å; S985-R989 WeakPolarHBondContact O-CG 3.1Å; S985-R989 PolarHBondContact O-N 2.86Å; T986-R989 PolarHBondContact O-N 3.32Å; T986-R989 VanDerWaalsContact O-N 3.16Å; L987-R989 VanDerWaalsContact C-N 3.27Å; L987-R989 PolarHBondContact O-N 2.84Å; R989-G993 PolarHBondContact O-N 3.2Å; R989-L994 HydrophobicContact CB-CB 3.87Å; R989-L994 HydrophobicContact CG-CB 4.1Å; R989-L994 HydrophobicContact CG-CD1 3.94Å; R989-L994 WeakPolarHBondContact O-CA 3.38Å; R989-L994 WeakPolarHBondContact O-CB 3.3Å; R989-L994 PolarHBondContact O-N 3.14Å; R989-L995 HydrophobicContact CB-CB 4.46Å; R989-L995 HydrophobicContact CB-CD1 3.71Å; R989-L995 HydrophobicContact CB-CG 3.88Å; R989-L995 PolarHBondContact O-N 3.02Å
990	L	82.9	Confident	77.1	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-67.9	-48.4	171.4	-69.3	159.4	0	0	0	109.8	L946 H948 L961 T986 L987 G992 G993 L995 T996 P997 I1002	L946-L990 HydrophobicContact CD2-CB 4Å; L946-L990 HydrophobicContact CD2-CD1 3.68Å; L946-L990 HydrophobicContact CD2-CG 4.41Å; L946-L990 HydrophobicContact CG-CD1 4.26Å; H948-L990 HydrophobicContact CB-CD1 3.92Å; L961-L990 HydrophobicContact CD1-CD1 3.56Å; T986-L990 HydrophobicContact CG2-CD1 4.22Å; T986-L990 WeakPolarHBondContact O-CG 3.47Å; T986-L990 PolarHBondContact O-N 3.5Å; L987-L990 PolarHBondContact O-N 3.03Å; L987-L990 VanDerWaalsContact O-N 3.13Å; L990-G992 VanDerWaalsContact C-N 3.3Å; L990-G992 PolarHBondContact O-N 3.32Å; L990-G993 PolarHBondContact O-N 3.46Å; L990-G993 VanDerWaalsContact O-N 3.13Å; L990-L995 HydrophobicContact CD2-CB 3.66Å; L990-L995 HydrophobicContact CG-CB 4.02Å; L990-T996 WeakPolarHBondContact CD2-O 3.32Å; L990-P997 HydrophobicContact CD2-CB 4.26Å; L990-I1002 HydrophobicContact CB-CD1 4.41Å; L990-I1002 WeakPolarHBondContact O-CD1 3.49Å
991	L	82.3	Confident	77.6	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-38.8	173.5	-69.4	175.2	0	0	0	113.1	L941 V943 F968 L987 M988 G993 I1002 L1096 I1126	L941-L991 HydrophobicContact CD1-CD2 4.23Å; L941-L991 HydrophobicContact CD2-CD2 3.52Å; V943-L991 HydrophobicContact CG2-CD2 3.62Å; F968-L991 HydrophobicContact CE2-CD1 4.39Å; F968-L991 HydrophobicContact CE2-CD2 4.44Å; F968-L991 HydrophobicContact CZ-CD1 4.39Å; L987-L991 HydrophobicContact CD1-CD1 4.45Å; L987-L991 HydrophobicContact CD1-CG 4.37Å; L987-L991 HydrophobicContact CG-CD1 4.24Å; L987-L991 WeakPolarHBondContact O-CB 3.42Å; L987-L991 WeakPolarHBondContact O-CG 3.41Å; L987-L991 PolarHBondContact O-N 3.23Å; M988-L991 HydrophobicContact SD-CD1 4.21Å; L991-G993 VanDerWaalsContact C-N 3.34Å; L991-I1002 HydrophobicContact CD2-CD1 4.44Å; L991-I1002 HydrophobicContact CD2-CG2 4.34Å; L991-L1096 HydrophobicContact CB-CD1 3.86Å; L991-L1096 HydrophobicContact CB-CD2 4.26Å; L991-L1096 HydrophobicContact CD1-CD2 4.35Å; L991-I1126 HydrophobicContact CD1-CD1 4.32Å
992	G	77.4	Confident	78	Confident	5 Å²	5	34.2 Å²	34.2	5%	0.052	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	8.9	177.9	0	0	0	0	0	115.4	M988 L990 L994	M988-G992 PolarHBondContact O-N 3.26Å; L990-G992 VanDerWaalsContact C-N 3.3Å; L990-G992 PolarHBondContact O-N 3.32Å; G992-L994 PolarHBondContact O-N 2.67Å; G992-L994 VanDerWaalsContact O-N 3.17Å
993	G	72.7	Confident	78	Confident	35 Å²	35	37.8 Å²	37.8	36%	0.361	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	11.3	178.3	0	0	0	0	0	115.9	R989 L990 L991	R989-G993 PolarHBondContact O-N 3.2Å; L990-G993 PolarHBondContact O-N 3.46Å; L990-G993 VanDerWaalsContact O-N 3.13Å; L991-G993 VanDerWaalsContact C-N 3.34Å
994	L	73.9	Confident	77.9	Confident	59 Å²	59	38.7 Å²	38.7	31%	0.309	23%	0.231	S	C	.	.	S	Bend	trans	-78.7	-19.1	176.9	-83.4	173.6	0	0	0	113.7	V722 R989 G992 Y1021	V722-L994 HydrophobicContact CG2-CD1 3.84Å; V722-L994 HydrophobicContact CG2-CD2 3.32Å; V722-L994 HydrophobicContact CG2-CG 3.38Å; R989-L994 HydrophobicContact CB-CB 3.87Å; R989-L994 HydrophobicContact CG-CB 4.1Å; R989-L994 HydrophobicContact CG-CD1 3.94Å; R989-L994 WeakPolarHBondContact O-CA 3.38Å; R989-L994 WeakPolarHBondContact O-CB 3.3Å; R989-L994 PolarHBondContact O-N 3.14Å; G992-L994 PolarHBondContact O-N 2.67Å; G992-L994 VanDerWaalsContact O-N 3.17Å; L994-Y1021 HydrophobicContact CD1-CD1 4.22Å; L994-Y1021 HydrophobicContact CD1-CE1 3.49Å; L994-Y1021 VanDerWaalsContact CD1-CE1 3.49Å
995	L	74.7	Confident	76.8	Confident	42 Å²	42	40.9 Å²	40.9	22%	0.22	25%	0.246	C	C	.	.	S	Bend	trans	-131.8	146.1	175.9	-69.1	174.2	0	0	0	108.5	F950 T986 R989 L990	F950-L995 HydrophobicContact CZ-CD1 3.99Å; F950-L995 HydrophobicContact CZ-CD2 4.28Å; T986-L995 HydrophobicContact CG2-CD1 3.86Å; R989-L995 HydrophobicContact CB-CB 4.46Å; R989-L995 HydrophobicContact CB-CD1 3.71Å; R989-L995 HydrophobicContact CB-CG 3.88Å; R989-L995 PolarHBondContact O-N 3.02Å; L990-L995 HydrophobicContact CD2-CB 3.66Å; L990-L995 HydrophobicContact CG-CB 4.02Å
996	T	71.9	Confident	75.8	Confident	111 Å²	111	43.8 Å²	43.8	68%	0.681	28%	0.279	S	S	*	.			trans	-83.8	137.1	167.9	46.4	0	0	0	0	110.1	H948 L990	H948-T996 PolarHBondContact CE1-O 2.88Å; H948-T996 PolarHBondContact ND1-O 2.94Å; L990-T996 WeakPolarHBondContact CD2-O 3.32Å
997	P	72.2	Confident	74.8	Confident	47 Å²	47	46.5 Å²	46.5	31%	0.305	29%	0.29	S	S	.	.			trans	-65.4	145.1	168.8	27.6	-32.4	0	0	0	110	L946 L990	L946-P997 HydrophobicContact CD1-CB 3.82Å; L990-P997 HydrophobicContact CD2-CB 4.26Å
998	H	75.4	Confident	72.9	Confident	120 Å²	120	56.2 Å²	56.2	56%	0.556	33%	0.332	S	S	*	.	S	Bend	trans	-82.3	-22.7	169	-74.6	82.8	0	0	0	111.3	S947 H948 S949	S947-H998 PolarHBondContact O-N 3.02Å; H948-H998 AromaticContact CE1-CE1 3.54Å; H948-H998 AromaticContact CE1-ND1 3.52Å; H948-H998 AromaticContact CG-ND1 3.5Å; H948-H998 AromaticContact ND1-CE1 3.64Å; H948-H998 AromaticContact ND1-ND1 3.12Å; H948-H998 PolarHBondContact ND1-ND1 3.12Å; H948-H998 VanDerWaalsContact ND1-ND1 3.12Å; H948-H998 AromaticContact NE2-CE1 3.93Å; S949-H998 PolarHBondContact N-ND1 3.31Å; S949-H998 PolarHBondContact O-CE1 3.17Å; S949-H998 PolarHBondContact O-NE2 2.94Å
999	G	68.6	Low	71.2	Confident	25 Å²	25	61.9 Å²	61.9	26%	0.258	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	162.9	170	0	0	0	0	0	110.2	L946 S947	L946-G999 WeakPolarHBondContact CA-O 3.5Å; S947-G999 PolarHBondContact N-O 2.85Å; S947-G999 PolarHBondContact O-N 2.84Å; S947-G999 WeakPolarHBondContact OG-CA 3.44Å; S947-G999 PolarHBondContact OG-N 2.93Å; S947-G999 PolarHBondContact OG-O 3.02Å
1000	G	72.6	Confident	69.4	Low	38 Å²	38	66 Å²	66	39%	0.392	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	87.4	172.3	-171.4	0	0	0	0	0	113.6	S944 S945	S944-G1000 CarbonylContact O-C 3.55Å; S944-G1000 WeakPolarHBondContact O-CA 3.48Å; S945-G1000 WeakPolarHBondContact O-CA 3.44Å
1001	S	75.7	Confident	67.6	Low	41 Å²	41	73.3 Å²	73.3	29%	0.287	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	159.7	-178.5	71.9	0	0	0	0	112.2	S944	S944-S1001 PolarHBondContact N-O 2.92Å; S944-S1001 PolarHBondContact O-N 2.86Å; S944-S1001 PolarHBondContact OG-OG 3.46Å
1002	I	78.4	Confident	65.9	Low	33 Å²	33	75.5 Å²	75.5	17%	0.169	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.5	177.2	-59.5	168.3	0	0	0	106.7	L941 S942 L946 L990 L991	L941-I1002 HydrophobicContact CD1-CG2 4.5Å; L941-I1002 HydrophobicContact CD2-CG2 4.01Å; L941-I1002 HydrophobicContact CG-CG2 4.32Å; S942-I1002 WeakPolarHBondContact O-CA 3.45Å; L946-I1002 HydrophobicContact CD1-CD1 3.94Å; L946-I1002 HydrophobicContact CD1-CG1 3.85Å; L990-I1002 HydrophobicContact CB-CD1 4.41Å; L990-I1002 WeakPolarHBondContact O-CD1 3.49Å; L991-I1002 HydrophobicContact CD2-CD1 4.44Å; L991-I1002 HydrophobicContact CD2-CG2 4.34Å
1003	L	76.1	Confident	64.6	Low	84 Å²	84	80.3 Å²	80.3	44%	0.44	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	124.2	-178.8	-163.4	83.1	0	0	0	109.6	S942	S942-L1003 PolarHBondContact N-O 2.74Å; S942-L1003 PolarHBondContact O-N 2.9Å
1004	V	73.3	Confident	63.6	Low	24 Å²	24	79.6 Å²	79.6	15%	0.145	45%	0.452	C	S	.	.			trans	-106.9	125.5	171.1	-178.2	0	0	0	0	107.9	L941 G1006 K1007 I1019	L941-V1004 HydrophobicContact CD1-CG2 4.34Å; V1004-G1006 PolarHBondContact O-N 2.85Å; V1004-K1007 PolarHBondContact O-N 3.34Å; V1004-I1019 HydrophobicContact CG2-CD1 4.3Å
1005	P	62.8	Low	62.6	Low	54 Å²	54	79.3 Å²	79.3	35%	0.351	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	132.9	-177.7	-19.8	28.9	0	0	0	111.9	V939 G940	V939-P1005 WeakPolarHBondContact O-CG 3.35Å; G940-P1005 WeakPolarHBondContact O-CD 3.43Å
1006	G	61.1	Low	62	Low	82 Å²	82	80.1 Å²	80.1	85%	0.845	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.9	-0.3	-178.5	0	0	0	0	0	115.5	V1004	V1004-G1006 PolarHBondContact O-N 2.85Å
1007	K	62	Low	61.6	Low	73 Å²	73	80.2 Å²	80.2	32%	0.317	45%	0.45	S	S	.	.			trans	-123.6	128.5	169.2	-72.5	177.3	179.3	154	0	111	V1004 V1012 T1015 D1018	V1004-K1007 PolarHBondContact O-N 3.34Å; K1007-V1012 HydrophobicContact CB-CG2 4.39Å; K1007-V1012 HydrophobicContact CD-CG1 4.09Å; K1007-T1015 PolarHBondContact NZ-OG1 3.38Å; K1007-D1018 IonicContact NZ-OD2 3.05Å; K1007-D1018 PolarHBondContact NZ-OD2 3.32Å
1008	K	47.5	Very low	61.4	Low	208 Å²	208	79.4 Å²	79.4	90%	0.904	44%	0.444	S	S	*	.			trans	-84.8	-12.3	-169	-70.2	-173.5	175	-177.5	0	114.6
1009	D	50.4	Low	61.7	Low	118 Å²	118	74 Å²	74	63%	0.631	42%	0.419	S	S	*	.			trans	-90	137.7	-172.9	-60	-40.5	0	0	0	113	L1011 V1012	D1009-L1011 PolarHBondContact O-N 2.84Å; D1009-L1011 VanDerWaalsContact O-N 3.12Å; D1009-V1012 HydrophobicContact CB-CG2 3.64Å; D1009-V1012 WeakPolarHBondContact O-CG2 3.46Å
1010	K	46	Very low	62.4	Low	182 Å²	182	72.8 Å²	72.8	79%	0.791	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-0.6	-173.4	-66.8	177.1	176.8	175.3	0	115.1
1011	L	44.3	Very low	63	Low	158 Å²	158	71.2 Å²	71.2	83%	0.827	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.5	43.9	-168.7	-131	156.3	0	0	0	112	D1009	D1009-L1011 PolarHBondContact O-N 2.84Å; D1009-L1011 VanDerWaalsContact O-N 3.12Å
1012	V	47.3	Very low	63.6	Low	46 Å²	46	69.3 Å²	69.3	28%	0.279	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-81.7	121.7	-176.4	174.3	0	0	0	0	111.2	K1007 D1009 P1014	K1007-V1012 HydrophobicContact CB-CG2 4.39Å; K1007-V1012 HydrophobicContact CD-CG1 4.09Å; D1009-V1012 HydrophobicContact CB-CG2 3.64Å; D1009-V1012 WeakPolarHBondContact O-CG2 3.46Å; V1012-P1014 WeakPolarHBondContact O-CD 3.38Å
1013	V	49.3	Very low	63.8	Low	106 Å²	106	68.3 Å²	68.3	64%	0.642	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-60.2	118.5	160.8	179.1	0	0	0	0	107.4	T1015	V1013-T1015 PolarHBondContact O-N 3.19Å; V1013-T1015 VanDerWaalsContact O-N 3.14Å
1014	P	51.8	Low	64	Low	21 Å²	21	66.4 Å²	66.4	14%	0.136	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-54.8	122.7	-173.5	18.8	-31.6	0	0	0	110.5	V1012 I1019	V1012-P1014 WeakPolarHBondContact O-CD 3.38Å; P1014-I1019 HydrophobicContact CB-CD1 3.33Å; P1014-I1019 HydrophobicContact CG-CD1 4.36Å
1015	T	54.2	Low	64.1	Low	53 Å²	53	73.2 Å²	73.2	33%	0.325	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-80.9	144.1	-172	-41.3	0	0	0	0	110.6	K1007 V1013 N1017 D1018	K1007-T1015 PolarHBondContact NZ-OG1 3.38Å; V1013-T1015 PolarHBondContact O-N 3.19Å; V1013-T1015 VanDerWaalsContact O-N 3.14Å; T1015-N1017 PolarHBondContact O-N 3.47Å; T1015-D1018 PolarHBondContact O-N 3.27Å
1016	F	60.3	Low	64.9	Low	59 Å²	59	74.7 Å²	74.7	26%	0.259	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.9	-162.6	-51.6	-65.1	0	0	0	116.4	K721 V722 G724	K721-F1016 WeakPolarHBondContact O-CE1 3.27Å; K721-F1016 WeakPolarHBondContact O-CZ 3.43Å; V722-F1016 VanDerWaalsContact O-CD1 3.3Å; V722-F1016 WeakPolarHBondContact O-CD1 3.14Å; G724-F1016 VanDerWaalsContact CA-CG 3.43Å; G724-F1016 VanDerWaalsContact N-CG 3.32Å
1017	N	63.8	Low	65.7	Low	112 Å²	112	71.2 Å²	71.2	60%	0.599	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-21.6	175.7	-60.4	4.2	0	0	0	112	T1015	T1015-N1017 PolarHBondContact O-N 3.47Å
1018	D	69.4	Low	66.8	Low	30 Å²	30	68.5 Å²	68.5	16%	0.16	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-30.3	-170.8	-49.5	-39	0	0	0	112	K1007 T1015 R1093 V1094	K1007-D1018 IonicContact NZ-OD2 3.05Å; K1007-D1018 PolarHBondContact NZ-OD2 3.32Å; T1015-D1018 PolarHBondContact O-N 3.27Å; D1018-R1093 PolarHBondContact O-N 3.38Å; D1018-V1094 PolarHBondContact O-N 3.01Å
1019	I	80	Confident	68.5	Low	6 Å²	6	60.6 Å²	60.6	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	124.3	-172.5	-78.8	155.9	0	0	0	112.8	L941 V1004 P1014 V1094 L1096	L941-I1019 HydrophobicContact CD1-CD1 4.38Å; V1004-I1019 HydrophobicContact CG2-CD1 4.3Å; P1014-I1019 HydrophobicContact CB-CD1 3.33Å; P1014-I1019 HydrophobicContact CG-CD1 4.36Å; I1019-V1094 CarbonylContact C-O 3.42Å; I1019-V1094 WeakPolarHBondContact CA-O 3.38Å; I1019-V1094 HydrophobicContact CG1-CB 3.7Å; I1019-V1094 HydrophobicContact CG1-CG1 4.04Å; I1019-V1094 HydrophobicContact CG1-CG2 4.34Å; I1019-L1096 HydrophobicContact CG2-CD1 3.58Å; I1019-L1096 HydrophobicContact CG2-CG 3.97Å
1020	A	84.2	Confident	70.1	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.008	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	114.3	172	0	0	0	0	0	111.3	A1087 A1092 V1094 W1095 L1096	A1020-A1087 WeakPolarHBondContact CB-O 3.24Å; A1020-A1092 HydrophobicContact CB-CB 3.7Å; A1020-V1094 PolarHBondContact N-O 3.47Å; A1020-W1095 HydrophobicContact CB-CG 4.31Å; A1020-L1096 PolarHBondContact O-N 2.92Å
1021	Y	85.6	Confident	71.9	Confident	5 Å²	5	55.9 Å²	55.9	2%	0.02	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.5	-178.8	-179.8	-117.8	0	0	0	114.2	Y719 V722 M988 L994 P1023 L1096	Y719-Y1021 WeakPolarHBondContact CE2-O 3.19Å; V722-Y1021 HydrophobicContact CB-CD1 4.46Å; V722-Y1021 HydrophobicContact CG1-CD1 3.92Å; V722-Y1021 HydrophobicContact CG1-CG 4.09Å; V722-Y1021 HydrophobicContact CG2-CD1 4.39Å; M988-Y1021 HydrophobicContact CB-CE2 4.44Å; L994-Y1021 HydrophobicContact CD1-CD1 4.22Å; L994-Y1021 HydrophobicContact CD1-CE1 3.49Å; L994-Y1021 VanDerWaalsContact CD1-CE1 3.49Å; Y1021-P1023 HydrophobicContact CD1-CG 4.49Å; Y1021-P1023 HydrophobicContact CE1-CB 3.64Å; Y1021-P1023 HydrophobicContact CE1-CG 4.03Å; Y1021-L1096 WeakPolarHBondContact CA-O 3.35Å; Y1021-L1096 HydrophobicContact CD2-CB 3.88Å; Y1021-L1096 HydrophobicContact CD2-CD1 4.49Å
1022	C	87.6	Confident	73.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	104.5	172.9	-166.8	0	0	0	0	110.6	A1087 L1096 L1097 D1098	C1022-A1087 HydrophobicContact CB-CB 3.96Å; C1022-L1096 PolarHBondContact N-O 3.12Å; C1022-L1097 HydrophobicContact CB-CD2 3.51Å; C1022-D1098 WeakPolarHBondContact O-CB 3.14Å; C1022-D1098 PolarHBondContact O-N 3.09Å
1023	P	84	Confident	75.9	Confident	13 Å²	13	49.7 Å²	49.7	8%	0.084	25%	0.254	C	S	.	.			trans	-77.3	161.5	-177.5	26	-30.5	0	0	0	114.1	Y719 Y1021 K1025 R1080 Q1083	Y719-P1023 HydrophobicContact CD2-CG 3.92Å; Y719-P1023 HydrophobicContact CE2-CG 4.05Å; Y1021-P1023 HydrophobicContact CD1-CG 4.49Å; Y1021-P1023 HydrophobicContact CE1-CB 3.64Å; Y1021-P1023 HydrophobicContact CE1-CG 4.03Å; P1023-K1025 PolarHBondContact O-N 3.41Å; P1023-R1080 PolarHBondContact O-NH1 3.43Å; P1023-Q1083 PolarHBondContact O-NE2 3.03Å
1024	E	79.4	Confident	77.8	Confident	44 Å²	44	44.6 Å²	44.6	21%	0.206	22%	0.223	C	C	.	.	S	Bend	trans	-60.1	-38.3	174.3	-166.4	-162.4	168	0	0	113.6	R1080 K1102 R1959	E1024-R1080 PolarHBondContact O-NH1 3.18Å; E1024-K1102 HydrophobicContact CG-CD 4.07Å; E1024-K1102 WeakPolarHBondContact OE1-CE 3.31Å; E1024-K1102 IonicContact OE1-NZ 2.81Å; E1024-K1102 PolarHBondContact OE1-NZ 3.48Å; E1024-R1959 IonicContact OE1-CZ 3.37Å; E1024-R1959 IonicContact OE1-NH1 3.81Å; E1024-R1959 PolarHBondContact OE1-NH1 2.77Å; E1024-R1959 IonicContact OE1-NH2 3.99Å; E1024-R1959 PolarHBondContact OE1-NH2 3.05Å
1025	K	75.2	Confident	79.6	Confident	166 Å²	166	51.6 Å²	51.6	72%	0.722	25%	0.247	S	C	*	.	S	Bend	trans	-82	144.2	179.1	-67	-173.5	177.3	-174.4	0	111	P1023 C1027 Q1083	P1023-K1025 PolarHBondContact O-N 3.41Å; K1025-C1027 PolarHBondContact O-N 2.97Å; K1025-Q1083 PolarHBondContact O-NE2 3.43Å
1026	F	79	Confident	81.3	Confident	85 Å²	85	53.1 Å²	53.1	37%	0.373	25%	0.25	S	S	.	.			trans	-69.6	122.1	173.2	-60	-64.6	0	0	0	111.6	I1076 K1079 R1080	F1026-I1076 HydrophobicContact CE2-CG2 3.92Å; F1026-I1076 HydrophobicContact CZ-CG2 3.7Å; F1026-K1079 HydrophobicContact CD1-CB 4.07Å; F1026-K1079 HydrophobicContact CE1-CB 3.97Å; F1026-K1079 HydrophobicContact CZ-CB 4.49Å; F1026-R1080 HydrophobicContact CE1-CB 3.88Å; F1026-R1080 HydrophobicContact CZ-CB 4.43Å
1027	C	79.2	Confident	82.7	Confident	10 Å²	10	50.3 Å²	50.3	7%	0.068	24%	0.238	C	C	.	.			trans	-117	70.3	173.2	-57.1	0	0	0	0	109.2	F716 Y719 K1025	F716-C1027 HydrophobicContact CD1-CB 4.47Å; Y719-C1027 HydrophobicContact CD1-CB 3.56Å; Y719-C1027 HydrophobicContact CD2-CB 4.46Å; Y719-C1027 HydrophobicContact CE1-CB 4.21Å; Y719-C1027 HydrophobicContact CG-CB 3.72Å; K1025-C1027 PolarHBondContact O-N 2.97Å
1028	L	84.4	Confident	83.9	Confident	16 Å²	16	45 Å²	45	8%	0.084	21%	0.21	C	C	.	.			trans	-129.5	140.1	-174.2	-66.6	170.5	0	0	0	111.6	F716 E1030 K1079 L1082 Q1083 V1086	F716-L1028 WeakPolarHBondContact CZ-O 3.31Å; L1028-E1030 PolarHBondContact O-N 3.13Å; L1028-K1079 HydrophobicContact CD1-CB 3.99Å; L1028-K1079 HydrophobicContact CD1-CG 4.39Å; L1028-K1079 VanDerWaalsContact CD1-O 3.26Å; L1028-K1079 WeakPolarHBondContact CD1-O 3.33Å; L1028-L1082 HydrophobicContact CD1-CB 4.34Å; L1028-L1082 HydrophobicContact CD1-CD2 4.09Å; L1028-L1082 HydrophobicContact CD1-CG 4.31Å; L1028-L1082 HydrophobicContact CD2-CD2 4.01Å; L1028-L1082 HydrophobicContact CD2-CG 3.96Å; L1028-Q1083 HydrophobicContact CD1-CB 4.3Å; L1028-V1086 HydrophobicContact CD2-CG2 4.46Å
1029	F	84.1	Confident	84.7	Confident	42 Å²	42	46.2 Å²	46.2	18%	0.184	22%	0.216	C	C	.	.			trans	-79.5	111.3	-179	-66.6	-75.1	0	0	0	111.1	F716 M720 N1031 L1032 H1037 F1040 Y1041	F716-F1029 HydrophobicContact CD1-CE1 4.08Å; F716-F1029 HydrophobicContact CD1-CE2 4.47Å; F716-F1029 HydrophobicContact CD1-CZ 4.03Å; F716-F1029 HydrophobicContact CD2-CD1 4.48Å; F716-F1029 AromaticContact CD2-CE1 3.99Å; F716-F1029 HydrophobicContact CD2-CE1 3.99Å; F716-F1029 AromaticContact CE1-CD1 3.92Å; F716-F1029 HydrophobicContact CE1-CD1 3.92Å; F716-F1029 HydrophobicContact CE1-CD2 4.32Å; F716-F1029 AromaticContact CE1-CE1 3.9Å; F716-F1029 HydrophobicContact CE1-CE1 3.9Å; F716-F1029 HydrophobicContact CE1-CE2 4.31Å; F716-F1029 HydrophobicContact CE1-CG 4.13Å; F716-F1029 HydrophobicContact CE1-CZ 4.1Å; F716-F1029 AromaticContact CE2-CD1 3.84Å; F716-F1029 HydrophobicContact CE2-CD1 3.84Å; F716-F1029 AromaticContact CE2-CE1 3.81Å; F716-F1029 HydrophobicContact CE2-CE1 3.81Å; F716-F1029 HydrophobicContact CG-CE1 4.13Å; F716-F1029 HydrophobicContact CG-CZ 4.31Å; F716-F1029 AromaticContact CZ-CD1 3.54Å; F716-F1029 HydrophobicContact CZ-CD1 3.54Å; F716-F1029 AromaticContact CZ-CE1 3.78Å; F716-F1029 HydrophobicContact CZ-CE1 3.78Å; F716-F1029 HydrophobicContact CZ-CG 4.02Å; F716-F1029 HydrophobicContact CZ-CZ 4.44Å; M720-F1029 HydrophobicContact CE-CE2 4.26Å; M720-F1029 HydrophobicContact CE-CZ 3.71Å; F1029-N1031 PolarHBondContact O-N 3.31Å; F1029-L1032 HydrophobicContact CB-CB 4.17Å; F1029-L1032 HydrophobicContact CB-CD1 3.86Å; F1029-L1032 HydrophobicContact CB-CG 3.92Å; F1029-L1032 HydrophobicContact CD2-CD1 3.81Å; F1029-L1032 HydrophobicContact CG-CD1 3.99Å; F1029-L1032 PolarHBondContact O-N 3.08Å; F1029-H1037 PolarHBondContact N-NE2 3.34Å; F1029-H1037 PolarHBondContact O-CE1 3.5Å; F1029-H1037 PolarHBondContact O-NE2 2.93Å; F1029-F1040 HydrophobicContact CE2-CD1 4.44Å; F1029-F1040 HydrophobicContact CE2-CE1 4.05Å; F1029-Y1041 HydrophobicContact CE2-CE2 4.48Å
1030	E	82.4	Confident	85	Confident	73 Å²	73	49.6 Å²	49.6	34%	0.341	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.2	-173.6	-61	179	123.5	0	0	114	R710 Q714 L1028 G1072	R710-E1030 IonicContact CZ-OE2 3.44Å; R710-E1030 IonicContact NH2-OE2 3.27Å; R710-E1030 PolarHBondContact NH2-OE2 3.12Å; Q714-E1030 PolarHBondContact NE2-OE2 3.45Å; L1028-E1030 PolarHBondContact O-N 3.13Å; E1030-G1072 WeakPolarHBondContact O-CA 3.45Å; E1030-G1072 PolarHBondContact O-N 3.49Å
1031	N	83.7	Confident	85	Confident	128 Å²	128	49.6 Å²	49.6	68%	0.684	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-26.9	-176	-65.8	-3.9	0	0	0	114.5	F1029 R1070	F1029-N1031 PolarHBondContact O-N 3.31Å; N1031-R1070 WeakPolarHBondContact O-CD 3.37Å; N1031-R1070 WeakPolarHBondContact O-CG 3.27Å
1032	L	87.4	Confident	84.9	Confident	53 Å²	53	49.6 Å²	49.6	28%	0.277	23%	0.231	S	C	.	.	S	Bend	trans	-80.3	147.7	-176.4	-65.6	180	0	0	0	111.2	F1029 E1036 H1037 R1070 A1071	F1029-L1032 HydrophobicContact CB-CB 4.17Å; F1029-L1032 HydrophobicContact CB-CD1 3.86Å; F1029-L1032 HydrophobicContact CB-CG 3.92Å; F1029-L1032 HydrophobicContact CD2-CD1 3.81Å; F1029-L1032 HydrophobicContact CG-CD1 3.99Å; F1029-L1032 PolarHBondContact O-N 3.08Å; L1032-E1036 VanDerWaalsContact CA-OE2 3.31Å; L1032-E1036 WeakPolarHBondContact CA-OE2 3.34Å; L1032-E1036 HydrophobicContact CB-CB 4.12Å; L1032-E1036 HydrophobicContact CD2-CB 4.32Å; L1032-E1036 WeakPolarHBondContact CD2-OE2 3.34Å; L1032-H1037 PolarHBondContact O-CE1 2.82Å; L1032-H1037 VanDerWaalsContact O-CE1 3.3Å; L1032-H1037 PolarHBondContact O-ND1 2.88Å; L1032-R1070 WeakPolarHBondContact O-CA 3.45Å; L1032-A1071 PolarHBondContact O-N 3.17Å
1033	T	89.8	Confident	84.6	Confident	20 Å²	20	58.2 Å²	58.2	12%	0.123	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-71.2	161.3	172.7	67.7	0	0	0	0	112	R1035 E1036 H1037 S1068 V1069	T1033-R1035 PolarHBondContact O-N 2.75Å; T1033-E1036 WeakPolarHBondContact CB-OE1 3.07Å; T1033-E1036 WeakPolarHBondContact CG2-OE1 2.92Å; T1033-E1036 PolarHBondContact N-OE2 2.87Å; T1033-E1036 PolarHBondContact O-N 3.32Å; T1033-E1036 WeakPolarHBondContact OG1-CG 3.44Å; T1033-E1036 PolarHBondContact OG1-N 3.08Å; T1033-E1036 PolarHBondContact OG1-OE1 2.97Å; T1033-H1037 PolarHBondContact O-N 3.49Å; T1033-H1037 PolarHBondContact O-ND1 2.83Å; T1033-S1068 WeakPolarHBondContact CG2-O 3.5Å; T1033-V1069 WeakPolarHBondContact CA-O 3.33Å
1034	V	89.6	Confident	84.4	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-53.3	-42.4	172.9	162.3	0	0	0	0	111.3	L1038 L1063 F1066 S1067 V1069 L1074 L1082	V1034-L1038 HydrophobicContact CG1-CD1 4.33Å; V1034-L1038 WeakPolarHBondContact O-CG 3.36Å; V1034-L1038 PolarHBondContact O-N 3.42Å; V1034-L1063 HydrophobicContact CG1-CB 4.23Å; V1034-L1063 HydrophobicContact CG1-CD1 4.28Å; V1034-F1066 WeakPolarHBondContact CB-O 3.35Å; V1034-F1066 VanDerWaalsContact CG2-O 3.28Å; V1034-F1066 WeakPolarHBondContact CG2-O 3.36Å; V1034-S1067 PolarHBondContact N-O 3.2Å; V1034-V1069 PolarHBondContact N-O 3.12Å; V1034-V1069 VanDerWaalsContact N-O 3.17Å; V1034-L1074 HydrophobicContact CG2-CD1 3.74Å; V1034-L1074 HydrophobicContact CG2-CD2 4.33Å; V1034-L1082 HydrophobicContact CB-CD1 4.39Å; V1034-L1082 HydrophobicContact CG1-CD1 4.05Å; V1034-L1082 HydrophobicContact CG2-CD1 4.28Å; V1034-L1082 HydrophobicContact CG2-CD2 4.19Å
1035	R	88.5	Confident	84.1	Confident	168 Å²	168	58.5 Å²	58.5	63%	0.634	26%	0.264	S	S	*	.	H	α-helix	trans	-66.1	-45.3	178.1	-177.1	175.8	174.4	-178.3	-5.8	112.4	T1033 H1037 L1038 D1039 S1067	T1033-R1035 PolarHBondContact O-N 2.75Å; R1035-H1037 VanDerWaalsContact C-N 3.34Å; R1035-H1037 PolarHBondContact O-N 2.97Å; R1035-L1038 PolarHBondContact O-N 3.19Å; R1035-D1039 PolarHBondContact O-N 3.26Å; R1035-D1039 VanDerWaalsContact O-N 3.14Å; R1035-S1067 WeakPolarHBondContact CB-O 3.29Å; R1035-S1067 PolarHBondContact N-O 3.21Å
1036	E	90.5	Very high	83.9	Confident	85 Å²	85	53.4 Å²	53.4	40%	0.397	26%	0.258	S	S	.	.	H	α-helix	trans	-61.2	-39.2	177.1	-77.5	145.4	-132.1	0	0	112.6	L1032 T1033 L1038 F1040	L1032-E1036 VanDerWaalsContact CA-OE2 3.31Å; L1032-E1036 WeakPolarHBondContact CA-OE2 3.34Å; L1032-E1036 HydrophobicContact CB-CB 4.12Å; L1032-E1036 HydrophobicContact CD2-CB 4.32Å; L1032-E1036 WeakPolarHBondContact CD2-OE2 3.34Å; T1033-E1036 WeakPolarHBondContact CB-OE1 3.07Å; T1033-E1036 WeakPolarHBondContact CG2-OE1 2.92Å; T1033-E1036 PolarHBondContact N-OE2 2.87Å; T1033-E1036 PolarHBondContact O-N 3.32Å; T1033-E1036 WeakPolarHBondContact OG1-CG 3.44Å; T1033-E1036 PolarHBondContact OG1-N 3.08Å; T1033-E1036 PolarHBondContact OG1-OE1 2.97Å; E1036-L1038 VanDerWaalsContact C-N 3.35Å; E1036-L1038 PolarHBondContact O-N 2.84Å; E1036-F1040 WeakPolarHBondContact O-CB 3.47Å; E1036-F1040 PolarHBondContact O-N 3.43Å
1037	H	89.7	Confident	83.4	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.6	-48.3	175.9	-82	81.3	0	0	0	111.9	F1029 L1032 T1033 R1035 F1040 Y1041 A1071 L1082 V1086	F1029-H1037 PolarHBondContact N-NE2 3.34Å; F1029-H1037 PolarHBondContact O-CE1 3.5Å; F1029-H1037 PolarHBondContact O-NE2 2.93Å; L1032-H1037 PolarHBondContact O-CE1 2.82Å; L1032-H1037 VanDerWaalsContact O-CE1 3.3Å; L1032-H1037 PolarHBondContact O-ND1 2.88Å; T1033-H1037 PolarHBondContact O-N 3.49Å; T1033-H1037 PolarHBondContact O-ND1 2.83Å; R1035-H1037 VanDerWaalsContact C-N 3.34Å; R1035-H1037 PolarHBondContact O-N 2.97Å; H1037-F1040 PolarHBondContact O-N 2.98Å; H1037-Y1041 VanDerWaalsContact O-CD2 3.3Å; H1037-Y1041 WeakPolarHBondContact O-CD2 3.36Å; H1037-Y1041 PolarHBondContact O-N 3.27Å; H1037-A1071 WeakPolarHBondContact CE1-CB 3.41Å; H1037-L1082 HydrophobicContact CB-CD1 4.27Å; H1037-V1086 HydrophobicContact CB-CG2 4.18Å
1038	L	88.2	Confident	82.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-70.5	-43.4	-173.3	-61.6	168.7	0	0	0	110.6	V1034 R1035 E1036 Y1041 Q1042 I1058 L1082 A1085 V1086 V1089	V1034-L1038 HydrophobicContact CG1-CD1 4.33Å; V1034-L1038 WeakPolarHBondContact O-CG 3.36Å; V1034-L1038 PolarHBondContact O-N 3.42Å; R1035-L1038 PolarHBondContact O-N 3.19Å; E1036-L1038 VanDerWaalsContact C-N 3.35Å; E1036-L1038 PolarHBondContact O-N 2.84Å; L1038-Y1041 PolarHBondContact O-N 3.36Å; L1038-Q1042 WeakPolarHBondContact O-CB 3.41Å; L1038-Q1042 PolarHBondContact O-N 3.42Å; L1038-I1058 HydrophobicContact CD1-CD1 3.66Å; L1038-I1058 HydrophobicContact CD1-CG1 3.24Å; L1038-L1082 HydrophobicContact CD2-CD1 4.33Å; L1038-L1082 HydrophobicContact CG-CD1 4.36Å; L1038-A1085 HydrophobicContact CD2-CB 3.74Å; L1038-V1086 HydrophobicContact CD2-CB 4.47Å; L1038-V1086 HydrophobicContact CD2-CG2 3.78Å; L1038-V1089 HydrophobicContact CB-CG2 4.16Å; L1038-V1089 HydrophobicContact CD2-CG2 3.42Å; L1038-V1089 VanDerWaalsContact CD2-CG2 3.42Å; L1038-V1089 HydrophobicContact CG-CG2 4.36Å
1039	D	86.3	Confident	81.6	Confident	55 Å²	55	67.2 Å²	67.2	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-60.6	-44.1	172.8	-172.9	12.5	0	0	0	111.7	R1035 Y1041 Q1042 R1043	R1035-D1039 PolarHBondContact O-N 3.26Å; R1035-D1039 VanDerWaalsContact O-N 3.14Å; D1039-Y1041 PolarHBondContact O-N 3.02Å; D1039-Q1042 WeakPolarHBondContact O-CB 3.33Å; D1039-Q1042 PolarHBondContact O-N 3.44Å; D1039-R1043 VanDerWaalsContact O-CG 3.31Å; D1039-R1043 WeakPolarHBondContact O-CG 3.48Å; D1039-R1043 PolarHBondContact O-N 3.43Å; D1039-R1043 IonicContact OD1-CZ 2.71Å; D1039-R1043 IonicContact OD1-NE 3.55Å; D1039-R1043 PolarHBondContact OD1-NE 3.01Å; D1039-R1043 IonicContact OD1-NH2 2.85Å; D1039-R1043 PolarHBondContact OD1-NH2 3.01Å; D1039-R1043 IonicContact OD2-CZ 3.73Å; D1039-R1043 IonicContact OD2-NE 2.89Å; D1039-R1043 IonicContact OD2-NH2 3.27Å; D1039-R1043 PolarHBondContact OD2-NH2 3.18Å
1040	F	87.1	Confident	80.5	Confident	77 Å²	77	74.5 Å²	74.5	34%	0.338	35%	0.346	S	S	.	.	H	α-helix	trans	-58.3	-51	177.1	177.2	-97.8	0	0	0	112.6	M720 F1029 E1036 H1037 Q1042 R1043 L1044	M720-F1040 HydrophobicContact CE-CE1 3.84Å; M720-F1040 HydrophobicContact CE-CZ 3.74Å; F1029-F1040 HydrophobicContact CE2-CD1 4.44Å; F1029-F1040 HydrophobicContact CE2-CE1 4.05Å; E1036-F1040 WeakPolarHBondContact O-CB 3.47Å; E1036-F1040 PolarHBondContact O-N 3.43Å; H1037-F1040 PolarHBondContact O-N 2.98Å; F1040-Q1042 VanDerWaalsContact C-N 3.35Å; F1040-R1043 PolarHBondContact O-N 3.03Å; F1040-L1044 HydrophobicContact CE1-CD2 4.35Å; F1040-L1044 WeakPolarHBondContact O-CB 3.29Å; F1040-L1044 PolarHBondContact O-N 3.49Å
1041	Y	83.3	Confident	79.5	Confident	1 Å²	1	74.7 Å²	74.7	0%	0.004	36%	0.356	C	S	.	.	H	α-helix	trans	-72.1	-27.9	-180	-80.3	-77.2	0	0	0	113.1	Y719 F1029 H1037 L1038 D1039 L1044 R1045 V1086	Y719-Y1041 HydrophobicContact CD1-CE1 4.19Å; Y719-Y1041 WeakPolarHBondContact CD1-OH 3.29Å; Y719-Y1041 AromaticContact CE1-CE1 3.79Å; Y719-Y1041 HydrophobicContact CE1-CE1 3.79Å; Y719-Y1041 AromaticContact CE1-CZ 3.74Å; F1029-Y1041 HydrophobicContact CE2-CE2 4.48Å; H1037-Y1041 VanDerWaalsContact O-CD2 3.3Å; H1037-Y1041 WeakPolarHBondContact O-CD2 3.36Å; H1037-Y1041 PolarHBondContact O-N 3.27Å; L1038-Y1041 PolarHBondContact O-N 3.36Å; D1039-Y1041 PolarHBondContact O-N 3.02Å; Y1041-L1044 HydrophobicContact CD1-CD2 4Å; Y1041-L1044 HydrophobicContact CE1-CD2 4.1Å; Y1041-L1044 PolarHBondContact O-N 3.3Å; Y1041-R1045 PolarHBondContact O-N 3.03Å; Y1041-R1045 VanDerWaalsContact O-N 3.15Å; Y1041-V1086 HydrophobicContact CD1-CG1 3.96Å; Y1041-V1086 HydrophobicContact CD2-CB 4.31Å; Y1041-V1086 HydrophobicContact CD2-CG1 3.33Å; Y1041-V1086 HydrophobicContact CD2-CG2 3.99Å; Y1041-V1086 HydrophobicContact CE1-CG1 4.3Å; Y1041-V1086 HydrophobicContact CE2-CG1 3.72Å; Y1041-V1086 HydrophobicContact CG-CG1 3.48Å; Y1041-V1086 VanDerWaalsContact CG-CG1 3.48Å
1042	Q	83.1	Confident	78.6	Confident	5 Å²	5	75.2 Å²	75.2	2%	0.023	36%	0.356	C	S	.	.	H	α-helix	trans	-64.2	-46	172	-168.2	178.3	25.5	0	0	112.2	L1038 D1039 F1040 G1046 C1047 N1049 R1050 C1054 V1089	L1038-Q1042 WeakPolarHBondContact O-CB 3.41Å; L1038-Q1042 PolarHBondContact O-N 3.42Å; D1039-Q1042 WeakPolarHBondContact O-CB 3.33Å; D1039-Q1042 PolarHBondContact O-N 3.44Å; F1040-Q1042 VanDerWaalsContact C-N 3.35Å; Q1042-G1046 PolarHBondContact O-N 3.15Å; Q1042-C1047 HydrophobicContact CG-CB 3.84Å; Q1042-C1047 PolarHBondContact O-N 3.11Å; Q1042-N1049 PolarHBondContact NE2-O 3.05Å; Q1042-R1050 VanDerWaalsContact CD-O 3.31Å; Q1042-R1050 PolarHBondContact NE2-O 3.19Å; Q1042-R1050 PolarHBondContact OE1-O 3.47Å; Q1042-C1054 PolarHBondContact OE1-SG 3.1Å; Q1042-V1089 HydrophobicContact CB-CG1 3.68Å; Q1042-V1089 HydrophobicContact CG-CG1 3.84Å
1043	R	82.3	Confident	77.8	Confident	181 Å²	181	74 Å²	74	68%	0.683	35%	0.354	S	S	*	.	H	α-helix	trans	-64.3	-43.6	174.6	-68.2	176.4	-163.5	-155.3	9.4	111	D1039 F1040 R1045 G1046	D1039-R1043 VanDerWaalsContact O-CG 3.31Å; D1039-R1043 WeakPolarHBondContact O-CG 3.48Å; D1039-R1043 PolarHBondContact O-N 3.43Å; D1039-R1043 IonicContact OD1-CZ 2.71Å; D1039-R1043 IonicContact OD1-NE 3.55Å; D1039-R1043 PolarHBondContact OD1-NE 3.01Å; D1039-R1043 IonicContact OD1-NH2 2.85Å; D1039-R1043 PolarHBondContact OD1-NH2 3.01Å; D1039-R1043 IonicContact OD2-CZ 3.73Å; D1039-R1043 IonicContact OD2-NE 2.89Å; D1039-R1043 IonicContact OD2-NH2 3.27Å; D1039-R1043 PolarHBondContact OD2-NH2 3.18Å; F1040-R1043 PolarHBondContact O-N 3.03Å; R1043-R1045 VanDerWaalsContact C-N 3.27Å; R1043-R1045 PolarHBondContact O-N 3.32Å; R1043-G1046 PolarHBondContact O-N 3.35Å
1044	L	79.4	Confident	77.1	Confident	45 Å²	45	73.8 Å²	73.8	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-59.8	-36.4	-178.5	-174.6	63.1	0	0	0	113	L725 F1040 Y1041	L725-L1044 HydrophobicContact CD1-CD1 3.7Å; L725-L1044 HydrophobicContact CD1-CD2 4.06Å; L725-L1044 HydrophobicContact CD1-CG 4.46Å; L725-L1044 HydrophobicContact CD2-CD1 3.93Å; L725-L1044 HydrophobicContact CG-CD1 3.85Å; F1040-L1044 HydrophobicContact CE1-CD2 4.35Å; F1040-L1044 WeakPolarHBondContact O-CB 3.29Å; F1040-L1044 PolarHBondContact O-N 3.49Å; Y1041-L1044 HydrophobicContact CD1-CD2 4Å; Y1041-L1044 HydrophobicContact CE1-CD2 4.1Å; Y1041-L1044 PolarHBondContact O-N 3.3Å
1045	R	73.4	Confident	76.6	Confident	17 Å²	17	81.8 Å²	81.8	6%	0.064	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	4.5	176.2	-70	-174.7	-177.2	-179	11.3	114.4	Y1041 R1043 A1087 C1090	Y1041-R1045 PolarHBondContact O-N 3.03Å; Y1041-R1045 VanDerWaalsContact O-N 3.15Å; R1043-R1045 VanDerWaalsContact C-N 3.27Å; R1043-R1045 PolarHBondContact O-N 3.32Å; R1045-A1087 PolarHBondContact NH1-O 2.87Å; R1045-A1087 PolarHBondContact NH2-O 3.37Å; R1045-C1090 HydrophobicContact CB-CB 3.93Å; R1045-C1090 VanDerWaalsContact CB-SG 3.55Å
1046	G	70.8	Confident	76.2	Confident	59 Å²	59	76.1 Å²	76.1	61%	0.608	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	23.2	170.4	0	0	0	0	0	116.7	Q1042 R1043 R1048	Q1042-G1046 PolarHBondContact O-N 3.15Å; R1043-G1046 PolarHBondContact O-N 3.35Å; G1046-R1048 PolarHBondContact O-N 3.03Å
1047	C	67.7	Low	75.7	Confident	36 Å²	36	72.7 Å²	72.7	24%	0.243	35%	0.353	C	S	.	.			trans	-75.1	126	-172.2	-68.3	0	0	0	0	114.1	Q1042 C1090	Q1042-C1047 HydrophobicContact CG-CB 3.84Å; Q1042-C1047 PolarHBondContact O-N 3.11Å; C1047-C1090 HydrophobicContact CB-CB 4.42Å; C1047-C1090 WeakPolarHBondContact CB-SG 3.46Å; C1047-C1090 WeakPolarHBondContact SG-CA 3.34Å; C1047-C1090 WeakPolarHBondContact SG-CB 3.4Å; C1047-C1090 CovalentContact SG-SG 2.03Å; C1047-C1090 PolarHBondContact SG-SG 3.31Å
1048	R	63.3	Low	75.4	Confident	236 Å²	236	73.1 Å²	73.1	89%	0.891	36%	0.355	S	S	*	.	S	Bend	trans	-72.3	-36.1	-174	-69.7	-179	175.2	172.8	-2.9	114.5	G1046 R1050	G1046-R1048 PolarHBondContact O-N 3.03Å; R1048-R1050 PolarHBondContact O-N 3.34Å; R1048-R1050 VanDerWaalsContact O-N 3.08Å
1049	N	62.9	Low	75.1	Confident	129 Å²	129	79.8 Å²	79.8	69%	0.69	39%	0.389	S	S	*	.			trans	-84.1	79.4	-179.3	-83.4	-9.9	0	0	0	112.3	Q1042	Q1042-N1049 PolarHBondContact NE2-O 3.05Å
1050	R	61	Low	74.8	Confident	195 Å²	195	80.8 Å²	80.8	74%	0.736	39%	0.391	S	S	*	.	H	α-helix	trans	-62.4	-58.5	-166.3	-63.8	173.1	-175	158.1	0.7	115	Q1042 R1048	Q1042-R1050 VanDerWaalsContact CD-O 3.31Å; Q1042-R1050 PolarHBondContact NE2-O 3.19Å; Q1042-R1050 PolarHBondContact OE1-O 3.47Å; R1048-R1050 PolarHBondContact O-N 3.34Å; R1048-R1050 VanDerWaalsContact O-N 3.08Å
1051	S	62.3	Low	74.3	Confident	77 Å²	77	77.7 Å²	77.7	54%	0.538	38%	0.379	S	S	.	.	H	α-helix	trans	-88	-35.4	-162.9	54.8	0	0	0	0	115.9
1052	M	64.4	Low	74.1	Confident	139 Å²	139	80.1 Å²	80.1	69%	0.685	40%	0.404	S	S	*	.	H	α-helix	trans	-77.4	-45	-171.6	-65.8	-163.3	-69.6	0	0	113.2	C1054 R1055 S1056	M1052-C1054 VanDerWaalsContact C-N 3.33Å; M1052-C1054 PolarHBondContact O-N 2.9Å; M1052-R1055 PolarHBondContact O-N 3.43Å; M1052-S1056 PolarHBondContact O-N 3.42Å; M1052-S1056 PolarHBondContact O-OG 2.88Å
1053	A	70.3	Confident	74.1	Confident	29 Å²	29	80 Å²	80	24%	0.24	40%	0.404	C	S	.	.	H	α-helix	trans	-60.5	-38.9	-177.8	0	0	0	0	0	113.1	S1056 I1057	A1053-S1056 PolarHBondContact O-OG 3.29Å; A1053-S1056 VanDerWaalsContact O-OG 3.05Å; A1053-I1057 WeakPolarHBondContact O-CB 3.48Å; A1053-I1057 WeakPolarHBondContact O-CD1 3.31Å; A1053-I1057 WeakPolarHBondContact O-CG1 3.44Å; A1053-I1057 PolarHBondContact O-N 3.36Å; A1053-I1057 VanDerWaalsContact O-N 3.16Å
1054	C	74.8	Confident	74.1	Confident	15 Å²	15	76.4 Å²	76.4	10%	0.101	40%	0.396	C	S	.	.	H	α-helix	trans	-64.2	-41.1	173.2	-83.5	0	0	0	0	112.1	Q1042 M1052 I1058	Q1042-C1054 PolarHBondContact OE1-SG 3.1Å; M1052-C1054 VanDerWaalsContact C-N 3.33Å; M1052-C1054 PolarHBondContact O-N 2.9Å; C1054-I1058 WeakPolarHBondContact O-CB 3.36Å; C1054-I1058 VanDerWaalsContact O-CD1 3.28Å; C1054-I1058 WeakPolarHBondContact O-CD1 3.45Å; C1054-I1058 WeakPolarHBondContact O-CG1 3.23Å; C1054-I1058 PolarHBondContact O-N 2.9Å; C1054-I1058 VanDerWaalsContact O-N 3.1Å
1055	R	78.7	Confident	74.2	Confident	167 Å²	167	78.2 Å²	78.2	63%	0.63	42%	0.417	S	S	*	.	H	α-helix	trans	-68.1	-43.7	179.4	-73.8	179.6	178	168.3	-0.7	112.4	M1052 I1058 M1059	M1052-R1055 PolarHBondContact O-N 3.43Å; R1055-I1058 PolarHBondContact O-N 3.26Å; R1055-M1059 WeakPolarHBondContact O-CB 3.23Å; R1055-M1059 PolarHBondContact O-N 2.94Å
1056	S	80.2	Confident	74.7	Confident	49 Å²	49	80.7 Å²	80.7	34%	0.343	43%	0.429	S	S	.	.	H	α-helix	trans	-61.2	-48.3	178	59.5	0	0	0	0	111.1	M1052 A1053 I1058 M1059 E1060	M1052-S1056 PolarHBondContact O-N 3.42Å; M1052-S1056 PolarHBondContact O-OG 2.88Å; A1053-S1056 PolarHBondContact O-OG 3.29Å; A1053-S1056 VanDerWaalsContact O-OG 3.05Å; S1056-I1058 PolarHBondContact O-N 2.89Å; S1056-M1059 WeakPolarHBondContact O-CA 3.45Å; S1056-M1059 WeakPolarHBondContact O-CB 3.38Å; S1056-M1059 PolarHBondContact O-N 3.44Å; S1056-M1059 VanDerWaalsContact O-N 3.08Å; S1056-E1060 WeakPolarHBondContact O-CB 3.33Å; S1056-E1060 VanDerWaalsContact O-CG 3.3Å; S1056-E1060 WeakPolarHBondContact O-CG 3.5Å; S1056-E1060 PolarHBondContact O-N 3.4Å
1057	I	81.4	Confident	75.3	Confident	13 Å²	13	79.6 Å²	79.6	7%	0.067	41%	0.411	C	S	.	.	H	α-helix	trans	-64.8	-39.1	-179.2	-67.1	168.8	0	0	0	111.8	A1053 M1059 T1061 A1085 I1088	A1053-I1057 WeakPolarHBondContact O-CB 3.48Å; A1053-I1057 WeakPolarHBondContact O-CD1 3.31Å; A1053-I1057 WeakPolarHBondContact O-CG1 3.44Å; A1053-I1057 PolarHBondContact O-N 3.36Å; A1053-I1057 VanDerWaalsContact O-N 3.16Å; I1057-M1059 VanDerWaalsContact C-N 3.29Å; I1057-M1059 PolarHBondContact O-N 3Å; I1057-T1061 HydrophobicContact CG2-CG2 4.13Å; I1057-T1061 VanDerWaalsContact O-CB 3.29Å; I1057-T1061 WeakPolarHBondContact O-CB 3.3Å; I1057-T1061 VanDerWaalsContact O-CG2 3.26Å; I1057-T1061 WeakPolarHBondContact O-CG2 3.5Å; I1057-T1061 PolarHBondContact O-N 3.3Å; I1057-T1061 PolarHBondContact O-OG1 2.81Å; I1057-A1085 HydrophobicContact CG2-CB 3.82Å; I1057-I1088 HydrophobicContact CD1-CG2 4.4Å
1058	I	82.7	Confident	76.2	Confident	9 Å²	9	82.3 Å²	82.3	5%	0.046	43%	0.431	C	S	.	.	H	α-helix	trans	-64.1	-36.6	175	-64.8	164.8	0	0	0	111.1	L1038 C1054 R1055 S1056 G1062 L1063 M1064	L1038-I1058 HydrophobicContact CD1-CD1 3.66Å; L1038-I1058 HydrophobicContact CD1-CG1 3.24Å; C1054-I1058 WeakPolarHBondContact O-CB 3.36Å; C1054-I1058 VanDerWaalsContact O-CD1 3.28Å; C1054-I1058 WeakPolarHBondContact O-CD1 3.45Å; C1054-I1058 WeakPolarHBondContact O-CG1 3.23Å; C1054-I1058 PolarHBondContact O-N 2.9Å; C1054-I1058 VanDerWaalsContact O-N 3.1Å; R1055-I1058 PolarHBondContact O-N 3.26Å; S1056-I1058 PolarHBondContact O-N 2.89Å; I1058-G1062 PolarHBondContact O-N 3.45Å; I1058-L1063 HydrophobicContact CG2-CB 4.05Å; I1058-L1063 PolarHBondContact O-N 2.83Å; I1058-M1064 HydrophobicContact CB-SD 4.09Å; I1058-M1064 HydrophobicContact CG2-CB 4.34Å; I1058-M1064 HydrophobicContact CG2-CG 3.85Å; I1058-M1064 HydrophobicContact CG2-SD 3.51Å; I1058-M1064 VanDerWaalsContact CG2-SD 3.51Å; I1058-M1064 PolarHBondContact O-N 2.75Å
1059	M	82.2	Confident	77.3	Confident	142 Å²	142	73.2 Å²	73.2	70%	0.7	40%	0.402	S	S	*	.	H	α-helix	trans	-69.2	-49.8	176.9	-170.8	173	-178.1	0	0	111.8	R1055 S1056 I1057 T1061 G1062 M1064	R1055-M1059 WeakPolarHBondContact O-CB 3.23Å; R1055-M1059 PolarHBondContact O-N 2.94Å; S1056-M1059 WeakPolarHBondContact O-CA 3.45Å; S1056-M1059 WeakPolarHBondContact O-CB 3.38Å; S1056-M1059 PolarHBondContact O-N 3.44Å; S1056-M1059 VanDerWaalsContact O-N 3.08Å; I1057-M1059 VanDerWaalsContact C-N 3.29Å; I1057-M1059 PolarHBondContact O-N 3Å; M1059-T1061 PolarHBondContact O-N 3.45Å; M1059-G1062 PolarHBondContact O-N 3.49Å; M1059-M1064 HydrophobicContact CB-CG 4.18Å
1060	E	78.7	Confident	78.5	Confident	75 Å²	75	74.7 Å²	74.7	35%	0.35	40%	0.398	S	S	.	.	H	α-helix	trans	-66.2	-36	-178.6	-70.6	162.3	171.1	0	0	113.1	S1056 G1062 F1115 H1119	S1056-E1060 WeakPolarHBondContact O-CB 3.33Å; S1056-E1060 VanDerWaalsContact O-CG 3.3Å; S1056-E1060 WeakPolarHBondContact O-CG 3.5Å; S1056-E1060 PolarHBondContact O-N 3.4Å; E1060-G1062 VanDerWaalsContact C-N 3.28Å; E1060-G1062 PolarHBondContact O-N 3.33Å; E1060-F1115 HydrophobicContact CB-CD2 4.05Å; E1060-F1115 HydrophobicContact CB-CE2 4Å; E1060-H1119 IonicContact OE2-CE1 3.26Å; E1060-H1119 IonicContact OE2-NE2 2.71Å
1061	T	76.7	Confident	79.7	Confident	13 Å²	13	65.5 Å²	65.5	8%	0.08	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-3.9	177.1	59.5	0	0	0	0	113.8	I1057 M1059 L1063 I1081 A1085 F1115	I1057-T1061 HydrophobicContact CG2-CG2 4.13Å; I1057-T1061 VanDerWaalsContact O-CB 3.29Å; I1057-T1061 WeakPolarHBondContact O-CB 3.3Å; I1057-T1061 VanDerWaalsContact O-CG2 3.26Å; I1057-T1061 WeakPolarHBondContact O-CG2 3.5Å; I1057-T1061 PolarHBondContact O-N 3.3Å; I1057-T1061 PolarHBondContact O-OG1 2.81Å; M1059-T1061 PolarHBondContact O-N 3.45Å; T1061-L1063 VanDerWaalsContact C-N 3.3Å; T1061-L1063 PolarHBondContact O-N 2.72Å; T1061-I1081 HydrophobicContact CG2-CG2 4.31Å; T1061-A1085 HydrophobicContact CG2-CB 4.25Å; T1061-F1115 HydrophobicContact CG2-CE2 4.3Å; T1061-F1115 HydrophobicContact CG2-CZ 4.41Å
1062	G	79.3	Confident	80.6	Confident	52 Å²	52	63.1 Å²	63.1	54%	0.536	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	19.9	-179.2	0	0	0	0	0	114.3	I1058 M1059 E1060	I1058-G1062 PolarHBondContact O-N 3.45Å; M1059-G1062 PolarHBondContact O-N 3.49Å; E1060-G1062 VanDerWaalsContact C-N 3.28Å; E1060-G1062 PolarHBondContact O-N 3.33Å
1063	L	83.9	Confident	81.5	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	35%	0.352	C	S	.	.			trans	-89.9	-2.3	-177.6	-71.6	179.6	0	0	0	114.2	V1034 I1058 T1061 A1065 F1066 S1067 I1081 L1082	V1034-L1063 HydrophobicContact CG1-CB 4.23Å; V1034-L1063 HydrophobicContact CG1-CD1 4.28Å; I1058-L1063 HydrophobicContact CG2-CB 4.05Å; I1058-L1063 PolarHBondContact O-N 2.83Å; T1061-L1063 VanDerWaalsContact C-N 3.3Å; T1061-L1063 PolarHBondContact O-N 2.72Å; L1063-A1065 VanDerWaalsContact C-N 3.33Å; L1063-A1065 PolarHBondContact O-N 3.14Å; L1063-F1066 CarbonylContact O-C 2.91Å; L1063-F1066 WeakPolarHBondContact O-CA 3.43Å; L1063-F1066 PolarHBondContact O-N 3.19Å; L1063-S1067 PolarHBondContact O-N 2.88Å; L1063-S1067 VanDerWaalsContact O-N 3.09Å; L1063-I1081 HydrophobicContact CD1-CG2 3.96Å; L1063-I1081 HydrophobicContact CD2-CG2 4.21Å; L1063-I1081 HydrophobicContact CG-CG2 3.94Å; L1063-L1082 HydrophobicContact CD1-CB 4.2Å; L1063-L1082 HydrophobicContact CD1-CD1 4.27Å
1064	M	82.2	Confident	82.1	Confident	106 Å²	106	60.6 Å²	60.6	52%	0.522	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-50.8	-46.8	-177.5	-75.6	-68.1	-78.6	0	0	113.7	I1058 M1059 F1066 S1067	I1058-M1064 HydrophobicContact CB-SD 4.09Å; I1058-M1064 HydrophobicContact CG2-CB 4.34Å; I1058-M1064 HydrophobicContact CG2-CG 3.85Å; I1058-M1064 HydrophobicContact CG2-SD 3.51Å; I1058-M1064 VanDerWaalsContact CG2-SD 3.51Å; I1058-M1064 PolarHBondContact O-N 2.75Å; M1059-M1064 HydrophobicContact CB-CG 4.18Å; M1064-F1066 PolarHBondContact O-N 2.86Å; M1064-F1066 VanDerWaalsContact O-N 3.15Å; M1064-S1067 VanDerWaalsContact O-CB 3.3Å; M1064-S1067 WeakPolarHBondContact O-CB 3.11Å; M1064-S1067 PolarHBondContact O-N 3.44Å; M1064-S1067 VanDerWaalsContact O-N 3.17Å; M1064-S1067 PolarHBondContact O-OG 3.45Å
1065	A	81	Confident	82.4	Confident	83 Å²	83	62.3 Å²	62.3	69%	0.686	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-64.8	-15.9	178.7	0	0	0	0	0	114.1	L1063	L1063-A1065 VanDerWaalsContact C-N 3.33Å; L1063-A1065 PolarHBondContact O-N 3.14Å
1066	F	84.2	Confident	82.3	Confident	69 Å²	69	59.3 Å²	59.3	30%	0.303	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-113.9	8.5	-179.9	-53.5	-77.4	0	0	0	112.5	V1034 L1063 M1064 S1068 V1069 L1074 M1078	V1034-F1066 WeakPolarHBondContact CB-O 3.35Å; V1034-F1066 VanDerWaalsContact CG2-O 3.28Å; V1034-F1066 WeakPolarHBondContact CG2-O 3.36Å; L1063-F1066 CarbonylContact O-C 2.91Å; L1063-F1066 WeakPolarHBondContact O-CA 3.43Å; L1063-F1066 PolarHBondContact O-N 3.19Å; M1064-F1066 PolarHBondContact O-N 2.86Å; M1064-F1066 VanDerWaalsContact O-N 3.15Å; F1066-S1068 VanDerWaalsContact C-N 3.28Å; F1066-S1068 PolarHBondContact O-N 2.71Å; F1066-V1069 HydrophobicContact CB-CB 4.33Å; F1066-V1069 HydrophobicContact CB-CG2 4.37Å; F1066-V1069 HydrophobicContact CD1-CG2 4.33Å; F1066-V1069 WeakPolarHBondContact O-CB 3.02Å; F1066-V1069 PolarHBondContact O-N 2.83Å; F1066-L1074 HydrophobicContact CB-CD2 3.86Å; F1066-L1074 HydrophobicContact CD1-CD2 4.35Å; F1066-L1074 HydrophobicContact CG-CD2 4.24Å; F1066-M1078 HydrophobicContact CD1-SD 4.46Å; F1066-M1078 HydrophobicContact CD2-CE 4.2Å; F1066-M1078 HydrophobicContact CE1-CE 3.91Å; F1066-M1078 HydrophobicContact CE1-SD 4.26Å; F1066-M1078 HydrophobicContact CE2-CE 3.48Å; F1066-M1078 VanDerWaalsContact CE2-CE 3.48Å; F1066-M1078 HydrophobicContact CE2-SD 4.33Å; F1066-M1078 HydrophobicContact CZ-CE 3.32Å; F1066-M1078 HydrophobicContact CZ-SD 4.2Å
1067	S	84.5	Confident	82.4	Confident	35 Å²	35	58.6 Å²	58.6	25%	0.245	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-36.5	-174.3	55	0	0	0	0	114	V1034 R1035 L1063 M1064	V1034-S1067 PolarHBondContact N-O 3.2Å; R1035-S1067 WeakPolarHBondContact CB-O 3.29Å; R1035-S1067 PolarHBondContact N-O 3.21Å; L1063-S1067 PolarHBondContact O-N 2.88Å; L1063-S1067 VanDerWaalsContact O-N 3.09Å; M1064-S1067 VanDerWaalsContact O-CB 3.3Å; M1064-S1067 WeakPolarHBondContact O-CB 3.11Å; M1064-S1067 PolarHBondContact O-N 3.44Å; M1064-S1067 VanDerWaalsContact O-N 3.17Å; M1064-S1067 PolarHBondContact O-OG 3.45Å
1068	S	85.3	Confident	82.6	Confident	94 Å²	94	60.3 Å²	60.3	66%	0.657	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.1	175.3	55.9	0	0	0	0	114.3	T1033 F1066	T1033-S1068 WeakPolarHBondContact CG2-O 3.5Å; F1066-S1068 VanDerWaalsContact C-N 3.28Å; F1066-S1068 PolarHBondContact O-N 2.71Å
1069	V	87.4	Confident	82.7	Confident	45 Å²	45	62 Å²	62	27%	0.273	36%	0.357	S	S	.	.	S	Bend	trans	-84	133.6	-178	-179.4	0	0	0	0	109.5	T1033 V1034 F1066 C1073 L1074	T1033-V1069 WeakPolarHBondContact CA-O 3.33Å; V1034-V1069 PolarHBondContact N-O 3.12Å; V1034-V1069 VanDerWaalsContact N-O 3.17Å; F1066-V1069 HydrophobicContact CB-CB 4.33Å; F1066-V1069 HydrophobicContact CB-CG2 4.37Å; F1066-V1069 HydrophobicContact CD1-CG2 4.33Å; F1066-V1069 WeakPolarHBondContact O-CB 3.02Å; F1066-V1069 PolarHBondContact O-N 2.83Å; V1069-C1073 HydrophobicContact CG1-CB 3.89Å; V1069-L1074 HydrophobicContact CB-CD2 4.44Å; V1069-L1074 HydrophobicContact CG1-CD2 4.17Å
1070	R	88.5	Confident	82.9	Confident	160 Å²	160	55.3 Å²	55.3	60%	0.604	32%	0.324	S	S	*	.	B	Isolated β-bridge	trans	-62.1	137.5	174.3	-63.6	-176.3	-175	145.8	2.6	110.7	N1031 L1032 G1072 C1073	N1031-R1070 WeakPolarHBondContact O-CD 3.37Å; N1031-R1070 WeakPolarHBondContact O-CG 3.27Å; L1032-R1070 WeakPolarHBondContact O-CA 3.45Å; R1070-G1072 PolarHBondContact O-N 2.71Å; R1070-G1072 VanDerWaalsContact O-N 3.09Å; R1070-C1073 PolarHBondContact O-N 3.09Å
1071	A	85.6	Confident	83.4	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.008	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-59	-29.2	-176	0	0	0	0	0	113	L1032 H1037 C1073 L1074 K1079 L1082	L1032-A1071 PolarHBondContact O-N 3.17Å; H1037-A1071 WeakPolarHBondContact CE1-CB 3.41Å; A1071-C1073 VanDerWaalsContact C-N 3.28Å; A1071-C1073 PolarHBondContact O-N 2.68Å; A1071-L1074 HydrophobicContact CB-CD1 4.23Å; A1071-L1074 WeakPolarHBondContact O-CB 3.44Å; A1071-L1074 PolarHBondContact O-N 2.9Å; A1071-L1074 VanDerWaalsContact O-N 3.15Å; A1071-K1079 WeakPolarHBondContact O-CE 3.45Å; A1071-L1082 HydrophobicContact CB-CD2 3.87Å
1072	G	81.2	Confident	84	Confident	28 Å²	28	52.3 Å²	52.3	29%	0.289	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-53.3	-42	173.6	0	0	0	0	0	113.4	E1030 R1070 L1074 K1079	E1030-G1072 WeakPolarHBondContact O-CA 3.45Å; E1030-G1072 PolarHBondContact O-N 3.49Å; R1070-G1072 PolarHBondContact O-N 2.71Å; R1070-G1072 VanDerWaalsContact O-N 3.09Å; G1072-L1074 VanDerWaalsContact C-N 3.33Å; G1072-L1074 PolarHBondContact O-N 3.32Å; G1072-K1079 PolarHBondContact O-NZ 3.04Å
1073	C	84.1	Confident	84.5	Confident	105 Å²	105	49.8 Å²	49.8	71%	0.709	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-79.5	-8.3	-178	-59.8	0	0	0	0	114.3	V1069 R1070 A1071	V1069-C1073 HydrophobicContact CG1-CB 3.89Å; R1070-C1073 PolarHBondContact O-N 3.09Å; A1071-C1073 VanDerWaalsContact C-N 3.28Å; A1071-C1073 PolarHBondContact O-N 2.68Å
1074	L	82.6	Confident	84.7	Confident	9 Å²	9	49.9 Å²	49.9	5%	0.047	29%	0.285	C	S	.	.	S	Bend	trans	-71.6	144.7	178.5	-64.6	177.9	0	0	0	111.8	V1034 F1066 V1069 A1071 G1072 M1078 K1079 L1082	V1034-L1074 HydrophobicContact CG2-CD1 3.74Å; V1034-L1074 HydrophobicContact CG2-CD2 4.33Å; F1066-L1074 HydrophobicContact CB-CD2 3.86Å; F1066-L1074 HydrophobicContact CD1-CD2 4.35Å; F1066-L1074 HydrophobicContact CG-CD2 4.24Å; V1069-L1074 HydrophobicContact CB-CD2 4.44Å; V1069-L1074 HydrophobicContact CG1-CD2 4.17Å; A1071-L1074 HydrophobicContact CB-CD1 4.23Å; A1071-L1074 WeakPolarHBondContact O-CB 3.44Å; A1071-L1074 PolarHBondContact O-N 2.9Å; A1071-L1074 VanDerWaalsContact O-N 3.15Å; G1072-L1074 VanDerWaalsContact C-N 3.33Å; G1072-L1074 PolarHBondContact O-N 3.32Å; L1074-M1078 HydrophobicContact CB-CB 3.91Å; L1074-M1078 HydrophobicContact CD1-CB 4.4Å; L1074-M1078 HydrophobicContact CD2-CB 4.13Å; L1074-M1078 HydrophobicContact CD2-SD 4.44Å; L1074-M1078 HydrophobicContact CG-CB 4.37Å; L1074-K1079 HydrophobicContact CB-CG 3.84Å; L1074-K1079 VanDerWaalsContact O-CE 3.22Å; L1074-K1079 WeakPolarHBondContact O-CE 3.11Å; L1074-L1082 HydrophobicContact CD1-CD2 3.81Å
1075	S	80.8	Confident	85	Confident	51 Å²	51	44.8 Å²	44.8	36%	0.357	26%	0.26	S	S	.	.			trans	-60.3	154.7	167.9	73.3	0	0	0	0	111.1	Q1077 M1078 K1079	S1075-Q1077 PolarHBondContact O-N 3.07Å; S1075-M1078 PolarHBondContact O-N 2.72Å; S1075-M1078 WeakPolarHBondContact OG-CG 3.44Å; S1075-M1078 PolarHBondContact OG-N 2.94Å; S1075-M1078 PolarHBondContact OG-SD 3.14Å; S1075-K1079 PolarHBondContact O-N 2.81Å
1076	I	77.1	Confident	85.3	Confident	104 Å²	104	40.9 Å²	40.9	53%	0.533	23%	0.227	S	C	.	.	H	α-helix	trans	-50.9	-34.5	176.7	-63.5	172.6	0	0	0	111.7	F1026 R1080	F1026-I1076 HydrophobicContact CE2-CG2 3.92Å; F1026-I1076 HydrophobicContact CZ-CG2 3.7Å; I1076-R1080 PolarHBondContact O-N 2.85Å; I1076-R1080 VanDerWaalsContact O-N 3.07Å
1077	Q	80.6	Confident	85.3	Confident	35 Å²	35	37.6 Å²	37.6	16%	0.164	21%	0.213	C	C	.	.	H	α-helix	trans	-70.6	-44.3	178.8	-69.5	166.5	12.8	0	0	112.1	S1075 R1080 I1081 G1103 L1104 K1105	S1075-Q1077 PolarHBondContact O-N 3.07Å; Q1077-R1080 PolarHBondContact O-N 3.14Å; Q1077-I1081 WeakPolarHBondContact O-CG1 3.23Å; Q1077-I1081 PolarHBondContact O-N 2.9Å; Q1077-I1081 VanDerWaalsContact O-N 3.09Å; Q1077-G1103 WeakPolarHBondContact CG-O 3.44Å; Q1077-G1103 PolarHBondContact NE2-O 3.34Å; Q1077-L1104 HydrophobicContact CB-CD2 4.09Å; Q1077-L1104 HydrophobicContact CG-CD2 4.35Å; Q1077-L1104 WeakPolarHBondContact O-CD2 3.37Å; Q1077-K1105 VanDerWaalsContact OE1-CD 3.23Å; Q1077-K1105 VanDerWaalsContact OE1-CE 3.23Å
1078	M	86.1	Confident	85.3	Confident	49 Å²	49	36.3 Å²	36.3	24%	0.241	20%	0.203	C	C	.	.	H	α-helix	trans	-67.9	-35.8	174.9	-70.2	151.4	178.6	0	0	111.7	F1066 L1074 S1075 R1080 I1081 L1082	F1066-M1078 HydrophobicContact CD1-SD 4.46Å; F1066-M1078 HydrophobicContact CD2-CE 4.2Å; F1066-M1078 HydrophobicContact CE1-CE 3.91Å; F1066-M1078 HydrophobicContact CE1-SD 4.26Å; F1066-M1078 HydrophobicContact CE2-CE 3.48Å; F1066-M1078 VanDerWaalsContact CE2-CE 3.48Å; F1066-M1078 HydrophobicContact CE2-SD 4.33Å; F1066-M1078 HydrophobicContact CZ-CE 3.32Å; F1066-M1078 HydrophobicContact CZ-SD 4.2Å; L1074-M1078 HydrophobicContact CB-CB 3.91Å; L1074-M1078 HydrophobicContact CD1-CB 4.4Å; L1074-M1078 HydrophobicContact CD2-CB 4.13Å; L1074-M1078 HydrophobicContact CD2-SD 4.44Å; L1074-M1078 HydrophobicContact CG-CB 4.37Å; S1075-M1078 PolarHBondContact O-N 2.72Å; S1075-M1078 WeakPolarHBondContact OG-CG 3.44Å; S1075-M1078 PolarHBondContact OG-N 2.94Å; S1075-M1078 PolarHBondContact OG-SD 3.14Å; M1078-R1080 VanDerWaalsContact C-N 3.31Å; M1078-R1080 PolarHBondContact O-N 3.31Å; M1078-I1081 PolarHBondContact O-N 2.75Å; M1078-L1082 WeakPolarHBondContact O-CB 3.45Å; M1078-L1082 PolarHBondContact O-N 3.26Å
1079	K	85.9	Confident	85.1	Confident	43 Å²	43	32.1 Å²	32.1	19%	0.187	17%	0.173	C	C	.	.	H	α-helix	trans	-58.9	-41.7	170.6	-71	178.2	174.2	170.7	0	111.2	F1026 L1028 A1071 G1072 L1074 S1075 L1082 Q1083	F1026-K1079 HydrophobicContact CD1-CB 4.07Å; F1026-K1079 HydrophobicContact CE1-CB 3.97Å; F1026-K1079 HydrophobicContact CZ-CB 4.49Å; L1028-K1079 HydrophobicContact CD1-CB 3.99Å; L1028-K1079 HydrophobicContact CD1-CG 4.39Å; L1028-K1079 VanDerWaalsContact CD1-O 3.26Å; L1028-K1079 WeakPolarHBondContact CD1-O 3.33Å; A1071-K1079 WeakPolarHBondContact O-CE 3.45Å; G1072-K1079 PolarHBondContact O-NZ 3.04Å; L1074-K1079 HydrophobicContact CB-CG 3.84Å; L1074-K1079 VanDerWaalsContact O-CE 3.22Å; L1074-K1079 WeakPolarHBondContact O-CE 3.11Å; S1075-K1079 PolarHBondContact O-N 2.81Å; K1079-L1082 PolarHBondContact O-N 3.34Å; K1079-Q1083 WeakPolarHBondContact O-CB 3.15Å; K1079-Q1083 PolarHBondContact O-N 3.42Å
1080	R	86.1	Confident	84.4	Confident	3 Å²	3	30.9 Å²	30.9	1%	0.011	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-42.6	176.6	-167	56.7	162.6	172.1	-2.6	112.7	P1023 E1024 F1026 I1076 Q1077 M1078 Q1083 I1084 D1098 Q1099 P1100 L1104	P1023-R1080 PolarHBondContact O-NH1 3.43Å; E1024-R1080 PolarHBondContact O-NH1 3.18Å; F1026-R1080 HydrophobicContact CE1-CB 3.88Å; F1026-R1080 HydrophobicContact CZ-CB 4.43Å; I1076-R1080 PolarHBondContact O-N 2.85Å; I1076-R1080 VanDerWaalsContact O-N 3.07Å; Q1077-R1080 PolarHBondContact O-N 3.14Å; M1078-R1080 VanDerWaalsContact C-N 3.31Å; M1078-R1080 PolarHBondContact O-N 3.31Å; R1080-Q1083 PolarHBondContact O-N 2.94Å; R1080-I1084 HydrophobicContact CG-CD1 4.34Å; R1080-I1084 WeakPolarHBondContact O-CG1 3.1Å; R1080-I1084 PolarHBondContact O-N 2.77Å; R1080-I1084 VanDerWaalsContact O-N 3.1Å; R1080-D1098 PolarHBondContact NH2-O 3.44Å; R1080-Q1099 VanDerWaalsContact NH2-C 3.31Å; R1080-Q1099 PolarHBondContact NH2-O 3.48Å; R1080-P1100 VanDerWaalsContact CG-O 3.32Å; R1080-P1100 WeakPolarHBondContact CG-O 3.3Å; R1080-P1100 PolarHBondContact NE-O 3.31Å; R1080-P1100 VanDerWaalsContact NE-O 3.11Å; R1080-L1104 HydrophobicContact CB-CD2 3.95Å; R1080-L1104 HydrophobicContact CG-CD2 4.23Å; R1080-L1104 HydrophobicContact CG-CG 4.36Å
1081	I	88.4	Confident	83.8	Confident	24 Å²	24	28 Å²	28	12%	0.123	16%	0.163	C	C	.	.	H	α-helix	trans	-64.2	-44.4	176.1	-64.1	166.5	0	0	0	110.7	T1061 L1063 Q1077 M1078 Q1083 I1084 A1085 L1104 N1108	T1061-I1081 HydrophobicContact CG2-CG2 4.31Å; L1063-I1081 HydrophobicContact CD1-CG2 3.96Å; L1063-I1081 HydrophobicContact CD2-CG2 4.21Å; L1063-I1081 HydrophobicContact CG-CG2 3.94Å; Q1077-I1081 WeakPolarHBondContact O-CG1 3.23Å; Q1077-I1081 PolarHBondContact O-N 2.9Å; Q1077-I1081 VanDerWaalsContact O-N 3.09Å; M1078-I1081 PolarHBondContact O-N 2.75Å; I1081-Q1083 VanDerWaalsContact C-N 3.32Å; I1081-Q1083 PolarHBondContact O-N 3.32Å; I1081-I1084 PolarHBondContact O-N 3.2Å; I1081-A1085 WeakPolarHBondContact O-CB 3.13Å; I1081-A1085 PolarHBondContact O-N 3.06Å; I1081-L1104 HydrophobicContact CD1-CD2 4.42Å; I1081-L1104 HydrophobicContact CG1-CD2 4.1Å; I1081-N1108 HydrophobicContact CD1-CB 4.46Å
1082	L	90.1	Very high	83.5	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-41.5	175.3	178.6	61.3	0	0	0	112	L1028 V1034 H1037 L1038 L1063 A1071 L1074 M1078 K1079 I1084 A1085 V1086	L1028-L1082 HydrophobicContact CD1-CB 4.34Å; L1028-L1082 HydrophobicContact CD1-CD2 4.09Å; L1028-L1082 HydrophobicContact CD1-CG 4.31Å; L1028-L1082 HydrophobicContact CD2-CD2 4.01Å; L1028-L1082 HydrophobicContact CD2-CG 3.96Å; V1034-L1082 HydrophobicContact CB-CD1 4.39Å; V1034-L1082 HydrophobicContact CG1-CD1 4.05Å; V1034-L1082 HydrophobicContact CG2-CD1 4.28Å; V1034-L1082 HydrophobicContact CG2-CD2 4.19Å; H1037-L1082 HydrophobicContact CB-CD1 4.27Å; L1038-L1082 HydrophobicContact CD2-CD1 4.33Å; L1038-L1082 HydrophobicContact CG-CD1 4.36Å; L1063-L1082 HydrophobicContact CD1-CB 4.2Å; L1063-L1082 HydrophobicContact CD1-CD1 4.27Å; A1071-L1082 HydrophobicContact CB-CD2 3.87Å; L1074-L1082 HydrophobicContact CD1-CD2 3.81Å; M1078-L1082 WeakPolarHBondContact O-CB 3.45Å; M1078-L1082 PolarHBondContact O-N 3.26Å; K1079-L1082 PolarHBondContact O-N 3.34Å; L1082-I1084 VanDerWaalsContact C-N 3.32Å; L1082-I1084 PolarHBondContact O-N 3.09Å; L1082-A1085 WeakPolarHBondContact O-CB 3.4Å; L1082-A1085 PolarHBondContact O-N 3.38Å; L1082-V1086 HydrophobicContact CD1-CG2 4.34Å; L1082-V1086 WeakPolarHBondContact O-CB 3.29Å; L1082-V1086 VanDerWaalsContact O-CG2 3.32Å; L1082-V1086 WeakPolarHBondContact O-CG2 3.4Å; L1082-V1086 PolarHBondContact O-N 3.06Å
1083	Q	88.6	Confident	83.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-35.3	177.8	-169.7	-178.9	14.9	0	0	112.9	P1023 K1025 L1028 K1079 R1080 I1081 A1087	P1023-Q1083 PolarHBondContact O-NE2 3.03Å; K1025-Q1083 PolarHBondContact O-NE2 3.43Å; L1028-Q1083 HydrophobicContact CD1-CB 4.3Å; K1079-Q1083 WeakPolarHBondContact O-CB 3.15Å; K1079-Q1083 PolarHBondContact O-N 3.42Å; R1080-Q1083 PolarHBondContact O-N 2.94Å; I1081-Q1083 VanDerWaalsContact C-N 3.32Å; I1081-Q1083 PolarHBondContact O-N 3.32Å; Q1083-A1087 PolarHBondContact O-N 3.41Å
1084	I	88.7	Confident	83.6	Confident	3 Å²	3	29 Å²	29	2%	0.015	14%	0.144	C	C	.	.	H	α-helix	trans	-70.7	-45.2	174.3	-68.4	165.3	0	0	0	109.8	R1080 I1081 L1082 V1086 A1087 I1088 P1100 L1112	R1080-I1084 HydrophobicContact CG-CD1 4.34Å; R1080-I1084 WeakPolarHBondContact O-CG1 3.1Å; R1080-I1084 PolarHBondContact O-N 2.77Å; R1080-I1084 VanDerWaalsContact O-N 3.1Å; I1081-I1084 PolarHBondContact O-N 3.2Å; L1082-I1084 VanDerWaalsContact C-N 3.32Å; L1082-I1084 PolarHBondContact O-N 3.09Å; I1084-V1086 PolarHBondContact O-N 3.38Å; I1084-A1087 PolarHBondContact O-N 2.87Å; I1084-I1088 HydrophobicContact CG2-CD1 3.65Å; I1084-I1088 WeakPolarHBondContact O-CD1 3.31Å; I1084-I1088 WeakPolarHBondContact O-CG1 3.42Å; I1084-I1088 PolarHBondContact O-N 2.97Å; I1084-P1100 HydrophobicContact CD1-CB 3.83Å; I1084-P1100 HydrophobicContact CG1-CB 4.4Å; I1084-L1112 HydrophobicContact CD1-CD1 3.87Å; I1084-L1112 HydrophobicContact CD1-CD2 3.7Å; I1084-L1112 HydrophobicContact CD1-CG 4.45Å; I1084-L1112 HydrophobicContact CG2-CD1 3.96Å
1085	A	88.4	Confident	84	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-54.7	-51.5	174.8	0	0	0	0	0	111.3	L1038 I1057 T1061 I1081 L1082 A1087 I1088 V1089	L1038-A1085 HydrophobicContact CD2-CB 3.74Å; I1057-A1085 HydrophobicContact CG2-CB 3.82Å; T1061-A1085 HydrophobicContact CG2-CB 4.25Å; I1081-A1085 WeakPolarHBondContact O-CB 3.13Å; I1081-A1085 PolarHBondContact O-N 3.06Å; L1082-A1085 WeakPolarHBondContact O-CB 3.4Å; L1082-A1085 PolarHBondContact O-N 3.38Å; A1085-A1087 VanDerWaalsContact C-N 3.29Å; A1085-A1087 PolarHBondContact O-N 3.14Å; A1085-I1088 PolarHBondContact O-N 3.1Å; A1085-V1089 WeakPolarHBondContact O-CG2 3.48Å; A1085-V1089 PolarHBondContact O-N 2.97Å
1086	V	87.1	Confident	84.5	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-53.8	-41.2	176.4	162.4	0	0	0	0	112.8	Y719 L1028 H1037 L1038 Y1041 L1082 I1084 I1088	Y719-V1086 HydrophobicContact CE1-CG1 4.32Å; L1028-V1086 HydrophobicContact CD2-CG2 4.46Å; H1037-V1086 HydrophobicContact CB-CG2 4.18Å; L1038-V1086 HydrophobicContact CD2-CB 4.47Å; L1038-V1086 HydrophobicContact CD2-CG2 3.78Å; Y1041-V1086 HydrophobicContact CD1-CG1 3.96Å; Y1041-V1086 HydrophobicContact CD2-CB 4.31Å; Y1041-V1086 HydrophobicContact CD2-CG1 3.33Å; Y1041-V1086 HydrophobicContact CD2-CG2 3.99Å; Y1041-V1086 HydrophobicContact CE1-CG1 4.3Å; Y1041-V1086 HydrophobicContact CE2-CG1 3.72Å; Y1041-V1086 HydrophobicContact CG-CG1 3.48Å; Y1041-V1086 VanDerWaalsContact CG-CG1 3.48Å; L1082-V1086 HydrophobicContact CD1-CG2 4.34Å; L1082-V1086 WeakPolarHBondContact O-CB 3.29Å; L1082-V1086 VanDerWaalsContact O-CG2 3.32Å; L1082-V1086 WeakPolarHBondContact O-CG2 3.4Å; L1082-V1086 PolarHBondContact O-N 3.06Å; I1084-V1086 PolarHBondContact O-N 3.38Å; V1086-I1088 PolarHBondContact O-N 2.94Å
1087	A	84.3	Confident	85.1	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66	-27.5	178.1	0	0	0	0	0	112.6	A1020 C1022 R1045 Q1083 I1084 A1085	A1020-A1087 WeakPolarHBondContact CB-O 3.24Å; C1022-A1087 HydrophobicContact CB-CB 3.96Å; R1045-A1087 PolarHBondContact NH1-O 2.87Å; R1045-A1087 PolarHBondContact NH2-O 3.37Å; Q1083-A1087 PolarHBondContact O-N 3.41Å; I1084-A1087 PolarHBondContact O-N 2.87Å; A1085-A1087 VanDerWaalsContact C-N 3.29Å; A1085-A1087 PolarHBondContact O-N 3.14Å
1088	I	84.3	Confident	85.5	Confident	7 Å²	7	19.7 Å²	19.7	4%	0.036	9%	0.092	C	C	.	.	H	α-helix	trans	-104.6	-16.2	-165.5	-70.4	170.1	0	0	0	113.5	I1057 I1084 A1085 V1086 C1090 D1091 W1095 F1115	I1057-I1088 HydrophobicContact CD1-CG2 4.4Å; I1084-I1088 HydrophobicContact CG2-CD1 3.65Å; I1084-I1088 WeakPolarHBondContact O-CD1 3.31Å; I1084-I1088 WeakPolarHBondContact O-CG1 3.42Å; I1084-I1088 PolarHBondContact O-N 2.97Å; A1085-I1088 PolarHBondContact O-N 3.1Å; V1086-I1088 PolarHBondContact O-N 2.94Å; I1088-C1090 PolarHBondContact O-N 2.71Å; I1088-D1091 PolarHBondContact O-N 3.23Å; I1088-D1091 VanDerWaalsContact O-N 3.12Å; I1088-W1095 HydrophobicContact CB-CH2 4.34Å; I1088-W1095 HydrophobicContact CB-CZ2 4.36Å; I1088-W1095 HydrophobicContact CD1-CD2 4.33Å; I1088-W1095 HydrophobicContact CD1-CE3 3.72Å; I1088-W1095 HydrophobicContact CD1-CH2 4.03Å; I1088-W1095 HydrophobicContact CD1-CZ3 3.56Å; I1088-W1095 HydrophobicContact CG1-CD2 4.06Å; I1088-W1095 HydrophobicContact CG1-CE3 3.96Å; I1088-W1095 HydrophobicContact CG1-CH2 4.07Å; I1088-W1095 HydrophobicContact CG1-CZ2 4.17Å; I1088-W1095 HydrophobicContact CG1-CZ3 3.98Å; I1088-W1095 HydrophobicContact CG2-CH2 3.4Å; I1088-W1095 HydrophobicContact CG2-CZ2 3.54Å; I1088-W1095 HydrophobicContact CG2-CZ3 4.09Å; I1088-F1115 HydrophobicContact CD1-CE1 3.73Å; I1088-F1115 HydrophobicContact CD1-CZ 4.46Å; I1088-F1115 HydrophobicContact CG2-CE1 4.32Å; I1088-F1115 HydrophobicContact CG2-CZ 4.03Å
1089	V	82.3	Confident	85.5	Confident	6 Å²	6	18 Å²	18	4%	0.036	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.9	-29.9	-179.1	-175.5	0	0	0	0	115.2	L1038 Q1042 A1085	L1038-V1089 HydrophobicContact CB-CG2 4.16Å; L1038-V1089 HydrophobicContact CD2-CG2 3.42Å; L1038-V1089 VanDerWaalsContact CD2-CG2 3.42Å; L1038-V1089 HydrophobicContact CG-CG2 4.36Å; Q1042-V1089 HydrophobicContact CB-CG1 3.68Å; Q1042-V1089 HydrophobicContact CG-CG1 3.84Å; A1085-V1089 WeakPolarHBondContact O-CG2 3.48Å; A1085-V1089 PolarHBondContact O-N 2.97Å
1090	C	72.6	Confident	85.5	Confident	19 Å²	19	16 Å²	16	13%	0.128	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	24	-171.5	-92.5	0	0	0	0	115.1	R1045 C1047 I1088 A1092	R1045-C1090 HydrophobicContact CB-CB 3.93Å; R1045-C1090 VanDerWaalsContact CB-SG 3.55Å; C1047-C1090 HydrophobicContact CB-CB 4.42Å; C1047-C1090 WeakPolarHBondContact CB-SG 3.46Å; C1047-C1090 WeakPolarHBondContact SG-CA 3.34Å; C1047-C1090 WeakPolarHBondContact SG-CB 3.4Å; C1047-C1090 CovalentContact SG-SG 2.03Å; C1047-C1090 PolarHBondContact SG-SG 3.31Å; I1088-C1090 PolarHBondContact O-N 2.71Å; C1090-A1092 VanDerWaalsContact C-N 3.35Å; C1090-A1092 PolarHBondContact O-N 3.5Å; C1090-A1092 VanDerWaalsContact O-N 3.1Å
1091	D	75.4	Confident	85.3	Confident	99 Å²	99	16.1 Å²	16.1	53%	0.529	8%	0.076	S	C	.	.			trans	43.6	51.1	164.3	-154.1	-1.9	0	0	0	116	I1088 R1123	I1088-D1091 PolarHBondContact O-N 3.23Å; I1088-D1091 VanDerWaalsContact O-N 3.12Å; D1091-R1123 IonicContact OD1-CZ 3.84Å; D1091-R1123 IonicContact OD1-NE 2.92Å; D1091-R1123 PolarHBondContact OD1-NE 3.03Å; D1091-R1123 IonicContact OD1-NH2 3.17Å; D1091-R1123 PolarHBondContact OD1-NH2 2.94Å; D1091-R1123 IonicContact OD2-CZ 3.46Å; D1091-R1123 IonicContact OD2-NH2 3.94Å; D1091-R1123 PolarHBondContact OD2-NH2 3.34Å
1092	A	79.7	Confident	84.6	Confident	2 Å²	2	17 Å²	17	2%	0.017	8%	0.079	C	C	.	.			trans	-70.8	149.4	179.5	0	0	0	0	0	111.5	A1020 C1090 V1094 W1095	A1020-A1092 HydrophobicContact CB-CB 3.7Å; C1090-A1092 VanDerWaalsContact C-N 3.35Å; C1090-A1092 PolarHBondContact O-N 3.5Å; C1090-A1092 VanDerWaalsContact O-N 3.1Å; A1092-V1094 VanDerWaalsContact C-N 3.32Å; A1092-V1094 PolarHBondContact O-N 3.46Å; A1092-W1095 PolarHBondContact O-NE1 3.37Å
1093	R	81.1	Confident	83.6	Confident	152 Å²	152	19.1 Å²	19.1	57%	0.574	10%	0.101	S	C	*	.	S	Bend	trans	-63.9	-33.9	178.8	-66.6	-175.3	-178.4	177.2	-0.8	113.2	D1018 R1123 T1124	D1018-R1093 PolarHBondContact O-N 3.38Å; R1093-R1123 CarbonylContact O-C 3.58Å; R1093-R1123 WeakPolarHBondContact O-CA 3.44Å; R1093-T1124 PolarHBondContact O-N 2.63Å
1094	V	86.6	Confident	83.1	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.012	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.6	-178.8	-176.8	0	0	0	0	110.2	L941 D1018 I1019 A1020 A1092 L1096 T1124 I1126	L941-V1094 HydrophobicContact CD1-CG1 4.15Å; D1018-V1094 PolarHBondContact O-N 3.01Å; I1019-V1094 CarbonylContact C-O 3.42Å; I1019-V1094 WeakPolarHBondContact CA-O 3.38Å; I1019-V1094 HydrophobicContact CG1-CB 3.7Å; I1019-V1094 HydrophobicContact CG1-CG1 4.04Å; I1019-V1094 HydrophobicContact CG1-CG2 4.34Å; A1020-V1094 PolarHBondContact N-O 3.47Å; A1092-V1094 VanDerWaalsContact C-N 3.32Å; A1092-V1094 PolarHBondContact O-N 3.46Å; V1094-L1096 HydrophobicContact CG1-CD2 4.1Å; V1094-L1096 HydrophobicContact CG1-CG 4.49Å; V1094-T1124 CarbonylContact C-O 3.56Å; V1094-T1124 WeakPolarHBondContact CA-O 3.41Å; V1094-I1126 HydrophobicContact CG1-CD1 4.35Å
1095	W	90.5	Very high	82.4	Confident	1 Å²	1	23.5 Å²	23.5	0%	0.004	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.3	178.8	-68.2	10.4	0	0	0	110.6	A1020 I1088 A1092 F1115 L1116 H1119 R1123 T1124 I1125 I1126	A1020-W1095 HydrophobicContact CB-CG 4.31Å; I1088-W1095 HydrophobicContact CB-CH2 4.34Å; I1088-W1095 HydrophobicContact CB-CZ2 4.36Å; I1088-W1095 HydrophobicContact CD1-CD2 4.33Å; I1088-W1095 HydrophobicContact CD1-CE3 3.72Å; I1088-W1095 HydrophobicContact CD1-CH2 4.03Å; I1088-W1095 HydrophobicContact CD1-CZ3 3.56Å; I1088-W1095 HydrophobicContact CG1-CD2 4.06Å; I1088-W1095 HydrophobicContact CG1-CE3 3.96Å; I1088-W1095 HydrophobicContact CG1-CH2 4.07Å; I1088-W1095 HydrophobicContact CG1-CZ2 4.17Å; I1088-W1095 HydrophobicContact CG1-CZ3 3.98Å; I1088-W1095 HydrophobicContact CG2-CH2 3.4Å; I1088-W1095 HydrophobicContact CG2-CZ2 3.54Å; I1088-W1095 HydrophobicContact CG2-CZ3 4.09Å; A1092-W1095 PolarHBondContact O-NE1 3.37Å; W1095-F1115 HydrophobicContact CZ3-CE1 4.47Å; W1095-L1116 HydrophobicContact CE3-CD2 4.31Å; W1095-L1116 HydrophobicContact CZ3-CD2 4.28Å; W1095-H1119 HydrophobicContact CH2-CB 3.44Å; W1095-H1119 VanDerWaalsContact CH2-CB 3.44Å; W1095-H1119 AromaticContact CH2-CG 3.89Å; W1095-H1119 HydrophobicContact CZ2-CB 4.41Å; W1095-H1119 HydrophobicContact CZ3-CB 3.78Å; W1095-R1123 VanDerWaalsContact CE2-CD 3.49Å; W1095-T1124 PolarHBondContact N-O 3.26Å; W1095-I1125 HydrophobicContact CB-CG1 4.3Å; W1095-I1125 HydrophobicContact CB-CG2 4.33Å; W1095-I1125 HydrophobicContact CD2-CG1 4.43Å; W1095-I1125 HydrophobicContact CE3-CD1 3.83Å; W1095-I1125 HydrophobicContact CE3-CG1 4.16Å; W1095-I1125 HydrophobicContact CZ3-CD1 4.15Å; W1095-I1126 PolarHBondContact O-N 3.42Å
1096	L	89.9	Confident	81.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	100.9	179.7	-60.8	-175.3	0	0	0	110.3	M988 L991 I1019 A1020 Y1021 C1022 V1094 I1126	M988-L1096 VanDerWaalsContact CE-C 3.48Å; M988-L1096 HydrophobicContact CE-CB 3.74Å; M988-L1096 HydrophobicContact CE-CD2 4.3Å; M988-L1096 HydrophobicContact SD-CD2 4.49Å; L991-L1096 HydrophobicContact CB-CD1 3.86Å; L991-L1096 HydrophobicContact CB-CD2 4.26Å; L991-L1096 HydrophobicContact CD1-CD2 4.35Å; I1019-L1096 HydrophobicContact CG2-CD1 3.58Å; I1019-L1096 HydrophobicContact CG2-CG 3.97Å; A1020-L1096 PolarHBondContact O-N 2.92Å; Y1021-L1096 WeakPolarHBondContact CA-O 3.35Å; Y1021-L1096 HydrophobicContact CD2-CB 3.88Å; Y1021-L1096 HydrophobicContact CD2-CD1 4.49Å; C1022-L1096 PolarHBondContact N-O 3.12Å; V1094-L1096 HydrophobicContact CG1-CD2 4.1Å; V1094-L1096 HydrophobicContact CG1-CG 4.49Å; L1096-I1126 HydrophobicContact CD2-CB 3.88Å; L1096-I1126 HydrophobicContact CD2-CD1 3.72Å; L1096-I1126 HydrophobicContact CD2-CG1 4.1Å; L1096-I1126 HydrophobicContact CD2-CG2 4.47Å
1097	L	91.3	Very high	81.3	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	105.6	-175.8	-57.1	-179.2	0	0	0	111.7	M988 C1022 Q1099 P1100 L1116 I1125 I1126 V1127 T1128	M988-L1097 VanDerWaalsContact CE-N 3.29Å; C1022-L1097 HydrophobicContact CB-CD2 3.51Å; L1097-Q1099 PolarHBondContact O-N 3.26Å; L1097-P1100 HydrophobicContact CB-CB 4.11Å; L1097-P1100 HydrophobicContact CB-CG 3.9Å; L1097-P1100 HydrophobicContact CD1-CG 4.43Å; L1097-L1116 HydrophobicContact CD1-CD1 4.11Å; L1097-L1116 HydrophobicContact CD1-CD2 3.46Å; L1097-L1116 VanDerWaalsContact CD1-CD2 3.46Å; L1097-L1116 HydrophobicContact CD1-CG 4.45Å; L1097-I1125 HydrophobicContact CD1-CG2 4.43Å; L1097-I1126 PolarHBondContact N-O 3.34Å; L1097-V1127 HydrophobicContact CB-CG2 4.42Å; L1097-V1127 HydrophobicContact CD1-CG2 4.4Å; L1097-V1127 WeakPolarHBondContact O-CA 3.28Å; L1097-T1128 PolarHBondContact O-N 2.97Å
1098	D	88.8	Confident	81.1	Confident	1 Å²	1	35 Å²	35	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	99.6	-179.1	-164.7	24	0	0	0	111.1	S985 C1022 R1080 T1128	S985-D1098 WeakPolarHBondContact CB-OD2 3.43Å; S985-D1098 PolarHBondContact OG-OD1 2.96Å; S985-D1098 PolarHBondContact OG-OD2 3.03Å; S985-D1098 VanDerWaalsContact OG-OD2 3.05Å; C1022-D1098 WeakPolarHBondContact O-CB 3.14Å; C1022-D1098 PolarHBondContact O-N 3.09Å; R1080-D1098 PolarHBondContact NH2-O 3.44Å; D1098-T1128 VanDerWaalsContact CA-OG1 3.3Å; D1098-T1128 WeakPolarHBondContact CA-OG1 3.35Å; D1098-T1128 PolarHBondContact OD1-OG1 3.41Å
1099	Q	85.2	Confident	81	Confident	14 Å²	14	38.7 Å²	38.7	7%	0.065	20%	0.199	C	C	.	.	S	Bend	trans	54	53.3	-178.8	-51.6	-171.4	19	0	0	114.8	R1080 L1097 T1101 K1102 T1128	R1080-Q1099 VanDerWaalsContact NH2-C 3.31Å; R1080-Q1099 PolarHBondContact NH2-O 3.48Å; L1097-Q1099 PolarHBondContact O-N 3.26Å; Q1099-T1101 VanDerWaalsContact C-N 3.34Å; Q1099-T1101 PolarHBondContact O-N 2.64Å; Q1099-K1102 HydrophobicContact CB-CB 4.3Å; Q1099-K1102 HydrophobicContact CB-CD 4.4Å; Q1099-K1102 WeakPolarHBondContact O-CB 3.48Å; Q1099-K1102 PolarHBondContact O-N 3.05Å; Q1099-T1128 VanDerWaalsContact CA-O 3.27Å; Q1099-T1128 WeakPolarHBondContact CA-O 3.26Å; Q1099-T1128 WeakPolarHBondContact CG-OG1 3.21Å; Q1099-T1128 PolarHBondContact N-O 3.44Å; Q1099-T1128 PolarHBondContact N-OG1 2.95Å
1100	P	85.2	Confident	81.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-34.2	-164.3	28.4	-37.2	0	0	0	113.8	R1080 I1084 L1097 K1102 L1112 V1127	R1080-P1100 VanDerWaalsContact CG-O 3.32Å; R1080-P1100 WeakPolarHBondContact CG-O 3.3Å; R1080-P1100 PolarHBondContact NE-O 3.31Å; R1080-P1100 VanDerWaalsContact NE-O 3.11Å; I1084-P1100 HydrophobicContact CD1-CB 3.83Å; I1084-P1100 HydrophobicContact CG1-CB 4.4Å; L1097-P1100 HydrophobicContact CB-CB 4.11Å; L1097-P1100 HydrophobicContact CB-CG 3.9Å; L1097-P1100 HydrophobicContact CD1-CG 4.43Å; P1100-K1102 PolarHBondContact O-N 3.45Å; P1100-L1112 HydrophobicContact CB-CD2 4.1Å; P1100-V1127 HydrophobicContact CG-CG1 3.73Å
1101	T	83.7	Confident	81.6	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.037	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-5.2	177.7	58.4	0	0	0	0	115.6	Q1099 G1103 L1104 R1109 L1112 W1113 E1134	Q1099-T1101 VanDerWaalsContact C-N 3.34Å; Q1099-T1101 PolarHBondContact O-N 2.64Å; T1101-G1103 PolarHBondContact O-N 3.25Å; T1101-L1104 WeakPolarHBondContact O-CB 3.45Å; T1101-L1104 PolarHBondContact O-N 2.9Å; T1101-R1109 HydrophobicContact CG2-CB 4.17Å; T1101-R1109 HydrophobicContact CG2-CG 3.92Å; T1101-L1112 HydrophobicContact CG2-CD2 3.92Å; T1101-W1113 VanDerWaalsContact CG2-NE1 3.27Å; T1101-E1134 VanDerWaalsContact CB-OE1 3.28Å; T1101-E1134 WeakPolarHBondContact CB-OE1 3.49Å; T1101-E1134 HydrophobicContact CG2-CG 4.41Å; T1101-E1134 WeakPolarHBondContact CG2-OE1 3.44Å; T1101-E1134 PolarHBondContact OG1-OE1 2.85Å; T1101-E1134 PolarHBondContact OG1-OE2 2.84Å
1102	K	73.5	Confident	82.1	Confident	44 Å²	44	45.4 Å²	45.4	19%	0.191	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	125.8	-176.9	-163.9	170.8	-151	155.4	0	111.3	E980 E1024 Q1099 P1100 L1104	E980-K1102 IonicContact OE1-NZ 2.85Å; E1024-K1102 HydrophobicContact CG-CD 4.07Å; E1024-K1102 WeakPolarHBondContact OE1-CE 3.31Å; E1024-K1102 IonicContact OE1-NZ 2.81Å; E1024-K1102 PolarHBondContact OE1-NZ 3.48Å; Q1099-K1102 HydrophobicContact CB-CB 4.3Å; Q1099-K1102 HydrophobicContact CB-CD 4.4Å; Q1099-K1102 WeakPolarHBondContact O-CB 3.48Å; Q1099-K1102 PolarHBondContact O-N 3.05Å; P1100-K1102 PolarHBondContact O-N 3.45Å; K1102-L1104 VanDerWaalsContact C-N 3.28Å; K1102-L1104 PolarHBondContact O-N 3.28Å
1103	G	67.8	Low	82.6	Confident	44 Å²	44	47.2 Å²	47.2	45%	0.454	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-8	-176.9	0	0	0	0	0	115.9	Q1077 T1101	Q1077-G1103 WeakPolarHBondContact CG-O 3.44Å; Q1077-G1103 PolarHBondContact NE2-O 3.34Å; T1101-G1103 PolarHBondContact O-N 3.25Å
1104	L	79	Confident	82.9	Confident	4 Å²	4	44 Å²	44	2%	0.021	22%	0.22	C	C	.	.			trans	-76.2	140.2	176.7	-62.7	-172.8	0	0	0	112.4	Q1077 R1080 I1081 T1101 K1102 N1108 R1109 L1112	Q1077-L1104 HydrophobicContact CB-CD2 4.09Å; Q1077-L1104 HydrophobicContact CG-CD2 4.35Å; Q1077-L1104 WeakPolarHBondContact O-CD2 3.37Å; R1080-L1104 HydrophobicContact CB-CD2 3.95Å; R1080-L1104 HydrophobicContact CG-CD2 4.23Å; R1080-L1104 HydrophobicContact CG-CG 4.36Å; I1081-L1104 HydrophobicContact CD1-CD2 4.42Å; I1081-L1104 HydrophobicContact CG1-CD2 4.1Å; T1101-L1104 WeakPolarHBondContact O-CB 3.45Å; T1101-L1104 PolarHBondContact O-N 2.9Å; K1102-L1104 VanDerWaalsContact C-N 3.28Å; K1102-L1104 PolarHBondContact O-N 3.28Å; L1104-N1108 HydrophobicContact CB-CB 4.14Å; L1104-N1108 HydrophobicContact CD1-CB 4.48Å; L1104-N1108 HydrophobicContact CD2-CB 4.28Å; L1104-R1109 HydrophobicContact CB-CG 3.71Å; L1104-R1109 PolarHBondContact O-NE 2.94Å; L1104-R1109 PolarHBondContact O-NH2 3.25Å; L1104-L1112 HydrophobicContact CD1-CB 4.35Å; L1104-L1112 HydrophobicContact CD1-CD2 3.71Å
1105	K	72.7	Confident	82.9	Confident	90 Å²	90	44.1 Å²	44.1	39%	0.391	22%	0.221	S	C	.	.			trans	-60.2	152.7	165.9	-79.4	170	-172.8	177.6	0	110.7	Q1077 I1107 N1108 R1109	Q1077-K1105 VanDerWaalsContact OE1-CD 3.23Å; Q1077-K1105 VanDerWaalsContact OE1-CE 3.23Å; K1105-I1107 HydrophobicContact CB-CG2 4.26Å; K1105-I1107 PolarHBondContact O-N 3.36Å; K1105-I1107 VanDerWaalsContact O-N 3.13Å; K1105-N1108 PolarHBondContact O-N 3.34Å; K1105-R1109 WeakPolarHBondContact O-CG 3.49Å; K1105-R1109 PolarHBondContact O-N 3.29Å
1106	P	76.1	Confident	82.8	Confident	99 Å²	99	44.1 Å²	44.1	64%	0.643	22%	0.221	S	C	*	.	H	α-helix	trans	-50.4	-39.3	177.1	-28.8	35.7	0	0	0	114.4	R1109 R1110	P1106-R1109 PolarHBondContact O-N 2.99Å; P1106-R1110 PolarHBondContact O-N 3.41Å
1107	I	77.6	Confident	82.8	Confident	113 Å²	113	47.2 Å²	47.2	58%	0.579	24%	0.237	S	C	*	.	H	α-helix	trans	-67	-43.4	177	-162.6	165.6	0	0	0	112.4	K1105 R1109 R1110 I1111	K1105-I1107 HydrophobicContact CB-CG2 4.26Å; K1105-I1107 PolarHBondContact O-N 3.36Å; K1105-I1107 VanDerWaalsContact O-N 3.13Å; I1107-R1109 VanDerWaalsContact C-N 3.31Å; I1107-R1109 PolarHBondContact O-N 2.99Å; I1107-R1110 PolarHBondContact O-N 2.89Å; I1107-I1111 WeakPolarHBondContact O-CG1 3.31Å; I1107-I1111 PolarHBondContact O-N 2.89Å
1108	N	79.1	Confident	82.6	Confident	32 Å²	32	55.5 Å²	55.5	17%	0.171	27%	0.268	C	S	.	.	H	α-helix	trans	-68.5	-30	175.7	-64.2	22.8	0	0	0	112.1	I1081 L1104 K1105 L1112	I1081-N1108 HydrophobicContact CD1-CB 4.46Å; L1104-N1108 HydrophobicContact CB-CB 4.14Å; L1104-N1108 HydrophobicContact CD1-CB 4.48Å; L1104-N1108 HydrophobicContact CD2-CB 4.28Å; K1105-N1108 PolarHBondContact O-N 3.34Å; N1108-L1112 WeakPolarHBondContact O-CB 3.48Å; N1108-L1112 PolarHBondContact O-N 3.35Å
1109	R	83.1	Confident	82.4	Confident	84 Å²	84	57.1 Å²	57.1	32%	0.317	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-48.4	170.6	-64.9	-175.2	-164.1	-171.9	3	110.7	T1101 L1104 K1105 P1106 I1107 I1111 L1112 W1113	T1101-R1109 HydrophobicContact CG2-CB 4.17Å; T1101-R1109 HydrophobicContact CG2-CG 3.92Å; L1104-R1109 HydrophobicContact CB-CG 3.71Å; L1104-R1109 PolarHBondContact O-NE 2.94Å; L1104-R1109 PolarHBondContact O-NH2 3.25Å; K1105-R1109 WeakPolarHBondContact O-CG 3.49Å; K1105-R1109 PolarHBondContact O-N 3.29Å; P1106-R1109 PolarHBondContact O-N 2.99Å; I1107-R1109 VanDerWaalsContact C-N 3.31Å; I1107-R1109 PolarHBondContact O-N 2.99Å; R1109-I1111 VanDerWaalsContact C-N 3.33Å; R1109-I1111 PolarHBondContact O-N 2.91Å; R1109-L1112 CarbonylContact O-C 3.51Å; R1109-L1112 WeakPolarHBondContact O-CB 3.22Å; R1109-L1112 PolarHBondContact O-N 2.81Å; R1109-L1112 VanDerWaalsContact O-N 3.13Å; R1109-W1113 HydrophobicContact CB-CZ2 4.25Å; R1109-W1113 PolarHBondContact O-N 3.5Å
1110	R	84.4	Confident	82.5	Confident	170 Å²	170	60.3 Å²	60.3	64%	0.642	29%	0.287	S	S	*	.	H	α-helix	trans	-58.4	-42.3	176	-71.6	178.9	177.8	179.1	-1.8	112.5	P1106 I1107 L1112 W1113 N1114	P1106-R1110 PolarHBondContact O-N 3.41Å; I1107-R1110 PolarHBondContact O-N 2.89Å; R1110-L1112 VanDerWaalsContact C-N 3.34Å; R1110-L1112 PolarHBondContact O-N 3.18Å; R1110-W1113 HydrophobicContact CG-CE3 4.37Å; R1110-W1113 PolarHBondContact O-N 3.45Å; R1110-N1114 WeakPolarHBondContact O-CB 3.24Å; R1110-N1114 PolarHBondContact O-N 2.87Å; R1110-N1114 PolarHBondContact O-OD1 3.14Å
1111	I	82.7	Confident	82.4	Confident	82 Å²	82	66 Å²	66	42%	0.421	32%	0.317	S	S	.	.	H	α-helix	trans	-58	-48.1	174.4	-66.9	166.6	0	0	0	110.4	I1107 R1109 N1114 F1115	I1107-I1111 WeakPolarHBondContact O-CG1 3.31Å; I1107-I1111 PolarHBondContact O-N 2.89Å; R1109-I1111 VanDerWaalsContact C-N 3.33Å; R1109-I1111 PolarHBondContact O-N 2.91Å; I1111-N1114 PolarHBondContact O-N 3.29Å; I1111-F1115 WeakPolarHBondContact O-CB 3.5Å; I1111-F1115 PolarHBondContact O-N 2.76Å
1112	L	86.9	Confident	82.2	Confident	13 Å²	13	68.6 Å²	68.6	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-64.5	-40.1	176.9	175.4	62.9	0	0	0	113	I1084 P1100 T1101 L1104 N1108 R1109 R1110 F1115 L1116	I1084-L1112 HydrophobicContact CD1-CD1 3.87Å; I1084-L1112 HydrophobicContact CD1-CD2 3.7Å; I1084-L1112 HydrophobicContact CD1-CG 4.45Å; I1084-L1112 HydrophobicContact CG2-CD1 3.96Å; P1100-L1112 HydrophobicContact CB-CD2 4.1Å; T1101-L1112 HydrophobicContact CG2-CD2 3.92Å; L1104-L1112 HydrophobicContact CD1-CB 4.35Å; L1104-L1112 HydrophobicContact CD1-CD2 3.71Å; N1108-L1112 WeakPolarHBondContact O-CB 3.48Å; N1108-L1112 PolarHBondContact O-N 3.35Å; R1109-L1112 CarbonylContact O-C 3.51Å; R1109-L1112 WeakPolarHBondContact O-CB 3.22Å; R1109-L1112 PolarHBondContact O-N 2.81Å; R1109-L1112 VanDerWaalsContact O-N 3.13Å; R1110-L1112 VanDerWaalsContact C-N 3.34Å; R1110-L1112 PolarHBondContact O-N 3.18Å; L1112-F1115 HydrophobicContact CD1-CD1 4.42Å; L1112-F1115 WeakPolarHBondContact O-CB 3.38Å; L1112-F1115 PolarHBondContact O-N 3.49Å; L1112-L1116 HydrophobicContact CD1-CD1 4.44Å; L1112-L1116 HydrophobicContact CD1-CG 4.2Å; L1112-L1116 HydrophobicContact CG-CD1 4.41Å; L1112-L1116 WeakPolarHBondContact O-CG 3.5Å; L1112-L1116 PolarHBondContact O-N 3.1Å
1113	W	88.4	Confident	82.8	Confident	40 Å²	40	68.3 Å²	68.3	15%	0.152	34%	0.343	C	S	.	.	H	α-helix	trans	-62.6	-48.5	177.5	-62	-10.1	0	0	0	110.8	T1101 R1109 R1110 F1115 L1116 I1117 E1134 T1137 I1138	T1101-W1113 VanDerWaalsContact CG2-NE1 3.27Å; R1109-W1113 HydrophobicContact CB-CZ2 4.25Å; R1109-W1113 PolarHBondContact O-N 3.5Å; R1110-W1113 HydrophobicContact CG-CE3 4.37Å; R1110-W1113 PolarHBondContact O-N 3.45Å; W1113-F1115 PolarHBondContact O-N 2.94Å; W1113-L1116 PolarHBondContact O-N 3.26Å; W1113-I1117 WeakPolarHBondContact O-CB 3.2Å; W1113-I1117 WeakPolarHBondContact O-CD1 3.47Å; W1113-I1117 VanDerWaalsContact O-CG1 3.27Å; W1113-I1117 WeakPolarHBondContact O-CG1 3.49Å; W1113-I1117 PolarHBondContact O-N 3.07Å; W1113-E1134 HydrophobicContact CZ2-CB 4.39Å; W1113-E1134 HydrophobicContact CZ2-CG 4.27Å; W1113-T1137 HydrophobicContact CE3-CG2 3.69Å; W1113-T1137 HydrophobicContact CH2-CG2 4.46Å; W1113-T1137 HydrophobicContact CZ3-CG2 3.66Å; W1113-I1138 HydrophobicContact CB-CG1 4.32Å; W1113-I1138 HydrophobicContact CD2-CD1 4.36Å; W1113-I1138 HydrophobicContact CD2-CG1 4.18Å; W1113-I1138 HydrophobicContact CG-CD1 3.88Å; W1113-I1138 HydrophobicContact CG-CG1 3.87Å
1114	N	87.8	Confident	83.8	Confident	83 Å²	83	66.2 Å²	66.2	44%	0.444	32%	0.321	S	S	.	.	H	α-helix	trans	-59.1	-37.6	175.3	-67.5	-5.6	0	0	0	111.7	R1110 I1111 R1118	R1110-N1114 WeakPolarHBondContact O-CB 3.24Å; R1110-N1114 PolarHBondContact O-N 2.87Å; R1110-N1114 PolarHBondContact O-OD1 3.14Å; I1111-N1114 PolarHBondContact O-N 3.29Å; N1114-R1118 WeakPolarHBondContact O-CB 3.27Å; N1114-R1118 WeakPolarHBondContact O-CD 3.28Å; N1114-R1118 WeakPolarHBondContact O-CG 3.38Å; N1114-R1118 PolarHBondContact O-N 3.32Å; N1114-R1118 VanDerWaalsContact O-N 3.1Å
1115	F	87.4	Confident	84.4	Confident	6 Å²	6	66 Å²	66	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-65.2	-49.5	175.3	178.6	-97.4	0	0	0	112	E1060 T1061 I1088 W1095 I1111 L1112 W1113 I1117 R1118 H1119	E1060-F1115 HydrophobicContact CB-CD2 4.05Å; E1060-F1115 HydrophobicContact CB-CE2 4Å; T1061-F1115 HydrophobicContact CG2-CE2 4.3Å; T1061-F1115 HydrophobicContact CG2-CZ 4.41Å; I1088-F1115 HydrophobicContact CD1-CE1 3.73Å; I1088-F1115 HydrophobicContact CD1-CZ 4.46Å; I1088-F1115 HydrophobicContact CG2-CE1 4.32Å; I1088-F1115 HydrophobicContact CG2-CZ 4.03Å; W1095-F1115 HydrophobicContact CZ3-CE1 4.47Å; I1111-F1115 WeakPolarHBondContact O-CB 3.5Å; I1111-F1115 PolarHBondContact O-N 2.76Å; L1112-F1115 HydrophobicContact CD1-CD1 4.42Å; L1112-F1115 WeakPolarHBondContact O-CB 3.38Å; L1112-F1115 PolarHBondContact O-N 3.49Å; W1113-F1115 PolarHBondContact O-N 2.94Å; F1115-I1117 PolarHBondContact O-N 3.21Å; F1115-R1118 PolarHBondContact O-N 2.89Å; F1115-H1119 AromaticContact CD2-CD2 3.66Å; F1115-H1119 AromaticContact CD2-NE2 3.68Å; F1115-H1119 AromaticContact CE2-CD2 3.44Å; F1115-H1119 VanDerWaalsContact CE2-CD2 3.44Å; F1115-H1119 WeakPolarHBondContact CE2-CD2 3.24Å; F1115-H1119 AromaticContact CE2-NE2 3.24Å; F1115-H1119 WeakPolarHBondContact CE2-NE2 3.43Å; F1115-H1119 AromaticContact CZ-CD2 3.67Å; F1115-H1119 AromaticContact CZ-NE2 3.8Å; F1115-H1119 PolarHBondContact O-CD2 3.43Å; F1115-H1119 PolarHBondContact O-N 3.5Å; F1115-H1119 VanDerWaalsContact O-N 3.16Å
1116	L	88.8	Confident	85.3	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-42.5	177.7	-65.4	177.7	0	0	0	112.5	I973 W1095 L1097 L1112 W1113 R1118 H1119 R1120 V1127 I1138	I973-L1116 HydrophobicContact CD1-CB 4.24Å; W1095-L1116 HydrophobicContact CE3-CD2 4.31Å; W1095-L1116 HydrophobicContact CZ3-CD2 4.28Å; L1097-L1116 HydrophobicContact CD1-CD1 4.11Å; L1097-L1116 HydrophobicContact CD1-CD2 3.46Å; L1097-L1116 VanDerWaalsContact CD1-CD2 3.46Å; L1097-L1116 HydrophobicContact CD1-CG 4.45Å; L1112-L1116 HydrophobicContact CD1-CD1 4.44Å; L1112-L1116 HydrophobicContact CD1-CG 4.2Å; L1112-L1116 HydrophobicContact CG-CD1 4.41Å; L1112-L1116 WeakPolarHBondContact O-CG 3.5Å; L1112-L1116 PolarHBondContact O-N 3.1Å; W1113-L1116 PolarHBondContact O-N 3.26Å; L1116-R1118 PolarHBondContact O-N 3.37Å; L1116-H1119 PolarHBondContact O-N 2.94Å; L1116-R1120 PolarHBondContact O-N 3.44Å; L1116-V1127 HydrophobicContact CD1-CG2 4.47Å; L1116-I1138 HydrophobicContact CB-CG2 4.46Å
1117	I	88.9	Confident	86.1	Confident	65 Å²	65	57 Å²	57	33%	0.333	27%	0.271	S	S	.	.	H	α-helix	trans	-63.7	-40.2	178.8	-66.8	164.6	0	0	0	111.1	I973 W1113 F1115 H1119 R1120 I1138	I973-I1117 HydrophobicContact CD1-CG1 4.23Å; W1113-I1117 WeakPolarHBondContact O-CB 3.2Å; W1113-I1117 WeakPolarHBondContact O-CD1 3.47Å; W1113-I1117 VanDerWaalsContact O-CG1 3.27Å; W1113-I1117 WeakPolarHBondContact O-CG1 3.49Å; W1113-I1117 PolarHBondContact O-N 3.07Å; F1115-I1117 PolarHBondContact O-N 3.21Å; I1117-H1119 PolarHBondContact O-N 3.04Å; I1117-R1120 WeakPolarHBondContact O-CG 3.46Å; I1117-I1138 HydrophobicContact CG1-CG2 4.22Å
1118	R	87.2	Confident	86.8	Confident	174 Å²	174	51.7 Å²	51.7	66%	0.657	24%	0.244	S	C	*	.	H	α-helix	trans	-64.5	-36.4	176	-75	167.7	-174	171.2	-0.2	113.1	N1114 F1115 L1116	N1114-R1118 WeakPolarHBondContact O-CB 3.27Å; N1114-R1118 WeakPolarHBondContact O-CD 3.28Å; N1114-R1118 WeakPolarHBondContact O-CG 3.38Å; N1114-R1118 PolarHBondContact O-N 3.32Å; N1114-R1118 VanDerWaalsContact O-N 3.1Å; F1115-R1118 PolarHBondContact O-N 2.89Å; L1116-R1118 PolarHBondContact O-N 3.37Å
1119	H	85.4	Confident	87.2	Confident	35 Å²	35	50.2 Å²	50.2	16%	0.162	24%	0.236	C	C	.	.	H	α-helix	trans	-92.6	4.6	-176.8	-68.9	-72	0	0	0	114.9	E1060 W1095 F1115 L1116 I1117 N1121 R1123	E1060-H1119 IonicContact OE2-CE1 3.26Å; E1060-H1119 IonicContact OE2-NE2 2.71Å; W1095-H1119 HydrophobicContact CH2-CB 3.44Å; W1095-H1119 VanDerWaalsContact CH2-CB 3.44Å; W1095-H1119 AromaticContact CH2-CG 3.89Å; W1095-H1119 HydrophobicContact CZ2-CB 4.41Å; W1095-H1119 HydrophobicContact CZ3-CB 3.78Å; F1115-H1119 AromaticContact CD2-CD2 3.66Å; F1115-H1119 AromaticContact CD2-NE2 3.68Å; F1115-H1119 AromaticContact CE2-CD2 3.44Å; F1115-H1119 VanDerWaalsContact CE2-CD2 3.44Å; F1115-H1119 WeakPolarHBondContact CE2-CD2 3.24Å; F1115-H1119 AromaticContact CE2-NE2 3.24Å; F1115-H1119 WeakPolarHBondContact CE2-NE2 3.43Å; F1115-H1119 AromaticContact CZ-CD2 3.67Å; F1115-H1119 AromaticContact CZ-NE2 3.8Å; F1115-H1119 PolarHBondContact O-CD2 3.43Å; F1115-H1119 PolarHBondContact O-N 3.5Å; F1115-H1119 VanDerWaalsContact O-N 3.16Å; L1116-H1119 PolarHBondContact O-N 2.94Å; I1117-H1119 PolarHBondContact O-N 3.04Å; H1119-N1121 VanDerWaalsContact C-N 3.34Å; H1119-N1121 PolarHBondContact O-N 3.48Å; H1119-R1123 VanDerWaalsContact O-CD 3.28Å; H1119-R1123 WeakPolarHBondContact O-CD 3.26Å; H1119-R1123 PolarHBondContact O-NH1 3.39Å
1120	R	86.4	Confident	87.2	Confident	81 Å²	81	47.9 Å²	47.9	31%	0.306	23%	0.232	S	C	.	.			trans	-65.4	-32.7	-179.7	77.3	-174.8	179.7	168.8	0.6	114.2	G971 I973 L1116 I1117 G1122 R1123 I1125 D1140	G971-R1120 WeakPolarHBondContact CA-O 3.18Å; I973-R1120 HydrophobicContact CD1-CB 4.18Å; I973-R1120 HydrophobicContact CG1-CB 3.9Å; L1116-R1120 PolarHBondContact O-N 3.44Å; I1117-R1120 WeakPolarHBondContact O-CG 3.46Å; R1120-G1122 PolarHBondContact O-N 2.95Å; R1120-R1123 PolarHBondContact O-N 3.09Å; R1120-R1123 VanDerWaalsContact O-O 3.08Å; R1120-I1125 HydrophobicContact CB-CD1 4.25Å; R1120-D1140 IonicContact CZ-OD1 3.4Å; R1120-D1140 VanDerWaalsContact NH1-CG 3.28Å; R1120-D1140 IonicContact NH1-OD1 3.06Å; R1120-D1140 PolarHBondContact NH1-OD1 2.95Å; R1120-D1140 IonicContact NH1-OD2 3.32Å; R1120-D1140 PolarHBondContact NH1-OD2 3.4Å; R1120-D1140 VanDerWaalsContact NH1-OD2 3.13Å
1121	N	83.8	Confident	87	Confident	120 Å²	120	41.2 Å²	41.2	64%	0.642	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	124.4	-175.2	-66.1	5.2	0	0	0	110.6	H1119 R1123	H1119-N1121 VanDerWaalsContact C-N 3.34Å; H1119-N1121 PolarHBondContact O-N 3.48Å; N1121-R1123 VanDerWaalsContact C-N 3.3Å; N1121-R1123 PolarHBondContact O-N 3.08Å; N1121-R1123 PolarHBondContact O-NH1 3.38Å
1122	G	78.8	Confident	87	Confident	61 Å²	61	39 Å²	39	63%	0.629	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	12	-178	0	0	0	0	0	115.5	R1120	R1120-G1122 PolarHBondContact O-N 2.95Å
1123	R	86.8	Confident	86.7	Confident	38 Å²	38	41.9 Å²	41.9	14%	0.143	21%	0.214	C	C	.	.			trans	-132.7	149.4	-178.6	-54.8	-173.1	-175.3	75.8	7.9	111.5	G971 D1091 R1093 W1095 H1119 R1120 N1121 I1125	G971-R1123 WeakPolarHBondContact CA-O 3.49Å; G971-R1123 PolarHBondContact N-O 3.03Å; D1091-R1123 IonicContact OD1-CZ 3.84Å; D1091-R1123 IonicContact OD1-NE 2.92Å; D1091-R1123 PolarHBondContact OD1-NE 3.03Å; D1091-R1123 IonicContact OD1-NH2 3.17Å; D1091-R1123 PolarHBondContact OD1-NH2 2.94Å; D1091-R1123 IonicContact OD2-CZ 3.46Å; D1091-R1123 IonicContact OD2-NH2 3.94Å; D1091-R1123 PolarHBondContact OD2-NH2 3.34Å; R1093-R1123 CarbonylContact O-C 3.58Å; R1093-R1123 WeakPolarHBondContact O-CA 3.44Å; W1095-R1123 VanDerWaalsContact CE2-CD 3.49Å; H1119-R1123 VanDerWaalsContact O-CD 3.28Å; H1119-R1123 WeakPolarHBondContact O-CD 3.26Å; H1119-R1123 PolarHBondContact O-NH1 3.39Å; R1120-R1123 PolarHBondContact O-N 3.09Å; R1120-R1123 VanDerWaalsContact O-O 3.08Å; N1121-R1123 VanDerWaalsContact C-N 3.3Å; N1121-R1123 PolarHBondContact O-N 3.08Å; N1121-R1123 PolarHBondContact O-NH1 3.38Å; R1123-I1125 HydrophobicContact CB-CG1 4.35Å
1124	T	88.9	Confident	86.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	107.1	170.8	-57.4	0	0	0	0	108.6	F968 E970 R1093 V1094 W1095 I1126	F968-T1124 HydrophobicContact CB-CG2 3.72Å; E970-T1124 WeakPolarHBondContact CA-OG1 3.23Å; R1093-T1124 PolarHBondContact O-N 2.63Å; V1094-T1124 CarbonylContact C-O 3.56Å; V1094-T1124 WeakPolarHBondContact CA-O 3.41Å; W1095-T1124 PolarHBondContact N-O 3.26Å; T1124-I1126 HydrophobicContact CG2-CG1 4.31Å
1125	I	91.5	Very high	86.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121	-178	-54	-176.5	0	0	0	109.3	Q972 I973 T974 W1095 L1097 R1120 R1123 V1127	Q972-I1125 PolarHBondContact O-N 3.27Å; I973-I1125 HydrophobicContact CG1-CB 4.2Å; I973-I1125 HydrophobicContact CG1-CD1 4.3Å; I973-I1125 HydrophobicContact CG2-CB 4.35Å; I973-I1125 HydrophobicContact CG2-CG2 4.2Å; T974-I1125 PolarHBondContact N-O 3.15Å; T974-I1125 PolarHBondContact OG1-O 3.38Å; W1095-I1125 HydrophobicContact CB-CG1 4.3Å; W1095-I1125 HydrophobicContact CB-CG2 4.33Å; W1095-I1125 HydrophobicContact CD2-CG1 4.43Å; W1095-I1125 HydrophobicContact CE3-CD1 3.83Å; W1095-I1125 HydrophobicContact CE3-CG1 4.16Å; W1095-I1125 HydrophobicContact CZ3-CD1 4.15Å; L1097-I1125 HydrophobicContact CD1-CG2 4.43Å; R1120-I1125 HydrophobicContact CB-CD1 4.25Å; R1123-I1125 HydrophobicContact CB-CG1 4.35Å; I1125-V1127 HydrophobicContact CG2-CG2 3.88Å
1126	I	92.3	Very high	86.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.4	177.7	-48.9	-176.7	0	0	0	108.6	F968 T974 I976 M988 L991 V1094 W1095 L1096 L1097 T1124	F968-I1126 HydrophobicContact CB-CD1 4.13Å; F968-I1126 HydrophobicContact CD1-CD1 3.64Å; F968-I1126 HydrophobicContact CD1-CG1 3.87Å; F968-I1126 HydrophobicContact CD1-CG2 4.43Å; F968-I1126 HydrophobicContact CD2-CD1 3.71Å; F968-I1126 HydrophobicContact CE1-CD1 3.84Å; F968-I1126 HydrophobicContact CE1-CG1 4.17Å; F968-I1126 HydrophobicContact CE1-CG2 3.91Å; F968-I1126 HydrophobicContact CE2-CD1 3.9Å; F968-I1126 HydrophobicContact CG-CD1 3.55Å; F968-I1126 HydrophobicContact CG-CG1 4.16Å; F968-I1126 HydrophobicContact CZ-CD1 3.96Å; F968-I1126 HydrophobicContact CZ-CG2 4.33Å; T974-I1126 WeakPolarHBondContact O-CA 3.48Å; I976-I1126 HydrophobicContact CD1-CG2 3.57Å; I976-I1126 HydrophobicContact CG1-CG2 4.01Å; M988-I1126 HydrophobicContact CE-CG2 4.42Å; M988-I1126 HydrophobicContact SD-CG2 4.02Å; L991-I1126 HydrophobicContact CD1-CD1 4.32Å; V1094-I1126 HydrophobicContact CG1-CD1 4.35Å; W1095-I1126 PolarHBondContact O-N 3.42Å; L1096-I1126 HydrophobicContact CD2-CB 3.88Å; L1096-I1126 HydrophobicContact CD2-CD1 3.72Å; L1096-I1126 HydrophobicContact CD2-CG1 4.1Å; L1096-I1126 HydrophobicContact CD2-CG2 4.47Å; L1097-I1126 PolarHBondContact N-O 3.34Å; T1124-I1126 HydrophobicContact CG2-CG1 4.31Å
1127	V	92.9	Very high	86.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.5	-178.1	-175.8	0	0	0	0	109.6	I973 T974 V975 I976 L1097 P1100 L1116 I1125	I973-V1127 HydrophobicContact CG2-CG2 4.12Å; T974-V1127 PolarHBondContact O-N 3.2Å; V975-V1127 CarbonylContact C-O 3.54Å; V975-V1127 VanDerWaalsContact CA-O 3.3Å; V975-V1127 WeakPolarHBondContact CA-O 3.39Å; V975-V1127 HydrophobicContact CG2-CB 4.27Å; I976-V1127 PolarHBondContact N-O 3.17Å; L1097-V1127 HydrophobicContact CB-CG2 4.42Å; L1097-V1127 HydrophobicContact CD1-CG2 4.4Å; L1097-V1127 WeakPolarHBondContact O-CA 3.28Å; P1100-V1127 HydrophobicContact CG-CG1 3.73Å; L1116-V1127 HydrophobicContact CD1-CG2 4.47Å; I1125-V1127 HydrophobicContact CG2-CG2 3.88Å
1128	T	91.6	Very high	86	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	137.6	164.4	64.8	0	0	0	0	110.1	I976 K984 M988 L1097 D1098 Q1099	I976-T1128 HydrophobicContact CB-CG2 4.3Å; K984-T1128 HydrophobicContact CB-CG2 3.99Å; M988-T1128 HydrophobicContact CE-CG2 4.15Å; M988-T1128 HydrophobicContact CG-CG2 3.2Å; M988-T1128 HydrophobicContact SD-CG2 3.68Å; L1097-T1128 PolarHBondContact O-N 2.97Å; D1098-T1128 VanDerWaalsContact CA-OG1 3.3Å; D1098-T1128 WeakPolarHBondContact CA-OG1 3.35Å; D1098-T1128 PolarHBondContact OD1-OG1 3.41Å; Q1099-T1128 VanDerWaalsContact CA-O 3.27Å; Q1099-T1128 WeakPolarHBondContact CA-O 3.26Å; Q1099-T1128 WeakPolarHBondContact CG-OG1 3.21Å; Q1099-T1128 PolarHBondContact N-O 3.44Å; Q1099-T1128 PolarHBondContact N-OG1 2.95Å
1129	S	88.1	Confident	86.1	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.007	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	154.1	170	-173.1	0	0	0	0	112.1	I976 K984 S1131 E1134	I976-S1129 PolarHBondContact O-N 2.99Å; I976-S1129 VanDerWaalsContact O-N 3.15Å; K984-S1129 PolarHBondContact NZ-O 3.38Å; S1129-S1131 PolarHBondContact OG-N 2.95Å; S1129-S1131 PolarHBondContact OG-O 3.2Å; S1129-E1134 WeakPolarHBondContact CB-OE2 3.15Å; S1129-E1134 PolarHBondContact OG-OE2 3.01Å
1130	S	83.1	Confident	86.2	Confident	35 Å²	35	33 Å²	33	25%	0.245	19%	0.187	C	C	.	.	S	Bend	trans	-103.9	-5.2	162.7	52.5	0	0	0	0	112.4
1131	S	80.4	Confident	86.4	Confident	31 Å²	31	29.4 Å²	29.4	22%	0.217	17%	0.173	C	C	.	.			trans	-96.5	111	-178.4	175.2	0	0	0	0	109.8	S1129 L1133 E1134 A1135	S1129-S1131 PolarHBondContact OG-N 2.95Å; S1129-S1131 PolarHBondContact OG-O 3.2Å; S1131-L1133 PolarHBondContact O-N 3.15Å; S1131-E1134 WeakPolarHBondContact O-CB 3.3Å; S1131-E1134 PolarHBondContact O-N 2.83Å; S1131-E1134 PolarHBondContact OG-N 2.9Å; S1131-A1135 PolarHBondContact O-N 3.2Å; S1131-A1135 VanDerWaalsContact O-N 3.14Å
1132	Y	80.9	Confident	86.7	Confident	34 Å²	34	23.7 Å²	23.7	13%	0.133	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-38.2	176.9	65.1	-88.2	0	0	0	111.6	E1134 A1135 E1136 E1251 K1961	Y1132-E1134 PolarHBondContact O-N 3.4Å; Y1132-A1135 PolarHBondContact O-N 3.37Å; Y1132-E1136 VanDerWaalsContact O-CB 3.31Å; Y1132-E1136 WeakPolarHBondContact O-CB 3.18Å; Y1132-E1136 PolarHBondContact O-N 3.06Å; Y1132-E1251 HydrophobicContact CD2-CB 4.34Å; Y1132-E1251 HydrophobicContact CG-CB 4.28Å; Y1132-K1961 HydrophobicContact CE1-CD 4.38Å; Y1132-K1961 PolarHBondContact OH-NZ 3.49Å
1133	L	81.7	Confident	87.1	Confident	74 Å²	74	21 Å²	21	39%	0.387	11%	0.114	S	C	.	.	H	α-helix	trans	-60	-29.5	173	-65.4	173.1	0	0	0	113.6	S1131 T1137	S1131-L1133 PolarHBondContact O-N 3.15Å; L1133-T1137 VanDerWaalsContact O-CB 3.3Å; L1133-T1137 WeakPolarHBondContact O-CB 3.41Å; L1133-T1137 PolarHBondContact O-N 3.38Å; L1133-T1137 PolarHBondContact O-OG1 2.87Å
1134	E	82.2	Confident	87.2	Confident	6 Å²	6	19.2 Å²	19.2	3%	0.028	11%	0.108	C	C	.	.	H	α-helix	trans	-82	-37.7	-179.5	-173.1	-176.7	-166.9	0	0	110.7	T1101 W1113 S1129 S1131 Y1132 I1138	T1101-E1134 VanDerWaalsContact CB-OE1 3.28Å; T1101-E1134 WeakPolarHBondContact CB-OE1 3.49Å; T1101-E1134 HydrophobicContact CG2-CG 4.41Å; T1101-E1134 WeakPolarHBondContact CG2-OE1 3.44Å; T1101-E1134 PolarHBondContact OG1-OE1 2.85Å; T1101-E1134 PolarHBondContact OG1-OE2 2.84Å; W1113-E1134 HydrophobicContact CZ2-CB 4.39Å; W1113-E1134 HydrophobicContact CZ2-CG 4.27Å; S1129-E1134 WeakPolarHBondContact CB-OE2 3.15Å; S1129-E1134 PolarHBondContact OG-OE2 3.01Å; S1131-E1134 WeakPolarHBondContact O-CB 3.3Å; S1131-E1134 PolarHBondContact O-N 2.83Å; S1131-E1134 PolarHBondContact OG-N 2.9Å; Y1132-E1134 PolarHBondContact O-N 3.4Å; E1134-I1138 HydrophobicContact CG-CD1 3.6Å; E1134-I1138 HydrophobicContact CG-CG1 4.44Å; E1134-I1138 VanDerWaalsContact O-CG1 3.3Å; E1134-I1138 WeakPolarHBondContact O-CG1 3.27Å; E1134-I1138 PolarHBondContact O-N 3.27Å
1135	A	86.3	Confident	87	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59	-59.4	168	0	0	0	0	0	110.1	V975 Y977 S1131 Y1132 T1137 I1138 S1139 I1142 L1250	V975-A1135 HydrophobicContact CB-CB 4.14Å; V975-A1135 HydrophobicContact CG1-CB 3.68Å; Y977-A1135 HydrophobicContact CD2-CB 4.41Å; S1131-A1135 PolarHBondContact O-N 3.2Å; S1131-A1135 VanDerWaalsContact O-N 3.14Å; Y1132-A1135 PolarHBondContact O-N 3.37Å; A1135-T1137 PolarHBondContact O-N 3.33Å; A1135-T1137 VanDerWaalsContact O-N 3.09Å; A1135-I1138 PolarHBondContact O-N 2.92Å; A1135-S1139 WeakPolarHBondContact O-CB 3.44Å; A1135-S1139 PolarHBondContact O-N 2.98Å; A1135-S1139 PolarHBondContact O-OG 3.03Å; A1135-I1142 HydrophobicContact CB-CD1 4.3Å; A1135-I1142 HydrophobicContact CB-CG1 4.42Å; A1135-I1142 HydrophobicContact CB-CG2 4.47Å; A1135-L1250 HydrophobicContact CB-CD2 3.55Å
1136	E	84.7	Confident	86.3	Confident	58 Å²	58	20.2 Å²	20.2	27%	0.271	12%	0.115	S	C	.	.	H	α-helix	trans	-56.2	-29.7	-177.3	-168.5	174	167.3	0	0	114.2	Y1132 F1156	Y1132-E1136 VanDerWaalsContact O-CB 3.31Å; Y1132-E1136 WeakPolarHBondContact O-CB 3.18Å; Y1132-E1136 PolarHBondContact O-N 3.06Å; E1136-F1156 HydrophobicContact CG-CD1 4.45Å; E1136-F1156 HydrophobicContact CG-CE1 4.17Å; E1136-F1156 HydrophobicContact CG-CE2 4.49Å; E1136-F1156 HydrophobicContact CG-CZ 4.19Å
1137	T	85.4	Confident	85.2	Confident	75 Å²	75	26.7 Å²	26.7	46%	0.46	14%	0.139	S	C	.	.	H	α-helix	trans	-89.7	-32.6	-178.3	-51.3	0	0	0	0	114.6	W1113 L1133 A1135	W1113-T1137 HydrophobicContact CE3-CG2 3.69Å; W1113-T1137 HydrophobicContact CH2-CG2 4.46Å; W1113-T1137 HydrophobicContact CZ3-CG2 3.66Å; L1133-T1137 VanDerWaalsContact O-CB 3.3Å; L1133-T1137 WeakPolarHBondContact O-CB 3.41Å; L1133-T1137 PolarHBondContact O-N 3.38Å; L1133-T1137 PolarHBondContact O-OG1 2.87Å; A1135-T1137 PolarHBondContact O-N 3.33Å; A1135-T1137 VanDerWaalsContact O-N 3.09Å
1138	I	88.4	Confident	84.3	Confident	6 Å²	6	31 Å²	31	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-107.6	-24.7	-172.7	-38.4	167.4	0	0	0	112.2	I973 W1113 L1116 I1117 E1134 A1135	I973-I1138 HydrophobicContact CD1-CG2 3.77Å; I973-I1138 HydrophobicContact CG2-CG2 4.1Å; W1113-I1138 HydrophobicContact CB-CG1 4.32Å; W1113-I1138 HydrophobicContact CD2-CD1 4.36Å; W1113-I1138 HydrophobicContact CD2-CG1 4.18Å; W1113-I1138 HydrophobicContact CG-CD1 3.88Å; W1113-I1138 HydrophobicContact CG-CG1 3.87Å; L1116-I1138 HydrophobicContact CB-CG2 4.46Å; I1117-I1138 HydrophobicContact CG1-CG2 4.22Å; E1134-I1138 HydrophobicContact CG-CD1 3.6Å; E1134-I1138 HydrophobicContact CG-CG1 4.44Å; E1134-I1138 VanDerWaalsContact O-CG1 3.3Å; E1134-I1138 WeakPolarHBondContact O-CG1 3.27Å; E1134-I1138 PolarHBondContact O-N 3.27Å; A1135-I1138 PolarHBondContact O-N 2.92Å
1139	S	87.6	Confident	83.6	Confident	20 Å²	20	33.4 Å²	33.4	14%	0.14	17%	0.173	C	C	.	.			trans	-75.7	134.2	-170.2	73.3	0	0	0	0	113.1	A1135 R1141 I1142	A1135-S1139 WeakPolarHBondContact O-CB 3.44Å; A1135-S1139 PolarHBondContact O-N 2.98Å; A1135-S1139 PolarHBondContact O-OG 3.03Å; S1139-R1141 WeakPolarHBondContact CB-O 3.27Å; S1139-I1142 WeakPolarHBondContact OG-CG1 3.47Å
1140	D	89.1	Confident	83.2	Confident	52 Å²	52	34.2 Å²	34.2	28%	0.278	18%	0.176	S	C	.	.	S	Bend	trans	-79.4	-33.5	154.3	-61.2	-63.1	0	0	0	110.3	Q972 I973 R1120	Q972-D1140 HydrophobicContact CB-CB 4.12Å; Q972-D1140 HydrophobicContact CG-CB 4.4Å; I973-D1140 PolarHBondContact N-OD2 3.45Å; I973-D1140 PolarHBondContact O-N 3.36Å; R1120-D1140 IonicContact CZ-OD1 3.4Å; R1120-D1140 VanDerWaalsContact NH1-CG 3.28Å; R1120-D1140 IonicContact NH1-OD1 3.06Å; R1120-D1140 PolarHBondContact NH1-OD1 2.95Å; R1120-D1140 IonicContact NH1-OD2 3.32Å; R1120-D1140 PolarHBondContact NH1-OD2 3.4Å; R1120-D1140 VanDerWaalsContact NH1-OD2 3.13Å
1141	R	89.3	Confident	83	Confident	7 Å²	7	34.3 Å²	34.3	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.1	174.3	-57.9	175.4	70.1	97.1	-11.2	112.5	E933 I973 T974 V975 S1139 G1154	E933-R1141 VanDerWaalsContact O-CZ 3.22Å; E933-R1141 PolarHBondContact O-NH1 2.98Å; E933-R1141 PolarHBondContact O-NH2 3.35Å; I973-R1141 PolarHBondContact O-N 2.83Å; I973-R1141 VanDerWaalsContact O-N 3.16Å; T974-R1141 CarbonylContact C-O 3.51Å; T974-R1141 WeakPolarHBondContact CA-O 3.46Å; T974-R1141 HydrophobicContact CG2-CB 4.22Å; V975-R1141 PolarHBondContact N-O 2.94Å; S1139-R1141 WeakPolarHBondContact CB-O 3.27Å; R1141-G1154 CarbonylContact C-O 3.44Å; R1141-G1154 WeakPolarHBondContact CA-O 3.44Å
1142	I	89.9	Confident	83	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.3	178.5	-54.1	172.3	0	0	0	108.8	V975 A1135 S1139 I1144 C1153 G1154 F1156 L1159 L1250	V975-I1142 WeakPolarHBondContact O-CA 3.4Å; A1135-I1142 HydrophobicContact CB-CD1 4.3Å; A1135-I1142 HydrophobicContact CB-CG1 4.42Å; A1135-I1142 HydrophobicContact CB-CG2 4.47Å; S1139-I1142 WeakPolarHBondContact OG-CG1 3.47Å; I1142-I1144 HydrophobicContact CG2-CG1 4.11Å; I1142-C1153 VanDerWaalsContact O-CA 3.29Å; I1142-C1153 WeakPolarHBondContact O-CA 3.24Å; I1142-G1154 PolarHBondContact N-O 3.45Å; I1142-G1154 PolarHBondContact O-N 3.21Å; I1142-F1156 HydrophobicContact CD1-CB 4.03Å; I1142-F1156 HydrophobicContact CD1-CD2 4.11Å; I1142-F1156 HydrophobicContact CD1-CG 4.46Å; I1142-L1159 HydrophobicContact CB-CD1 3.88Å; I1142-L1159 HydrophobicContact CG2-CD1 4.38Å; I1142-L1250 HydrophobicContact CD1-CD1 3.75Å; I1142-L1250 HydrophobicContact CD1-CD2 3.84Å; I1142-L1250 HydrophobicContact CD1-CG 4.38Å; I1142-L1250 HydrophobicContact CG2-CD1 4.29Å; I1142-L1250 HydrophobicContact CG2-CD2 4.26Å
1143	A	88.9	Confident	83.1	Confident	3 Å²	3	31.6 Å²	31.6	3%	0.025	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	115.6	174.6	0	0	0	0	0	108.9	V975 I976 Y977 L1150 C1153	V975-A1143 PolarHBondContact O-N 2.82Å; I976-A1143 CarbonylContact C-O 3.55Å; I976-A1143 WeakPolarHBondContact CA-O 3.07Å; I976-A1143 HydrophobicContact CG1-CB 4.41Å; Y977-A1143 PolarHBondContact N-O 3.16Å; Y977-A1143 VanDerWaalsContact O-O 3.13Å; A1143-L1150 HydrophobicContact CB-CD1 3.97Å; A1143-C1153 HydrophobicContact CB-CB 4.15Å
1144	I	87.8	Confident	83.2	Confident	2 Å²	2	28.1 Å²	28.1	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	109	-174.5	-64.2	172.9	0	0	0	109.8	Y977 I1142 L1151 C1152 L1159 L1250 V1254	Y977-I1144 HydrophobicContact CD1-CG1 4.39Å; I1142-I1144 HydrophobicContact CG2-CG1 4.11Å; I1144-L1151 HydrophobicContact CG2-CB 4.43Å; I1144-L1151 HydrophobicContact CG2-CD1 4.36Å; I1144-L1151 PolarHBondContact O-N 3.38Å; I1144-C1152 PolarHBondContact N-O 3.2Å; I1144-L1159 HydrophobicContact CD1-CD1 4.16Å; I1144-L1250 HydrophobicContact CD1-CD1 4.45Å; I1144-V1254 HydrophobicContact CD1-CG2 3.68Å; I1144-V1254 HydrophobicContact CG1-CG2 4.28Å; I1144-V1254 HydrophobicContact CG2-CG2 4.43Å
1145	L	85.7	Confident	83.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113	177.7	-169.3	81.7	0	0	0	110.7	L961 V964 I976 Y977 G978 S982 K984 T1149	L961-L1145 HydrophobicContact CD2-CD1 4.27Å; L961-L1145 HydrophobicContact CD2-CD2 4.19Å; V964-L1145 HydrophobicContact CG2-CD1 4.27Å; I976-L1145 HydrophobicContact CG2-CB 4.29Å; Y977-L1145 PolarHBondContact O-N 3.5Å; G978-L1145 VanDerWaalsContact CA-O 3.25Å; G978-L1145 WeakPolarHBondContact CA-O 3.49Å; S982-L1145 WeakPolarHBondContact CB-O 3.38Å; S982-L1145 VanDerWaalsContact O-CD2 3.26Å; S982-L1145 WeakPolarHBondContact O-CD2 3.49Å; S982-L1145 PolarHBondContact OG-O 3.49Å; K984-L1145 HydrophobicContact CB-CD2 4.44Å; K984-L1145 HydrophobicContact CG-CD2 3.77Å; L1145-T1149 WeakPolarHBondContact CD1-O 3.49Å
1146	S	76.9	Confident	83.2	Confident	21 Å²	21	30.6 Å²	30.6	15%	0.147	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153.7	178.7	-169.5	0	0	0	0	110.7	K1148 T1149	S1146-K1148 PolarHBondContact O-N 3.47Å; S1146-T1149 PolarHBondContact N-O 3.24Å; S1146-T1149 PolarHBondContact O-N 2.86Å; S1146-T1149 PolarHBondContact O-OG1 3.49Å
1147	R	69.1	Low	82.9	Confident	136 Å²	136	32.2 Å²	32.2	51%	0.513	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	30.1	-178.9	-57	-175.7	-175.9	148.9	9.5	115.4	T1149 S1261 I1262	R1147-T1149 PolarHBondContact O-N 3.32Å; R1147-S1261 PolarHBondContact NH1-O 3.19Å; R1147-S1261 VanDerWaalsContact NH1-O 3.09Å; R1147-I1262 VanDerWaalsContact NH2-CD1 3.29Å
1148	K	72.7	Confident	82.7	Confident	90 Å²	90	30.9 Å²	30.9	39%	0.391	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	-1.9	-179.4	-47.5	165.6	-176.2	-173.6	0	115.5	V959 I960 L961 T962 S1146	V959-K1148 VanDerWaalsContact O-CD 3.26Å; V959-K1148 WeakPolarHBondContact O-CD 3.39Å; V959-K1148 WeakPolarHBondContact O-CE 3.5Å; V959-K1148 PolarHBondContact O-NZ 3.22Å; I960-K1148 VanDerWaalsContact O-CB 3.25Å; I960-K1148 WeakPolarHBondContact O-CB 3.21Å; I960-K1148 WeakPolarHBondContact O-CG 3.49Å; L961-K1148 WeakPolarHBondContact CA-O 3.32Å; T962-K1148 PolarHBondContact N-O 3.23Å; T962-K1148 PolarHBondContact OG1-O 3.41Å; S1146-K1148 PolarHBondContact O-N 3.47Å
1149	T	76.8	Confident	82.3	Confident	51 Å²	51	30.7 Å²	30.7	31%	0.313	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	161.1	172.9	51	0	0	0	0	110.8	T962 L1145 S1146 R1147	T962-T1149 WeakPolarHBondContact OG1-CG2 3.13Å; L1145-T1149 WeakPolarHBondContact CD1-O 3.49Å; S1146-T1149 PolarHBondContact N-O 3.24Å; S1146-T1149 PolarHBondContact O-N 2.86Å; S1146-T1149 PolarHBondContact O-OG1 3.49Å; R1147-T1149 PolarHBondContact O-N 3.32Å
1150	L	80.4	Confident	81.8	Confident	17 Å²	17	31.5 Å²	31.5	9%	0.089	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	128.3	161.1	-173.4	86.4	0	0	0	108.2	L930 V964 T965 V966 A1143 C1153	L930-L1150 HydrophobicContact CD1-CD2 3.92Å; L930-L1150 HydrophobicContact CD2-CD2 3.95Å; V964-L1150 HydrophobicContact CG1-CB 4.38Å; T965-L1150 WeakPolarHBondContact O-CD2 3.19Å; V966-L1150 HydrophobicContact CG2-CD1 3.97Å; V966-L1150 HydrophobicContact CG2-CD2 3.54Å; V966-L1150 HydrophobicContact CG2-CG 4.29Å; A1143-L1150 HydrophobicContact CB-CD1 3.97Å; L1150-C1153 HydrophobicContact CD2-CB 4.3Å
1151	L	79	Confident	81.1	Confident	38 Å²	38	33.2 Å²	33.2	20%	0.199	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-45.6	178.5	-64.1	-176.2	0	0	0	112.4	L930 I1144 V1257	L930-L1151 WeakPolarHBondContact CD2-O 3.08Å; I1144-L1151 HydrophobicContact CG2-CB 4.43Å; I1144-L1151 HydrophobicContact CG2-CD1 4.36Å; I1144-L1151 PolarHBondContact O-N 3.38Å; L1151-V1257 HydrophobicContact CB-CG1 4.04Å; L1151-V1257 HydrophobicContact CD1-CG1 4.06Å
1152	C	79.3	Confident	80.4	Confident	4 Å²	4	36 Å²	36	3%	0.027	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	160.3	-178.8	54.1	0	0	0	0	111.3	I1144 L1159	I1144-C1152 PolarHBondContact N-O 3.2Å; C1152-L1159 HydrophobicContact CB-CD2 3.95Å
1153	C	83.3	Confident	79.4	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.027	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	125.1	176.8	172.8	0	0	0	0	112.3	H932 I1142 A1143 L1150	H932-C1153 PolarHBondContact ND1-O 2.79Å; H932-C1153 VanDerWaalsContact ND1-O 3.16Å; I1142-C1153 VanDerWaalsContact O-CA 3.29Å; I1142-C1153 WeakPolarHBondContact O-CA 3.24Å; A1143-C1153 HydrophobicContact CB-CB 4.15Å; L1150-C1153 HydrophobicContact CD2-CB 4.3Å
1154	G	84.4	Confident	78.4	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.8	-168.8	175.9	0	0	0	0	0	111.9	R1141 I1142	R1141-G1154 CarbonylContact C-O 3.44Å; R1141-G1154 WeakPolarHBondContact CA-O 3.44Å; I1142-G1154 PolarHBondContact N-O 3.45Å; I1142-G1154 PolarHBondContact O-N 3.21Å
1155	S	85	Confident	77.4	Confident	14 Å²	14	43 Å²	43	10%	0.098	22%	0.215	C	C	.	.			trans	-64.6	157.9	174	63.4	0	0	0	0	112.3	E933 T1157 F1158 L1159	E933-S1155 PolarHBondContact OE1-OG 3.01Å; E933-S1155 WeakPolarHBondContact OE2-CB 3.33Å; E933-S1155 PolarHBondContact OE2-N 3.29Å; E933-S1155 PolarHBondContact OE2-OG 2.88Å; S1155-T1157 VanDerWaalsContact C-N 3.26Å; S1155-T1157 PolarHBondContact O-N 3.46Å; S1155-T1157 PolarHBondContact OG-OG1 3.32Å; S1155-F1158 PolarHBondContact O-N 2.98Å; S1155-F1158 WeakPolarHBondContact OG-CB 3.37Å; S1155-F1158 PolarHBondContact OG-N 3.39Å; S1155-L1159 WeakPolarHBondContact O-CG 3.4Å; S1155-L1159 PolarHBondContact O-N 3.35Å
1156	F	83	Confident	76.7	Confident	45 Å²	45	43.5 Å²	43.5	20%	0.197	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-38.5	176.7	177	-120.6	0	0	0	112.2	E1136 I1142 L1159 R1160 L1250 V1253	E1136-F1156 HydrophobicContact CG-CD1 4.45Å; E1136-F1156 HydrophobicContact CG-CE1 4.17Å; E1136-F1156 HydrophobicContact CG-CE2 4.49Å; E1136-F1156 HydrophobicContact CG-CZ 4.19Å; I1142-F1156 HydrophobicContact CD1-CB 4.03Å; I1142-F1156 HydrophobicContact CD1-CD2 4.11Å; I1142-F1156 HydrophobicContact CD1-CG 4.46Å; F1156-L1159 PolarHBondContact O-N 3.11Å; F1156-R1160 WeakPolarHBondContact O-CB 3.23Å; F1156-R1160 PolarHBondContact O-N 3.24Å; F1156-L1250 HydrophobicContact CD2-CB 4.4Å; F1156-L1250 HydrophobicContact CD2-CD1 4.13Å; F1156-L1250 HydrophobicContact CE2-CB 3.88Å; F1156-L1250 HydrophobicContact CE2-CD1 4.27Å; F1156-V1253 HydrophobicContact CE2-CG2 4.5Å
1157	T	79.2	Confident	76.5	Confident	91 Å²	91	43.5 Å²	43.5	56%	0.558	22%	0.217	S	C	*	.	H	α-helix	trans	-59.9	-47	172.9	33	0	0	0	0	112.3	S1155 R1160 N1161	S1155-T1157 VanDerWaalsContact C-N 3.26Å; S1155-T1157 PolarHBondContact O-N 3.46Å; S1155-T1157 PolarHBondContact OG-OG1 3.32Å; T1157-R1160 PolarHBondContact O-N 3.27Å; T1157-N1161 WeakPolarHBondContact O-CB 3.31Å; T1157-N1161 VanDerWaalsContact O-CG 3.24Å; T1157-N1161 PolarHBondContact O-N 3.2Å; T1157-N1161 PolarHBondContact O-OD1 3.16Å
1158	F	81.4	Confident	76.8	Confident	48 Å²	48	40.2 Å²	40.2	21%	0.211	21%	0.206	C	C	.	.	H	α-helix	trans	-62.4	-45.3	177.3	173.5	-103.8	0	0	0	112.2	P931 E933 S1155 R1160 N1161 Q1162	P931-F1158 HydrophobicContact CB-CZ 4.47Å; P931-F1158 WeakPolarHBondContact O-CE1 3.43Å; P931-F1158 VanDerWaalsContact O-CZ 3.3Å; P931-F1158 WeakPolarHBondContact O-CZ 3.15Å; E933-F1158 HydrophobicContact CB-CD1 4.21Å; E933-F1158 HydrophobicContact CB-CD2 4.04Å; E933-F1158 HydrophobicContact CB-CE1 4.1Å; E933-F1158 HydrophobicContact CB-CE2 3.99Å; E933-F1158 HydrophobicContact CB-CG 4.13Å; E933-F1158 HydrophobicContact CB-CZ 3.98Å; E933-F1158 VanDerWaalsContact N-CZ 3.33Å; E933-F1158 WeakPolarHBondContact OE2-CB 3.26Å; S1155-F1158 PolarHBondContact O-N 2.98Å; S1155-F1158 WeakPolarHBondContact OG-CB 3.37Å; S1155-F1158 PolarHBondContact OG-N 3.39Å; F1158-R1160 PolarHBondContact O-N 3.24Å; F1158-N1161 PolarHBondContact O-N 3.48Å; F1158-Q1162 WeakPolarHBondContact O-CG 3.31Å; F1158-Q1162 PolarHBondContact O-N 3.17Å
1159	L	79.5	Confident	77.1	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-35.4	176.9	-64.8	175.4	0	0	0	112.9	I1142 I1144 C1152 S1155 F1156 T1163 V1253	I1142-L1159 HydrophobicContact CB-CD1 3.88Å; I1142-L1159 HydrophobicContact CG2-CD1 4.38Å; I1144-L1159 HydrophobicContact CD1-CD1 4.16Å; C1152-L1159 HydrophobicContact CB-CD2 3.95Å; S1155-L1159 WeakPolarHBondContact O-CG 3.4Å; S1155-L1159 PolarHBondContact O-N 3.35Å; F1156-L1159 PolarHBondContact O-N 3.11Å; L1159-T1163 PolarHBondContact O-N 3.32Å; L1159-T1163 PolarHBondContact O-OG1 2.84Å; L1159-V1253 HydrophobicContact CB-CG1 3.93Å
1160	R	77.2	Confident	77.3	Confident	37 Å²	37	38 Å²	38	14%	0.14	19%	0.192	C	C	.	.	H	α-helix	trans	-67.8	-40.4	174.3	-175.7	180	175.9	-159.3	-0.6	112.1	F1156 T1157 F1158 T1163 N1164 L1165 G1166	F1156-R1160 WeakPolarHBondContact O-CB 3.23Å; F1156-R1160 PolarHBondContact O-N 3.24Å; T1157-R1160 PolarHBondContact O-N 3.27Å; F1158-R1160 PolarHBondContact O-N 3.24Å; R1160-T1163 PolarHBondContact O-N 3.17Å; R1160-T1163 PolarHBondContact O-OG1 3.2Å; R1160-T1163 VanDerWaalsContact O-OG1 3.07Å; R1160-N1164 PolarHBondContact O-N 3.16Å; R1160-L1165 WeakPolarHBondContact CG-O 3.33Å; R1160-L1165 PolarHBondContact NE-O 2.84Å; R1160-L1165 PolarHBondContact O-N 3.05Å; R1160-G1166 PolarHBondContact NH2-O 3.4Å
1161	N	75.4	Confident	77.3	Confident	89 Å²	89	37.3 Å²	37.3	48%	0.476	19%	0.189	S	C	.	.	H	α-helix	trans	-66.7	-46.9	177.3	-70.2	-0.1	0	0	0	111	T1157 F1158 T1163 N1164	T1157-N1161 WeakPolarHBondContact O-CB 3.31Å; T1157-N1161 VanDerWaalsContact O-CG 3.24Å; T1157-N1161 PolarHBondContact O-N 3.2Å; T1157-N1161 PolarHBondContact O-OD1 3.16Å; F1158-N1161 PolarHBondContact O-N 3.48Å; N1161-T1163 PolarHBondContact O-N 3.3Å; N1161-T1163 VanDerWaalsContact O-N 3.17Å; N1161-N1164 PolarHBondContact O-N 3.45Å; N1161-N1164 PolarHBondContact O-OD1 3.14Å
1162	Q	73.1	Confident	77.3	Confident	66 Å²	66	41.4 Å²	41.4	31%	0.308	20%	0.202	S	C	.	.	H	α-helix	trans	-56.4	-32.6	175.5	-76.4	-177.9	1.4	0	0	114.1	P931 F1158 N1164	P931-Q1162 VanDerWaalsContact CB-NE2 3.33Å; F1158-Q1162 WeakPolarHBondContact O-CG 3.31Å; F1158-Q1162 PolarHBondContact O-N 3.17Å; Q1162-N1164 VanDerWaalsContact C-N 3.35Å
1163	T	70	Confident	77.2	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.2	-178.7	45	0	0	0	0	113.5	L1159 R1160 N1161 L1165 V1253 K1256 V1257	L1159-T1163 PolarHBondContact O-N 3.32Å; L1159-T1163 PolarHBondContact O-OG1 2.84Å; R1160-T1163 PolarHBondContact O-N 3.17Å; R1160-T1163 PolarHBondContact O-OG1 3.2Å; R1160-T1163 VanDerWaalsContact O-OG1 3.07Å; N1161-T1163 PolarHBondContact O-N 3.3Å; N1161-T1163 VanDerWaalsContact O-N 3.17Å; T1163-L1165 PolarHBondContact O-N 3.32Å; T1163-V1253 HydrophobicContact CG2-CG1 3.91Å; T1163-K1256 HydrophobicContact CG2-CB 4.37Å; T1163-K1256 VanDerWaalsContact O-CD 3.23Å; T1163-K1256 WeakPolarHBondContact O-CD 3.45Å; T1163-K1256 WeakPolarHBondContact O-CE 3.37Å; T1163-K1256 PolarHBondContact O-NZ 3.39Å; T1163-V1257 HydrophobicContact CG2-CG2 3.49Å; T1163-V1257 VanDerWaalsContact CG2-CG2 3.49Å
1164	N	67.1	Low	76.6	Confident	127 Å²	127	46.9 Å²	46.9	68%	0.679	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.1	49.9	-172.1	-72.5	-12.3	0	0	0	111.3	R1160 N1161 Q1162 K1256	R1160-N1164 PolarHBondContact O-N 3.16Å; N1161-N1164 PolarHBondContact O-N 3.45Å; N1161-N1164 PolarHBondContact O-OD1 3.14Å; Q1162-N1164 VanDerWaalsContact C-N 3.35Å; N1164-K1256 PolarHBondContact O-NZ 2.78Å
1165	L	67.4	Low	75.4	Confident	23 Å²	23	53 Å²	53	12%	0.12	27%	0.267	C	S	.	.			trans	-107.2	97.4	178.9	-80	173	0	0	0	110.5	R1160 T1163 L1218 A1248 Q1252 V1253 K1256	R1160-L1165 WeakPolarHBondContact CG-O 3.33Å; R1160-L1165 PolarHBondContact NE-O 2.84Å; R1160-L1165 PolarHBondContact O-N 3.05Å; T1163-L1165 PolarHBondContact O-N 3.32Å; L1165-L1218 WeakPolarHBondContact O-CD1 3.42Å; L1165-A1248 HydrophobicContact CB-CB 3.62Å; L1165-A1248 HydrophobicContact CD1-CB 4.45Å; L1165-Q1252 HydrophobicContact CD1-CB 4.18Å; L1165-Q1252 WeakPolarHBondContact CD1-O 3.32Å; L1165-V1253 HydrophobicContact CD1-CB 4.33Å; L1165-V1253 HydrophobicContact CD1-CG2 3.91Å; L1165-K1256 HydrophobicContact CD1-CB 4.15Å; L1165-K1256 HydrophobicContact CD1-CD 4.15Å; L1165-K1256 HydrophobicContact CD2-CD 3.86Å; L1165-K1256 HydrophobicContact CG-CD 3.82Å
1166	G	70	Confident	74.2	Confident	10 Å²	10	59 Å²	59	10%	0.103	30%	0.295	C	S	.	.			trans	-73.1	-131	179.5	0	0	0	0	0	114.5	R1160 I1216 A1248	R1160-G1166 PolarHBondContact NH2-O 3.4Å; G1166-I1216 CarbonylContact C-O 3.45Å; G1166-I1216 VanDerWaalsContact CA-O 3.23Å; G1166-I1216 WeakPolarHBondContact CA-O 3.4Å; G1166-A1248 PolarHBondContact O-N 2.96Å
1167	F	73.5	Confident	72.8	Confident	22 Å²	22	64.2 Å²	64.2	10%	0.096	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.9	-178	-61.6	-91.9	0	0	0	110.5	I1216 L1224 L1245 S1246	F1167-I1216 HydrophobicContact CB-CB 4.43Å; F1167-I1216 PolarHBondContact N-O 2.96Å; F1167-I1216 PolarHBondContact O-N 2.89Å; F1167-L1224 HydrophobicContact CD1-CD2 4.45Å; F1167-L1224 HydrophobicContact CD2-CD1 4.36Å; F1167-L1224 HydrophobicContact CD2-CD2 4.07Å; F1167-L1224 HydrophobicContact CE1-CD2 4.06Å; F1167-L1224 HydrophobicContact CE2-CD2 3.66Å; F1167-L1224 HydrophobicContact CG-CD2 4.46Å; F1167-L1224 HydrophobicContact CZ-CD2 3.64Å; F1167-L1245 HydrophobicContact CB-CD1 3.79Å; F1167-L1245 HydrophobicContact CB-CG 4.33Å; F1167-L1245 HydrophobicContact CD1-CD2 4.38Å; F1167-L1245 HydrophobicContact CD1-CG 4.41Å; F1167-S1246 CarbonylContact C-O 3.53Å; F1167-S1246 WeakPolarHBondContact CA-O 3.17Å
1168	K	75.1	Confident	71.5	Confident	67 Å²	67	67 Å²	67	29%	0.291	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113.9	172.4	-73.8	-178	176.1	170.3	0	109.3	V1214 S1246 Q1252	K1168-V1214 CarbonylContact C-O 3.51Å; K1168-V1214 WeakPolarHBondContact CA-O 3.26Å; K1168-S1246 PolarHBondContact N-O 2.99Å; K1168-S1246 PolarHBondContact O-N 3.41Å; K1168-S1246 PolarHBondContact O-OG 3.38Å; K1168-Q1252 VanDerWaalsContact NZ-CD 3.28Å
1169	M	79.6	Confident	69.9	Low	5 Å²	5	73.7 Å²	73.7	3%	0.025	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	133.6	172.8	-176.4	172.6	69.5	0	0	109.5	L1171 M1199 V1214 I1216 I1231 V1244 L1245	M1169-L1171 HydrophobicContact CE-CD1 4.29Å; M1169-L1171 HydrophobicContact CE-CD2 3.94Å; M1169-L1171 HydrophobicContact CE-CG 4.21Å; M1169-L1171 HydrophobicContact CG-CD2 4.07Å; M1169-L1171 HydrophobicContact SD-CD2 3.92Å; M1169-M1199 HydrophobicContact CE-CE 4.47Å; M1169-V1214 HydrophobicContact CB-CB 4.4Å; M1169-V1214 HydrophobicContact CE-CB 4.19Å; M1169-V1214 HydrophobicContact CE-CG2 4.17Å; M1169-V1214 PolarHBondContact N-O 3.06Å; M1169-V1214 PolarHBondContact O-N 3.03Å; M1169-I1216 HydrophobicContact CB-CD1 4.04Å; M1169-I1231 HydrophobicContact CE-CD1 4.18Å; M1169-I1231 HydrophobicContact SD-CD1 3.98Å; M1169-I1231 HydrophobicContact SD-CG2 4.12Å; M1169-V1244 CarbonylContact C-O 3.46Å; M1169-V1244 WeakPolarHBondContact CA-O 3.35Å; M1169-L1245 HydrophobicContact CB-CD1 4.06Å
1170	K	80.9	Confident	68.7	Low	88 Å²	88	80 Å²	80	38%	0.383	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.6	172.2	-50	-177	-179.3	175.9	0	108.4	I1212 Y1243 V1244	K1170-I1212 CarbonylContact C-O 3.6Å; K1170-I1212 VanDerWaalsContact CA-O 3.3Å; K1170-I1212 WeakPolarHBondContact CA-O 3.35Å; K1170-Y1243 CarbonylContact O-C 3.23Å; K1170-Y1243 VanDerWaalsContact O-CA 3.3Å; K1170-Y1243 WeakPolarHBondContact O-CA 3.46Å; K1170-V1244 HydrophobicContact CB-CB 4.33Å; K1170-V1244 PolarHBondContact N-O 3.17Å; K1170-V1244 PolarHBondContact O-N 3.02Å
1171	L	80	Confident	67.3	Low	4 Å²	4	84.2 Å²	84.2	2%	0.021	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	140.8	171.2	-51.9	173.1	0	0	0	108.4	M1169 K1211 I1212 C1240	M1169-L1171 HydrophobicContact CE-CD1 4.29Å; M1169-L1171 HydrophobicContact CE-CD2 3.94Å; M1169-L1171 HydrophobicContact CE-CG 4.21Å; M1169-L1171 HydrophobicContact CG-CD2 4.07Å; M1169-L1171 HydrophobicContact SD-CD2 3.92Å; L1171-K1211 CarbonylContact O-C 3.57Å; L1171-K1211 VanDerWaalsContact O-CA 3.24Å; L1171-K1211 WeakPolarHBondContact O-CA 3.25Å; L1171-I1212 HydrophobicContact CB-CB 4.23Å; L1171-I1212 PolarHBondContact N-O 3.08Å; L1171-I1212 PolarHBondContact O-N 3.08Å; L1171-C1240 HydrophobicContact CB-CB 4.44Å
1172	R	79	Confident	65.9	Low	123 Å²	123	87 Å²	87	46%	0.464	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.5	172.2	-174.9	-162.7	-63.7	173.1	-7.2	108.6	E1210 C1240 D1241 S1242	R1172-E1210 WeakPolarHBondContact CA-O 3.38Å; R1172-C1240 CarbonylContact O-C 3.57Å; R1172-C1240 WeakPolarHBondContact O-CA 3.42Å; R1172-C1240 WeakPolarHBondContact O-CB 3.5Å; R1172-D1241 WeakPolarHBondContact CD-OD2 3.29Å; R1172-D1241 IonicContact CZ-OD2 3.64Å; R1172-D1241 IonicContact NE-OD2 3.67Å; R1172-D1241 IonicContact NH1-OD2 2.87Å; R1172-D1241 PolarHBondContact NH1-OD2 3.25Å; R1172-D1241 PolarHBondContact O-N 2.89Å; R1172-S1242 PolarHBondContact N-O 2.68Å; R1172-S1242 PolarHBondContact NE-OG 2.94Å; R1172-S1242 PolarHBondContact NH1-OG 3.33Å
1173	K	77	Confident	64.9	Low	32 Å²	32	86.7 Å²	86.7	14%	0.139	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	149.9	173.2	-66.5	-154.1	-177.6	-171.4	0	111.1	E1187 Y1207 Q1209 E1210 A1239	K1173-E1187 VanDerWaalsContact NZ-CD 3.3Å; K1173-E1187 IonicContact NZ-OE1 3.76Å; K1173-E1187 PolarHBondContact NZ-OE1 3Å; K1173-E1187 IonicContact NZ-OE2 2.7Å; K1173-E1187 PolarHBondContact NZ-OE2 3.37Å; K1173-Y1207 VanDerWaalsContact CE-OH 3.29Å; K1173-Y1207 WeakPolarHBondContact CE-OH 3.46Å; K1173-Y1207 PolarHBondContact NZ-OH 3.19Å; K1173-Q1209 WeakPolarHBondContact CD-O 3.33Å; K1173-E1210 PolarHBondContact N-O 2.93Å; K1173-A1239 CarbonylContact C-O 3.53Å; K1173-A1239 WeakPolarHBondContact CA-O 3.24Å
1174	M	71.3	Confident	64	Low	91 Å²	91	90.8 Å²	90.8	45%	0.448	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-68.6	144.6	164.9	-70.7	177.5	167.7	0	0	110.1	A1239 D1241	M1174-A1239 PolarHBondContact N-O 3.47Å; M1174-D1241 HydrophobicContact CG-CB 4.15Å
1175	P	59.7	Low	63.2	Low	128 Å²	128	91.5 Å²	91.5	83%	0.831	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-69.7	129.7	170.3	29.8	-32.5	0	0	0	109.7
1176	M	58.8	Low	62.4	Low	141 Å²	141	93.5 Å²	93.5	70%	0.695	50%	0.497	S	S	*	.			trans	-105.5	143.6	169.5	-64.9	-65.4	-164.6	0	0	108.7
1177	D	53.5	Low	61.7	Low	154 Å²	154	96 Å²	96	82%	0.824	51%	0.506	S	S	*	.			trans	-69.4	150.1	175.7	-73.9	-38.2	0	0	0	111.6	K1179	D1177-K1179 PolarHBondContact O-N 2.97Å
1178	D	52	Low	60.9	Low	149 Å²	149	96.8 Å²	96.8	80%	0.797	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	13.2	-163.6	-82.9	-40.5	0	0	0	118.3
1179	K	48.3	Very low	60.1	Low	190 Å²	190	100.1 Å²	100.1	83%	0.826	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-19	-172.2	-69.7	-175.8	176.8	178.5	0	116	D1177	D1177-K1179 PolarHBondContact O-N 2.97Å
1180	D	53.1	Low	59.3	Low	133 Å²	133	106.7 Å²	106.7	71%	0.711	55%	0.552	S	S	*	*			trans	-109.2	39.5	-167.6	-63.7	-24.5	0	0	0	114.9	V1182	D1180-V1182 PolarHBondContact O-N 3.31Å
1181	I	49.6	Very low	58.5	Low	125 Å²	125	102.8 Å²	102.8	64%	0.641	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-68	-2.5	-167.1	-65.2	173.4	0	0	0	115.1
1182	V	44.1	Very low	57.7	Low	148 Å²	148	109.4 Å²	109.4	90%	0.897	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-88	-8.6	-163.3	-176.1	0	0	0	0	115.4	D1180	D1180-V1182 PolarHBondContact O-N 3.31Å
1183	S	53.8	Low	57.1	Low	60 Å²	60	108.4 Å²	108.4	42%	0.42	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-102.7	5.5	-166.2	69.8	0	0	0	0	117.6	N1185 A1186 E1187	S1183-N1185 PolarHBondContact O-N 3.02Å; S1183-A1186 PolarHBondContact O-N 3.36Å; S1183-E1187 PolarHBondContact O-N 2.86Å
1184	T	51	Low	56.5	Low	87 Å²	87	108.3 Å²	108.3	53%	0.534	56%	0.562	S	S	.	*	H	α-helix	trans	-59	-19.9	-166.4	50.4	0	0	0	0	116.8	N1188	T1184-N1188 PolarHBondContact O-ND2 3.17Å
1185	N	50	Low	56.3	Low	141 Å²	141	104.2 Å²	104.2	75%	0.754	54%	0.542	S	S	*	.	H	α-helix	trans	-83.1	-29.2	173.6	-77.9	-17.4	0	0	0	113.3	S1183	S1183-N1185 PolarHBondContact O-N 3.02Å
1186	A	50.7	Low	56.6	Low	65 Å²	65	101.3 Å²	101.3	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-75.2	-42.2	-179.6	0	0	0	0	0	111.9	S1183 N1188 H1189 W1190	S1183-A1186 PolarHBondContact O-N 3.36Å; A1186-N1188 VanDerWaalsContact C-N 3.26Å; A1186-N1188 PolarHBondContact O-N 3.38Å; A1186-H1189 PolarHBondContact O-N 2.94Å; A1186-W1190 PolarHBondContact O-N 3.07Å
1187	E	55.6	Low	57.1	Low	64 Å²	64	104.7 Å²	104.7	30%	0.299	53%	0.529	S	S	.	.	H	α-helix	trans	-55.1	-42.6	177	-62.7	-169.7	131.3	0	0	112.1	K1173 S1183 H1189 W1190 T1191	K1173-E1187 VanDerWaalsContact NZ-CD 3.3Å; K1173-E1187 IonicContact NZ-OE1 3.76Å; K1173-E1187 PolarHBondContact NZ-OE1 3Å; K1173-E1187 IonicContact NZ-OE2 2.7Å; K1173-E1187 PolarHBondContact NZ-OE2 3.37Å; S1183-E1187 PolarHBondContact O-N 2.86Å; E1187-H1189 PolarHBondContact O-N 3.18Å; E1187-W1190 PolarHBondContact O-N 3.15Å; E1187-T1191 PolarHBondContact O-N 3.29Å; E1187-T1191 PolarHBondContact O-OG1 3.06Å
1188	N	55.4	Low	57.5	Low	37 Å²	37	98.9 Å²	98.9	20%	0.198	50%	0.498	C	S	.	.	H	α-helix	trans	-62.2	-25.5	179.1	-88.4	-55.2	0	0	0	113.8	T1184 A1186 R1192 Y1207	T1184-N1188 PolarHBondContact O-ND2 3.17Å; A1186-N1188 VanDerWaalsContact C-N 3.26Å; A1186-N1188 PolarHBondContact O-N 3.38Å; N1188-R1192 WeakPolarHBondContact O-CD 3.33Å; N1188-R1192 VanDerWaalsContact O-CG 3.28Å; N1188-R1192 WeakPolarHBondContact O-CG 3.37Å; N1188-R1192 PolarHBondContact O-NH1 2.81Å; N1188-Y1207 WeakPolarHBondContact OD1-CD1 3.47Å
1189	H	59	Low	58.1	Low	138 Å²	138	92.5 Å²	92.5	64%	0.639	46%	0.464	S	S	*	.	H	α-helix	trans	-89.5	-43.4	177.5	-153.3	-77.4	0	0	0	110.9	A1186 E1187 R1192 H1193	A1186-H1189 PolarHBondContact O-N 2.94Å; E1187-H1189 PolarHBondContact O-N 3.18Å; H1189-R1192 PolarHBondContact O-N 3.24Å; H1189-H1193 WeakPolarHBondContact O-CB 3.45Å; H1189-H1193 PolarHBondContact O-N 3.12Å
1190	W	62.7	Low	58.8	Low	142 Å²	142	89.2 Å²	89.2	54%	0.538	46%	0.462	S	S	.	.	H	α-helix	trans	-63.1	-47.9	179.2	-171.9	56.3	0	0	0	112.3	A1186 E1187 R1192 H1193 I1194 E1237	A1186-W1190 PolarHBondContact O-N 3.07Å; E1187-W1190 PolarHBondContact O-N 3.15Å; W1190-R1192 VanDerWaalsContact C-N 3.34Å; W1190-R1192 PolarHBondContact O-N 3.32Å; W1190-H1193 PolarHBondContact O-N 3.3Å; W1190-I1194 HydrophobicContact CD2-CD1 4.11Å; W1190-I1194 HydrophobicContact CG-CD1 4.39Å; W1190-I1194 HydrophobicContact CZ2-CD1 3.93Å; W1190-I1194 PolarHBondContact O-N 3.01Å; W1190-E1237 WeakPolarHBondContact CH2-O 3.34Å
1191	T	63.5	Low	59.4	Low	7 Å²	7	89.9 Å²	89.9	4%	0.043	46%	0.46	C	S	.	.	H	α-helix	trans	-65.3	-36.1	178	57.1	0	0	0	0	112.6	E1187 L1195 Y1207 I1212	E1187-T1191 PolarHBondContact O-N 3.29Å; E1187-T1191 PolarHBondContact O-OG1 3.06Å; T1191-L1195 VanDerWaalsContact O-CB 3.31Å; T1191-L1195 WeakPolarHBondContact O-CB 3.46Å; T1191-L1195 PolarHBondContact O-N 3.32Å; T1191-Y1207 HydrophobicContact CG2-CE2 4.31Å; T1191-Y1207 VanDerWaalsContact OG1-CE2 3.32Å; T1191-Y1207 WeakPolarHBondContact OG1-CE2 3.19Å; T1191-I1212 HydrophobicContact CG2-CD1 4.38Å
1192	R	63.4	Low	60.2	Low	142 Å²	142	84.7 Å²	84.7	54%	0.536	44%	0.436	S	S	.	.	H	α-helix	trans	-64.3	-44.2	174.2	-82.8	-175.9	-174.1	112	-8.6	111.3	N1188 H1189 W1190 L1195 S1196 I1204	N1188-R1192 WeakPolarHBondContact O-CD 3.33Å; N1188-R1192 VanDerWaalsContact O-CG 3.28Å; N1188-R1192 WeakPolarHBondContact O-CG 3.37Å; N1188-R1192 PolarHBondContact O-NH1 2.81Å; H1189-R1192 PolarHBondContact O-N 3.24Å; W1190-R1192 VanDerWaalsContact C-N 3.34Å; W1190-R1192 PolarHBondContact O-N 3.32Å; R1192-L1195 PolarHBondContact O-N 3.07Å; R1192-S1196 WeakPolarHBondContact O-CB 3.34Å; R1192-S1196 PolarHBondContact O-N 3.43Å; R1192-S1196 PolarHBondContact O-OG 3.28Å; R1192-I1204 HydrophobicContact CB-CD1 4.5Å; R1192-I1204 HydrophobicContact CG-CD1 3.69Å
1193	H	67.1	Low	61.4	Low	103 Å²	103	84.4 Å²	84.4	48%	0.477	43%	0.425	S	S	.	.	H	α-helix	trans	-66	-38.2	-178.7	-168.1	-33.4	0	0	0	112.4	H1189 W1190 S1196 R1197	H1189-H1193 WeakPolarHBondContact O-CB 3.45Å; H1189-H1193 PolarHBondContact O-N 3.12Å; W1190-H1193 PolarHBondContact O-N 3.3Å; H1193-S1196 PolarHBondContact O-OG 2.94Å; H1193-S1196 VanDerWaalsContact O-OG 3.11Å; H1193-R1197 WeakPolarHBondContact O-CB 3.46Å; H1193-R1197 PolarHBondContact O-N 3.44Å
1194	I	64.7	Low	62.3	Low	30 Å²	30	83.5 Å²	83.5	15%	0.154	42%	0.415	C	S	.	.	H	α-helix	trans	-72.8	-40.9	176.4	-63.4	174.1	0	0	0	110.7	W1190 R1197 L1198 M1234 F1238	W1190-I1194 HydrophobicContact CD2-CD1 4.11Å; W1190-I1194 HydrophobicContact CG-CD1 4.39Å; W1190-I1194 HydrophobicContact CZ2-CD1 3.93Å; W1190-I1194 PolarHBondContact O-N 3.01Å; I1194-R1197 PolarHBondContact O-N 3.02Å; I1194-L1198 HydrophobicContact CG2-CD1 3.84Å; I1194-L1198 WeakPolarHBondContact O-CG 3.13Å; I1194-L1198 PolarHBondContact O-N 2.76Å; I1194-L1198 VanDerWaalsContact O-N 3.1Å; I1194-M1234 HydrophobicContact CG2-CE 4.06Å; I1194-F1238 HydrophobicContact CB-CE1 4.03Å; I1194-F1238 HydrophobicContact CG2-CE1 3.5Å; I1194-F1238 HydrophobicContact CG2-CZ 3.53Å
1195	L	66	Low	63.2	Low	5 Å²	5	82.6 Å²	82.6	3%	0.026	41%	0.41	C	S	.	.	H	α-helix	trans	-63.7	-43.2	177	-86	158.8	0	0	0	112.6	T1191 R1192 R1197 L1198 M1199 I1204 V1214	T1191-L1195 VanDerWaalsContact O-CB 3.31Å; T1191-L1195 WeakPolarHBondContact O-CB 3.46Å; T1191-L1195 PolarHBondContact O-N 3.32Å; R1192-L1195 PolarHBondContact O-N 3.07Å; L1195-R1197 VanDerWaalsContact C-N 3.28Å; L1195-R1197 PolarHBondContact O-N 3.4Å; L1195-L1198 PolarHBondContact O-N 3.03Å; L1195-M1199 HydrophobicContact CD2-CE 3.82Å; L1195-M1199 PolarHBondContact O-N 3.05Å; L1195-I1204 HydrophobicContact CD1-CD1 3.5Å; L1195-I1204 HydrophobicContact CD1-CG1 3.94Å; L1195-V1214 HydrophobicContact CD1-CG2 3.88Å; L1195-V1214 HydrophobicContact CD2-CG1 4.2Å; L1195-V1214 HydrophobicContact CD2-CG2 4.14Å
1196	S	66.5	Low	64.2	Low	67 Å²	67	83 Å²	83	47%	0.469	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-30.7	176.2	64	0	0	0	0	112.9	R1192 H1193	R1192-S1196 WeakPolarHBondContact O-CB 3.34Å; R1192-S1196 PolarHBondContact O-N 3.43Å; R1192-S1196 PolarHBondContact O-OG 3.28Å; H1193-S1196 PolarHBondContact O-OG 2.94Å; H1193-S1196 VanDerWaalsContact O-OG 3.11Å
1197	R	68.4	Low	65.3	Low	212 Å²	212	82.9 Å²	82.9	80%	0.8	39%	0.391	S	S	*	.	H	α-helix	trans	-72.8	-27.9	174.8	-138.8	179.3	-166.6	175.2	4	113.4	H1193 I1194 L1195	H1193-R1197 WeakPolarHBondContact O-CB 3.46Å; H1193-R1197 PolarHBondContact O-N 3.44Å; I1194-R1197 PolarHBondContact O-N 3.02Å; L1195-R1197 VanDerWaalsContact C-N 3.28Å; L1195-R1197 PolarHBondContact O-N 3.4Å
1198	L	62.8	Low	65.9	Low	32 Å²	32	81.3 Å²	81.3	17%	0.168	39%	0.392	C	S	.	.	H	α-helix	trans	-91	-33.1	178.9	-73	166.2	0	0	0	112.8	I1194 L1195 K1230 M1234 F1238	I1194-L1198 HydrophobicContact CG2-CD1 3.84Å; I1194-L1198 WeakPolarHBondContact O-CG 3.13Å; I1194-L1198 PolarHBondContact O-N 2.76Å; I1194-L1198 VanDerWaalsContact O-N 3.1Å; L1195-L1198 PolarHBondContact O-N 3.03Å; L1198-K1230 HydrophobicContact CD2-CD 3.83Å; L1198-K1230 HydrophobicContact CD2-CG 4.38Å; L1198-M1234 HydrophobicContact CD1-CE 4.18Å; L1198-M1234 HydrophobicContact CD1-SD 3.98Å; L1198-M1234 HydrophobicContact CD2-SD 4.04Å; L1198-F1238 HydrophobicContact CD1-CE2 4.39Å; L1198-F1238 HydrophobicContact CD1-CZ 3.76Å
1199	M	65.1	Low	66.4	Low	14 Å²	14	88.6 Å²	88.6	7%	0.069	43%	0.425	C	S	.	.			trans	-150.4	96.8	-176.8	-65.9	-177.8	-69	0	0	109.9	M1169 L1195 E1201 A1202 V1214 I1216 L1227 I1231	M1169-M1199 HydrophobicContact CE-CE 4.47Å; L1195-M1199 HydrophobicContact CD2-CE 3.82Å; L1195-M1199 PolarHBondContact O-N 3.05Å; M1199-E1201 PolarHBondContact O-N 3.4Å; M1199-A1202 HydrophobicContact CB-CB 3.47Å; M1199-A1202 VanDerWaalsContact CB-CB 3.47Å; M1199-A1202 HydrophobicContact CE-CB 3.83Å; M1199-A1202 HydrophobicContact CG-CB 4.37Å; M1199-A1202 PolarHBondContact O-N 2.9Å; M1199-A1202 HydrophobicContact SD-CB 4.11Å; M1199-V1214 HydrophobicContact CE-CG1 4.39Å; M1199-I1216 HydrophobicContact CE-CD1 4.38Å; M1199-I1216 HydrophobicContact CE-CG1 4.26Å; M1199-I1216 HydrophobicContact SD-CD1 4.15Å; M1199-I1216 HydrophobicContact SD-CG1 4.03Å; M1199-I1216 HydrophobicContact SD-CG2 4.14Å; M1199-L1227 HydrophobicContact CG-CD2 3.94Å; M1199-L1227 HydrophobicContact SD-CD2 4.36Å; M1199-I1231 HydrophobicContact CE-CD1 4.38Å
1200	P	63.1	Low	67	Low	121 Å²	121	88.1 Å²	88.1	79%	0.786	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-22.2	-178	24.7	-33.8	0	0	0	113.8
1201	E	65	Low	67.6	Low	147 Å²	147	85.4 Å²	85.4	69%	0.687	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	5.6	179	-59.8	-177.9	165	0	0	113.9	M1199 P1217	M1199-E1201 PolarHBondContact O-N 3.4Å; E1201-P1217 HydrophobicContact CB-CG 3.8Å; E1201-P1217 VanDerWaalsContact OE2-CG 3.31Å; E1201-P1217 WeakPolarHBondContact OE2-CG 3.44Å
1202	A	67.5	Low	68.3	Low	16 Å²	16	85.2 Å²	85.2	13%	0.132	41%	0.413	C	S	.	.			trans	-93.6	113.1	-175.7	0	0	0	0	0	113	M1199 V1214 A1215	M1199-A1202 HydrophobicContact CB-CB 3.47Å; M1199-A1202 VanDerWaalsContact CB-CB 3.47Å; M1199-A1202 HydrophobicContact CE-CB 3.83Å; M1199-A1202 HydrophobicContact CG-CB 4.37Å; M1199-A1202 PolarHBondContact O-N 2.9Å; M1199-A1202 HydrophobicContact SD-CB 4.11Å; A1202-V1214 HydrophobicContact CB-CG1 3.92Å; A1202-A1215 CarbonylContact C-O 3.45Å; A1202-A1215 VanDerWaalsContact CA-O 3.23Å; A1202-A1215 WeakPolarHBondContact CA-O 3.4Å
1203	E	68.9	Low	68.9	Low	142 Å²	142	80.9 Å²	80.9	66%	0.664	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	129.2	-179.8	-66.5	-175.9	161	0	0	112.5	T1205 V1214 A1215	E1203-T1205 VanDerWaalsContact C-N 3.35Å; E1203-T1205 PolarHBondContact O-N 3.19Å; E1203-V1214 WeakPolarHBondContact O-CA 3.45Å; E1203-A1215 PolarHBondContact N-O 3.05Å; E1203-A1215 VanDerWaalsContact N-O 3.11Å; E1203-A1215 PolarHBondContact O-N 3.37Å
1204	I	72	Confident	69.4	Low	42 Å²	42	76 Å²	76	22%	0.215	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	86.9	170.1	-51.1	-173.2	0	0	0	109.5	R1192 L1195 K1206 Y1207 I1212 H1213	R1192-I1204 HydrophobicContact CB-CD1 4.5Å; R1192-I1204 HydrophobicContact CG-CD1 3.69Å; L1195-I1204 HydrophobicContact CD1-CD1 3.5Å; L1195-I1204 HydrophobicContact CD1-CG1 3.94Å; I1204-K1206 VanDerWaalsContact C-N 3.34Å; I1204-K1206 PolarHBondContact O-N 3.49Å; I1204-Y1207 HydrophobicContact CG2-CD2 4.45Å; I1204-I1212 HydrophobicContact CG2-CG2 3.96Å; I1204-H1213 CarbonylContact C-O 3.44Å
1205	T	70.8	Confident	69.8	Low	67 Å²	67	75.7 Å²	75.7	41%	0.411	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	-34.8	-178	57.4	0	0	0	0	115	E1203 H1213 A1215	E1203-T1205 VanDerWaalsContact C-N 3.35Å; E1203-T1205 PolarHBondContact O-N 3.19Å; T1205-H1213 PolarHBondContact N-O 3.14Å; T1205-H1213 WeakPolarHBondContact OG1-CB 3.22Å; T1205-H1213 PolarHBondContact OG1-O 3.25Å; T1205-A1215 HydrophobicContact CG2-CB 3.59Å
1206	K	71	Confident	70.3	Confident	151 Å²	151	75.9 Å²	75.9	66%	0.657	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.7	135.1	174	-64.4	-169.3	177.4	-172	0	110.8	I1204 H1213	I1204-K1206 VanDerWaalsContact C-N 3.34Å; I1204-K1206 PolarHBondContact O-N 3.49Å; K1206-H1213 HydrophobicContact CB-CB 4.05Å; K1206-H1213 PolarHBondContact N-O 2.64Å; K1206-H1213 WeakPolarHBondContact O-CB 3.3Å; K1206-H1213 PolarHBondContact O-N 2.66Å
1207	Y	73.6	Confident	70.4	Confident	62 Å²	62	74.6 Å²	74.6	24%	0.243	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.4	169.3	-160.7	-85	0	0	0	108.3	K1173 N1188 T1191 I1204 I1212	K1173-Y1207 VanDerWaalsContact CE-OH 3.29Å; K1173-Y1207 WeakPolarHBondContact CE-OH 3.46Å; K1173-Y1207 PolarHBondContact NZ-OH 3.19Å; N1188-Y1207 WeakPolarHBondContact OD1-CD1 3.47Å; T1191-Y1207 HydrophobicContact CG2-CE2 4.31Å; T1191-Y1207 VanDerWaalsContact OG1-CE2 3.32Å; T1191-Y1207 WeakPolarHBondContact OG1-CE2 3.19Å; I1204-Y1207 HydrophobicContact CG2-CD2 4.45Å; Y1207-I1212 HydrophobicContact CD2-CB 4.47Å; Y1207-I1212 HydrophobicContact CD2-CD1 4.25Å; Y1207-I1212 HydrophobicContact CD2-CG1 3.92Å; Y1207-I1212 HydrophobicContact CD2-CG2 3.91Å; Y1207-I1212 HydrophobicContact CE2-CD1 3.59Å; Y1207-I1212 HydrophobicContact CE2-CG1 3.72Å; Y1207-I1212 HydrophobicContact CE2-CG2 4.26Å
1208	G	67.7	Low	70.2	Confident	31 Å²	31	68 Å²	68	32%	0.32	35%	0.35	S	S	.	.			trans	-132.9	159.3	179.6	0	0	0	0	0	111.4	E1210 K1211	G1208-E1210 VanDerWaalsContact C-N 3.29Å; G1208-E1210 PolarHBondContact O-N 3.4Å; G1208-K1211 WeakPolarHBondContact CA-O 3.39Å; G1208-K1211 PolarHBondContact N-O 3.38Å; G1208-K1211 PolarHBondContact O-N 3.39Å; G1208-K1211 VanDerWaalsContact O-N 3.14Å
1209	Q	66.4	Low	70.4	Confident	189 Å²	189	68.4 Å²	68.4	88%	0.883	35%	0.353	S	S	*	.	S	Bend	trans	-52.5	-42.6	-174.2	-73.4	173.2	-34.1	0	0	113.2	K1173	K1173-Q1209 WeakPolarHBondContact CD-O 3.33Å
1210	E	70.7	Confident	70.6	Confident	128 Å²	128	73.4 Å²	73.4	60%	0.598	38%	0.38	S	S	*	.	S	Bend	trans	-95.3	-19	177.7	-61.6	-179.8	163.7	0	0	114.6	R1172 K1173 G1208	R1172-E1210 WeakPolarHBondContact CA-O 3.38Å; K1173-E1210 PolarHBondContact N-O 2.93Å; G1208-E1210 VanDerWaalsContact C-N 3.29Å; G1208-E1210 PolarHBondContact O-N 3.4Å
1211	K	76.2	Confident	70.9	Confident	86 Å²	86	75.5 Å²	75.5	37%	0.374	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	131.8	-160	-62.1	-179.9	-174.7	85.7	0	113.1	L1171 G1208	L1171-K1211 CarbonylContact O-C 3.57Å; L1171-K1211 VanDerWaalsContact O-CA 3.24Å; L1171-K1211 WeakPolarHBondContact O-CA 3.25Å; G1208-K1211 WeakPolarHBondContact CA-O 3.39Å; G1208-K1211 PolarHBondContact N-O 3.38Å; G1208-K1211 PolarHBondContact O-N 3.39Å; G1208-K1211 VanDerWaalsContact O-N 3.14Å
1212	I	77.8	Confident	71.4	Confident	2 Å²	2	77.1 Å²	77.1	1%	0.01	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	129.1	176.6	-51.4	170.8	0	0	0	109.1	K1170 L1171 T1191 I1204 Y1207 V1214	K1170-I1212 CarbonylContact C-O 3.6Å; K1170-I1212 VanDerWaalsContact CA-O 3.3Å; K1170-I1212 WeakPolarHBondContact CA-O 3.35Å; L1171-I1212 HydrophobicContact CB-CB 4.23Å; L1171-I1212 PolarHBondContact N-O 3.08Å; L1171-I1212 PolarHBondContact O-N 3.08Å; T1191-I1212 HydrophobicContact CG2-CD1 4.38Å; I1204-I1212 HydrophobicContact CG2-CG2 3.96Å; Y1207-I1212 HydrophobicContact CD2-CB 4.47Å; Y1207-I1212 HydrophobicContact CD2-CD1 4.25Å; Y1207-I1212 HydrophobicContact CD2-CG1 3.92Å; Y1207-I1212 HydrophobicContact CD2-CG2 3.91Å; Y1207-I1212 HydrophobicContact CE2-CD1 3.59Å; Y1207-I1212 HydrophobicContact CE2-CG1 3.72Å; Y1207-I1212 HydrophobicContact CE2-CG2 4.26Å; I1212-V1214 HydrophobicContact CG2-CG2 4.26Å
1213	H	76.2	Confident	71.7	Confident	51 Å²	51	80.4 Å²	80.4	24%	0.236	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	112	-179.3	-66.5	-94.6	0	0	0	111.4	I1204 T1205 K1206	I1204-H1213 CarbonylContact C-O 3.44Å; T1205-H1213 PolarHBondContact N-O 3.14Å; T1205-H1213 WeakPolarHBondContact OG1-CB 3.22Å; T1205-H1213 PolarHBondContact OG1-O 3.25Å; K1206-H1213 HydrophobicContact CB-CB 4.05Å; K1206-H1213 PolarHBondContact N-O 2.64Å; K1206-H1213 WeakPolarHBondContact O-CB 3.3Å; K1206-H1213 PolarHBondContact O-N 2.66Å
1214	V	76.4	Confident	72	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.006	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	130.8	179.6	-174.9	0	0	0	0	109.7	K1168 M1169 L1195 M1199 A1202 E1203 I1212 I1216	K1168-V1214 CarbonylContact C-O 3.51Å; K1168-V1214 WeakPolarHBondContact CA-O 3.26Å; M1169-V1214 HydrophobicContact CB-CB 4.4Å; M1169-V1214 HydrophobicContact CE-CB 4.19Å; M1169-V1214 HydrophobicContact CE-CG2 4.17Å; M1169-V1214 PolarHBondContact N-O 3.06Å; M1169-V1214 PolarHBondContact O-N 3.03Å; L1195-V1214 HydrophobicContact CD1-CG2 3.88Å; L1195-V1214 HydrophobicContact CD2-CG1 4.2Å; L1195-V1214 HydrophobicContact CD2-CG2 4.14Å; M1199-V1214 HydrophobicContact CE-CG1 4.39Å; A1202-V1214 HydrophobicContact CB-CG1 3.92Å; E1203-V1214 WeakPolarHBondContact O-CA 3.45Å; I1212-V1214 HydrophobicContact CG2-CG2 4.26Å; V1214-I1216 HydrophobicContact CG1-CG1 4.4Å
1215	A	74.3	Confident	72.4	Confident	23 Å²	23	81.5 Å²	81.5	19%	0.19	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.7	166.3	0	0	0	0	0	109.4	A1202 E1203 T1205	A1202-A1215 CarbonylContact C-O 3.45Å; A1202-A1215 VanDerWaalsContact CA-O 3.23Å; A1202-A1215 WeakPolarHBondContact CA-O 3.4Å; E1203-A1215 PolarHBondContact N-O 3.05Å; E1203-A1215 VanDerWaalsContact N-O 3.11Å; E1203-A1215 PolarHBondContact O-N 3.37Å; T1205-A1215 HydrophobicContact CG2-CB 3.59Å
1216	I	75.7	Confident	72.7	Confident	10 Å²	10	86.5 Å²	86.5	5%	0.051	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.7	176.5	-54.6	174	0	0	0	106.2	G1166 F1167 M1169 M1199 V1214 V1219 L1245	G1166-I1216 CarbonylContact C-O 3.45Å; G1166-I1216 VanDerWaalsContact CA-O 3.23Å; G1166-I1216 WeakPolarHBondContact CA-O 3.4Å; F1167-I1216 HydrophobicContact CB-CB 4.43Å; F1167-I1216 PolarHBondContact N-O 2.96Å; F1167-I1216 PolarHBondContact O-N 2.89Å; M1169-I1216 HydrophobicContact CB-CD1 4.04Å; M1199-I1216 HydrophobicContact CE-CD1 4.38Å; M1199-I1216 HydrophobicContact CE-CG1 4.26Å; M1199-I1216 HydrophobicContact SD-CD1 4.15Å; M1199-I1216 HydrophobicContact SD-CG1 4.03Å; M1199-I1216 HydrophobicContact SD-CG2 4.14Å; V1214-I1216 HydrophobicContact CG1-CG1 4.4Å; I1216-V1219 HydrophobicContact CG2-CG2 4.33Å; I1216-L1245 HydrophobicContact CD1-CD1 4.1Å
1217	P	68.4	Low	72.8	Confident	39 Å²	39	81 Å²	81	25%	0.253	39%	0.386	S	S	.	.			trans	-64	176.3	176.5	24.8	-33.4	0	0	0	113.3	E1201 V1219	E1201-P1217 HydrophobicContact CB-CG 3.8Å; E1201-P1217 VanDerWaalsContact OE2-CG 3.31Å; E1201-P1217 WeakPolarHBondContact OE2-CG 3.44Å; P1217-V1219 HydrophobicContact CG-CG2 4.2Å; P1217-V1219 PolarHBondContact O-N 3.1Å; P1217-V1219 VanDerWaalsContact O-N 3.08Å
1218	L	64.5	Low	73	Confident	74 Å²	74	79.8 Å²	79.8	39%	0.387	38%	0.383	S	S	.	.			trans	-72.9	97.6	174.4	-104.8	134.1	0	0	0	109	L1165	L1165-L1218 WeakPolarHBondContact O-CD1 3.42Å
1219	V	67.5	Low	73.7	Confident	40 Å²	40	80 Å²	80	24%	0.242	38%	0.382	C	S	.	.			trans	-112.4	145.1	175.4	-150.9	0	0	0	0	109.9	I1216 P1217 I1223	I1216-V1219 HydrophobicContact CG2-CG2 4.33Å; P1217-V1219 HydrophobicContact CG-CG2 4.2Å; P1217-V1219 PolarHBondContact O-N 3.1Å; P1217-V1219 VanDerWaalsContact O-N 3.08Å; V1219-I1223 HydrophobicContact CG1-CB 3.7Å; V1219-I1223 HydrophobicContact CG1-CD1 3.91Å; V1219-I1223 HydrophobicContact CG1-CG1 4.38Å; V1219-I1223 HydrophobicContact CG1-CG2 3.64Å
1220	D	67.8	Low	74.2	Confident	120 Å²	120	76.6 Å²	76.6	64%	0.642	36%	0.364	S	S	*	.			trans	-51.4	142.4	178	-101.2	-17.2	0	0	0	112.9	K1222 I1223 L1224	D1220-K1222 PolarHBondContact O-N 3.26Å; D1220-I1223 HydrophobicContact CB-CD1 4.19Å; D1220-I1223 HydrophobicContact CB-CG1 4.23Å; D1220-I1223 PolarHBondContact O-N 2.86Å; D1220-L1224 PolarHBondContact O-N 3.27Å
1221	F	70	Confident	74.4	Confident	165 Å²	165	71 Å²	71	72%	0.724	34%	0.338	S	S	*	.	H	α-helix	trans	-55.6	-30.6	-177.8	-126.5	-79.9	0	0	0	113.1	R1225	F1221-R1225 WeakPolarHBondContact O-CB 3.47Å; F1221-R1225 PolarHBondContact O-N 3.36Å
1222	K	75.8	Confident	74.5	Confident	180 Å²	180	71.8 Å²	71.8	78%	0.783	34%	0.344	S	S	*	.	H	α-helix	trans	-65.6	-41.6	174	-69.9	-179.8	179	175	0	112.6	D1220 K1226	D1220-K1222 PolarHBondContact O-N 3.26Å; K1222-K1226 PolarHBondContact O-N 2.98Å
1223	I	74.2	Confident	74.6	Confident	85 Å²	85	82 Å²	82	44%	0.436	38%	0.382	S	S	.	.	H	α-helix	trans	-77.3	-43	-179.3	-55	174.5	0	0	0	109.5	V1219 D1220 R1225 K1226 L1227	V1219-I1223 HydrophobicContact CG1-CB 3.7Å; V1219-I1223 HydrophobicContact CG1-CD1 3.91Å; V1219-I1223 HydrophobicContact CG1-CG1 4.38Å; V1219-I1223 HydrophobicContact CG1-CG2 3.64Å; D1220-I1223 HydrophobicContact CB-CD1 4.19Å; D1220-I1223 HydrophobicContact CB-CG1 4.23Å; D1220-I1223 PolarHBondContact O-N 2.86Å; I1223-R1225 VanDerWaalsContact C-N 3.29Å; I1223-R1225 PolarHBondContact O-N 2.64Å; I1223-K1226 WeakPolarHBondContact O-CB 3.32Å; I1223-K1226 PolarHBondContact O-N 3.25Å; I1223-K1226 VanDerWaalsContact O-N 3.08Å; I1223-L1227 HydrophobicContact CG2-CD1 4.12Å; I1223-L1227 PolarHBondContact O-N 3.37Å
1224	L	75.6	Confident	74.3	Confident	4 Å²	4	81.1 Å²	81.1	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-54.8	-43.3	173.4	-177	66.5	0	0	0	111.8	F1167 D1220 K1226 L1227 I1228 L1245	F1167-L1224 HydrophobicContact CD1-CD2 4.45Å; F1167-L1224 HydrophobicContact CD2-CD1 4.36Å; F1167-L1224 HydrophobicContact CD2-CD2 4.07Å; F1167-L1224 HydrophobicContact CE1-CD2 4.06Å; F1167-L1224 HydrophobicContact CE2-CD2 3.66Å; F1167-L1224 HydrophobicContact CG-CD2 4.46Å; F1167-L1224 HydrophobicContact CZ-CD2 3.64Å; D1220-L1224 PolarHBondContact O-N 3.27Å; L1224-K1226 PolarHBondContact O-N 2.85Å; L1224-L1227 PolarHBondContact O-N 3.36Å; L1224-I1228 HydrophobicContact CD1-CD1 4.19Å; L1224-I1228 HydrophobicContact CD1-CG1 4.38Å; L1224-I1228 HydrophobicContact CG-CD1 3.85Å; L1224-I1228 HydrophobicContact CG-CG1 4.45Å; L1224-I1228 VanDerWaalsContact O-CG1 3.28Å; L1224-I1228 WeakPolarHBondContact O-CG1 3.5Å; L1224-I1228 PolarHBondContact O-N 3.13Å; L1224-L1245 HydrophobicContact CD1-CD2 4.3Å; L1224-L1245 HydrophobicContact CD2-CD2 4.29Å
1225	R	79.1	Confident	74.2	Confident	204 Å²	204	82.1 Å²	82.1	77%	0.77	38%	0.384	S	S	*	.	H	α-helix	trans	-62.3	-38.9	176.2	-172.4	176.5	179.9	-177.3	-0.6	112.8	F1221 I1223 A1229	F1221-R1225 WeakPolarHBondContact O-CB 3.47Å; F1221-R1225 PolarHBondContact O-N 3.36Å; I1223-R1225 VanDerWaalsContact C-N 3.29Å; I1223-R1225 PolarHBondContact O-N 2.64Å; R1225-A1229 WeakPolarHBondContact O-CB 3.42Å; R1225-A1229 PolarHBondContact O-N 3.36Å
1226	K	78.2	Confident	73.9	Confident	172 Å²	172	83.9 Å²	83.9	75%	0.748	40%	0.404	S	S	*	.	H	α-helix	trans	-67.5	-40.2	174.4	-71.6	-175.9	176.7	-175.2	0	111.9	K1222 I1223 L1224 K1230	K1222-K1226 PolarHBondContact O-N 2.98Å; I1223-K1226 WeakPolarHBondContact O-CB 3.32Å; I1223-K1226 PolarHBondContact O-N 3.25Å; I1223-K1226 VanDerWaalsContact O-N 3.08Å; L1224-K1226 PolarHBondContact O-N 2.85Å; K1226-K1230 PolarHBondContact O-N 3.02Å
1227	L	73.4	Confident	73.6	Confident	36 Å²	36	88.8 Å²	88.8	19%	0.188	43%	0.427	C	S	.	.	H	α-helix	trans	-63.8	-48.8	176.9	-80.6	163.3	0	0	0	111.9	M1199 I1223 L1224 A1229 K1230 I1231	M1199-L1227 HydrophobicContact CG-CD2 3.94Å; M1199-L1227 HydrophobicContact SD-CD2 4.36Å; I1223-L1227 HydrophobicContact CG2-CD1 4.12Å; I1223-L1227 PolarHBondContact O-N 3.37Å; L1224-L1227 PolarHBondContact O-N 3.36Å; L1227-A1229 PolarHBondContact O-N 2.85Å; L1227-K1230 WeakPolarHBondContact O-CB 3.43Å; L1227-K1230 PolarHBondContact O-N 2.81Å; L1227-K1230 VanDerWaalsContact O-N 3.08Å; L1227-I1231 WeakPolarHBondContact O-CG1 3.29Å; L1227-I1231 PolarHBondContact O-N 3.01Å
1228	I	77.7	Confident	73.3	Confident	35 Å²	35	87.5 Å²	87.5	18%	0.179	42%	0.417	C	S	.	.	H	α-helix	trans	-58.1	-48.3	178.4	-67.2	163.7	0	0	0	110.6	L1224 K1230 I1231 E1232 Y1243 L1245	L1224-I1228 HydrophobicContact CD1-CD1 4.19Å; L1224-I1228 HydrophobicContact CD1-CG1 4.38Å; L1224-I1228 HydrophobicContact CG-CD1 3.85Å; L1224-I1228 HydrophobicContact CG-CG1 4.45Å; L1224-I1228 VanDerWaalsContact O-CG1 3.28Å; L1224-I1228 WeakPolarHBondContact O-CG1 3.5Å; L1224-I1228 PolarHBondContact O-N 3.13Å; I1228-K1230 PolarHBondContact O-N 3.42Å; I1228-K1230 VanDerWaalsContact O-N 3.13Å; I1228-I1231 PolarHBondContact O-N 3.05Å; I1228-E1232 HydrophobicContact CG2-CG 4.13Å; I1228-E1232 WeakPolarHBondContact O-CG 2.76Å; I1228-E1232 PolarHBondContact O-N 2.91Å; I1228-Y1243 HydrophobicContact CG2-CE2 4.16Å; I1228-Y1243 VanDerWaalsContact CG2-OH 3.24Å; I1228-Y1243 WeakPolarHBondContact CG2-OH 3.37Å; I1228-L1245 HydrophobicContact CD1-CD2 3.73Å; I1228-L1245 HydrophobicContact CG1-CD2 4.43Å
1229	A	81	Confident	73.4	Confident	37 Å²	37	85.5 Å²	85.5	31%	0.306	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-21.6	178.9	0	0	0	0	0	113.9	R1225 L1227 R1233	R1225-A1229 WeakPolarHBondContact O-CB 3.42Å; R1225-A1229 PolarHBondContact O-N 3.36Å; L1227-A1229 PolarHBondContact O-N 2.85Å; A1229-R1233 WeakPolarHBondContact O-CD 3.36Å; A1229-R1233 WeakPolarHBondContact O-CG 3.41Å
1230	K	77.5	Confident	73.6	Confident	117 Å²	117	83.7 Å²	83.7	51%	0.509	40%	0.4	S	S	.	.	H	α-helix	trans	-82.7	-40.3	172.3	-167	175.1	-178.1	-177.4	0	111.6	L1198 K1226 L1227 I1228 R1233 M1234	L1198-K1230 HydrophobicContact CD2-CD 3.83Å; L1198-K1230 HydrophobicContact CD2-CG 4.38Å; K1226-K1230 PolarHBondContact O-N 3.02Å; L1227-K1230 WeakPolarHBondContact O-CB 3.43Å; L1227-K1230 PolarHBondContact O-N 2.81Å; L1227-K1230 VanDerWaalsContact O-N 3.08Å; I1228-K1230 PolarHBondContact O-N 3.42Å; I1228-K1230 VanDerWaalsContact O-N 3.13Å; K1230-R1233 PolarHBondContact O-N 3.26Å; K1230-M1234 HydrophobicContact CG-SD 4.46Å; K1230-M1234 PolarHBondContact O-N 3.38Å
1231	I	75.7	Confident	74	Confident	10 Å²	10	82 Å²	82	5%	0.051	39%	0.391	C	S	.	.	H	α-helix	trans	-65.2	-43.2	176.4	-67	163.7	0	0	0	110.9	M1169 M1199 L1227 I1228 R1233 M1234 L1235	M1169-I1231 HydrophobicContact CE-CD1 4.18Å; M1169-I1231 HydrophobicContact SD-CD1 3.98Å; M1169-I1231 HydrophobicContact SD-CG2 4.12Å; M1199-I1231 HydrophobicContact CE-CD1 4.38Å; L1227-I1231 WeakPolarHBondContact O-CG1 3.29Å; L1227-I1231 PolarHBondContact O-N 3.01Å; I1228-I1231 PolarHBondContact O-N 3.05Å; I1231-R1233 VanDerWaalsContact C-N 3.26Å; I1231-R1233 PolarHBondContact O-N 3.36Å; I1231-M1234 CarbonylContact O-C 3.56Å; I1231-M1234 PolarHBondContact O-N 3.48Å; I1231-L1235 HydrophobicContact CG2-CD1 3.86Å; I1231-L1235 WeakPolarHBondContact O-CD1 3.43Å; I1231-L1235 PolarHBondContact O-N 3.38Å; I1231-L1235 VanDerWaalsContact O-N 3.09Å
1232	E	77.1	Confident	74.6	Confident	103 Å²	103	75.6 Å²	75.6	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-55.7	-38.8	176.9	-77.5	176.6	150.8	0	0	112.9	I1228 M1234 Y1243	I1228-E1232 HydrophobicContact CG2-CG 4.13Å; I1228-E1232 WeakPolarHBondContact O-CG 2.76Å; I1228-E1232 PolarHBondContact O-N 2.91Å; E1232-M1234 VanDerWaalsContact C-N 3.35Å; E1232-Y1243 HydrophobicContact CG-CE1 3.59Å; E1232-Y1243 PolarHBondContact OE1-OH 3.41Å
1233	R	80.2	Confident	74.9	Confident	215 Å²	215	70.3 Å²	70.3	81%	0.811	34%	0.342	S	S	*	.	H	α-helix	trans	-71.3	-29.1	177.1	-68	173.3	-172.6	178.4	0.4	113.3	A1229 K1230 I1231	A1229-R1233 WeakPolarHBondContact O-CD 3.36Å; A1229-R1233 WeakPolarHBondContact O-CG 3.41Å; K1230-R1233 PolarHBondContact O-N 3.26Å; I1231-R1233 VanDerWaalsContact C-N 3.26Å; I1231-R1233 PolarHBondContact O-N 3.36Å
1234	M	71	Confident	75.3	Confident	34 Å²	34	70.2 Å²	70.2	17%	0.167	35%	0.346	C	S	.	.	H	α-helix	trans	-95.6	-0.1	-176.8	-65.5	178.4	75	0	0	113.2	I1194 L1198 K1230 I1231 E1232 G1236 E1237 F1238	I1194-M1234 HydrophobicContact CG2-CE 4.06Å; L1198-M1234 HydrophobicContact CD1-CE 4.18Å; L1198-M1234 HydrophobicContact CD1-SD 3.98Å; L1198-M1234 HydrophobicContact CD2-SD 4.04Å; K1230-M1234 HydrophobicContact CG-SD 4.46Å; K1230-M1234 PolarHBondContact O-N 3.38Å; I1231-M1234 CarbonylContact O-C 3.56Å; I1231-M1234 PolarHBondContact O-N 3.48Å; E1232-M1234 VanDerWaalsContact C-N 3.35Å; M1234-G1236 PolarHBondContact O-N 3.24Å; M1234-E1237 WeakPolarHBondContact CE-OE2 3.29Å; M1234-E1237 WeakPolarHBondContact O-CA 3.25Å; M1234-E1237 WeakPolarHBondContact O-CB 3.42Å; M1234-E1237 PolarHBondContact O-N 2.85Å; M1234-F1238 HydrophobicContact CB-CD2 4.05Å; M1234-F1238 HydrophobicContact CB-CE2 3.69Å; M1234-F1238 WeakPolarHBondContact O-CD2 3.44Å; M1234-F1238 PolarHBondContact O-N 3.47Å
1235	L	72.7	Confident	75.6	Confident	22 Å²	22	72.6 Å²	72.6	12%	0.115	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-38.4	-173.3	-126.5	82.7	0	0	0	113.2	I1231 F1238 C1240 Y1243	I1231-L1235 HydrophobicContact CG2-CD1 3.86Å; I1231-L1235 WeakPolarHBondContact O-CD1 3.43Å; I1231-L1235 PolarHBondContact O-N 3.38Å; I1231-L1235 VanDerWaalsContact O-N 3.09Å; L1235-F1238 PolarHBondContact O-N 3.36Å; L1235-C1240 HydrophobicContact CG-CB 4.36Å; L1235-C1240 PolarHBondContact O-N 3.16Å; L1235-C1240 VanDerWaalsContact O-N 3.16Å; L1235-C1240 VanDerWaalsContact O-O 3.13Å; L1235-Y1243 HydrophobicContact CD1-CD1 3.94Å; L1235-Y1243 HydrophobicContact CD1-CG 4.41Å; L1235-Y1243 HydrophobicContact CD2-CD1 4.21Å
1236	G	67.8	Low	75.5	Confident	60 Å²	60	64.6 Å²	64.6	62%	0.619	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-35.6	174.9	0	0	0	0	0	113.6	M1234 F1238 A1239	M1234-G1236 PolarHBondContact O-N 3.24Å; G1236-F1238 VanDerWaalsContact C-N 3.29Å; G1236-F1238 PolarHBondContact O-N 2.93Å; G1236-A1239 PolarHBondContact O-N 3.43Å
1237	E	69.4	Low	75.4	Confident	113 Å²	113	58.9 Å²	58.9	53%	0.528	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-30.2	174.6	-59	177.6	-179.7	0	0	111.6	W1190 M1234 A1239	W1190-E1237 WeakPolarHBondContact CH2-O 3.34Å; M1234-E1237 WeakPolarHBondContact CE-OE2 3.29Å; M1234-E1237 WeakPolarHBondContact O-CA 3.25Å; M1234-E1237 WeakPolarHBondContact O-CB 3.42Å; M1234-E1237 PolarHBondContact O-N 2.85Å; E1237-A1239 PolarHBondContact O-N 2.9Å
1238	F	63.3	Low	75.4	Confident	12 Å²	12	57.2 Å²	57.2	5%	0.053	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	3.9	176.5	-71.8	-68.6	0	0	0	114.3	I1194 L1198 M1234 L1235 G1236 C1240	I1194-F1238 HydrophobicContact CB-CE1 4.03Å; I1194-F1238 HydrophobicContact CG2-CE1 3.5Å; I1194-F1238 HydrophobicContact CG2-CZ 3.53Å; L1198-F1238 HydrophobicContact CD1-CE2 4.39Å; L1198-F1238 HydrophobicContact CD1-CZ 3.76Å; M1234-F1238 HydrophobicContact CB-CD2 4.05Å; M1234-F1238 HydrophobicContact CB-CE2 3.69Å; M1234-F1238 WeakPolarHBondContact O-CD2 3.44Å; M1234-F1238 PolarHBondContact O-N 3.47Å; L1235-F1238 PolarHBondContact O-N 3.36Å; G1236-F1238 VanDerWaalsContact C-N 3.29Å; G1236-F1238 PolarHBondContact O-N 2.93Å; F1238-C1240 HydrophobicContact CB-CB 4.05Å; F1238-C1240 PolarHBondContact O-N 3.23Å; F1238-C1240 PolarHBondContact O-SG 3.39Å
1239	A	67.3	Low	75.5	Confident	32 Å²	32	57.2 Å²	57.2	26%	0.264	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	37.9	-167.6	0	0	0	0	0	112.2	K1173 M1174 G1236 E1237	K1173-A1239 CarbonylContact C-O 3.53Å; K1173-A1239 WeakPolarHBondContact CA-O 3.24Å; M1174-A1239 PolarHBondContact N-O 3.47Å; G1236-A1239 PolarHBondContact O-N 3.43Å; E1237-A1239 PolarHBondContact O-N 2.9Å
1240	C	71.8	Confident	75.3	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.014	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.2	-174.6	-73.9	0	0	0	0	111.7	L1171 R1172 L1235 F1238	L1171-C1240 HydrophobicContact CB-CB 4.44Å; R1172-C1240 CarbonylContact O-C 3.57Å; R1172-C1240 WeakPolarHBondContact O-CA 3.42Å; R1172-C1240 WeakPolarHBondContact O-CB 3.5Å; L1235-C1240 HydrophobicContact CG-CB 4.36Å; L1235-C1240 PolarHBondContact O-N 3.16Å; L1235-C1240 VanDerWaalsContact O-N 3.16Å; L1235-C1240 VanDerWaalsContact O-O 3.13Å; F1238-C1240 HydrophobicContact CB-CB 4.05Å; F1238-C1240 PolarHBondContact O-N 3.23Å; F1238-C1240 PolarHBondContact O-SG 3.39Å
1241	D	75.8	Confident	75.2	Confident	83 Å²	83	53.9 Å²	53.9	44%	0.444	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-44.3	178.9	156.2	68.8	0	0	0	112.1	R1172 M1174	R1172-D1241 WeakPolarHBondContact CD-OD2 3.29Å; R1172-D1241 IonicContact CZ-OD2 3.64Å; R1172-D1241 IonicContact NE-OD2 3.67Å; R1172-D1241 IonicContact NH1-OD2 2.87Å; R1172-D1241 PolarHBondContact NH1-OD2 3.25Å; R1172-D1241 PolarHBondContact O-N 2.89Å; M1174-D1241 HydrophobicContact CG-CB 4.15Å
1242	S	81.8	Confident	75.3	Confident	31 Å²	31	55.1 Å²	55.1	22%	0.217	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	153.8	-171.7	47.1	0	0	0	0	112.8	R1172	R1172-S1242 PolarHBondContact N-O 2.68Å; R1172-S1242 PolarHBondContact NE-OG 2.94Å; R1172-S1242 PolarHBondContact NH1-OG 3.33Å
1243	Y	83.4	Confident	75.3	Confident	69 Å²	69	50.2 Å²	50.2	27%	0.271	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	148.1	173.6	77.9	-78.9	0	0	0	111.5	K1170 I1228 E1232 L1235	K1170-Y1243 CarbonylContact O-C 3.23Å; K1170-Y1243 VanDerWaalsContact O-CA 3.3Å; K1170-Y1243 WeakPolarHBondContact O-CA 3.46Å; I1228-Y1243 HydrophobicContact CG2-CE2 4.16Å; I1228-Y1243 VanDerWaalsContact CG2-OH 3.24Å; I1228-Y1243 WeakPolarHBondContact CG2-OH 3.37Å; E1232-Y1243 HydrophobicContact CG-CE1 3.59Å; E1232-Y1243 PolarHBondContact OE1-OH 3.41Å; L1235-Y1243 HydrophobicContact CD1-CD1 3.94Å; L1235-Y1243 HydrophobicContact CD1-CG 4.41Å; L1235-Y1243 HydrophobicContact CD2-CD1 4.21Å
1244	V	82.2	Confident	75.1	Confident	83 Å²	83	41 Å²	41	50%	0.503	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	105.7	174.5	-179.9	0	0	0	0	108.4	M1169 K1170	M1169-V1244 CarbonylContact C-O 3.46Å; M1169-V1244 WeakPolarHBondContact CA-O 3.35Å; K1170-V1244 HydrophobicContact CB-CB 4.33Å; K1170-V1244 PolarHBondContact N-O 3.17Å; K1170-V1244 PolarHBondContact O-N 3.02Å
1245	L	82.3	Confident	75.3	Confident	55 Å²	55	44.8 Å²	44.8	29%	0.288	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	129.3	169.3	-167.2	70.6	0	0	0	109.6	F1167 M1169 I1216 L1224 I1228	F1167-L1245 HydrophobicContact CB-CD1 3.79Å; F1167-L1245 HydrophobicContact CB-CG 4.33Å; F1167-L1245 HydrophobicContact CD1-CD2 4.38Å; F1167-L1245 HydrophobicContact CD1-CG 4.41Å; M1169-L1245 HydrophobicContact CB-CD1 4.06Å; I1216-L1245 HydrophobicContact CD1-CD1 4.1Å; L1224-L1245 HydrophobicContact CD1-CD2 4.3Å; L1224-L1245 HydrophobicContact CD2-CD2 4.29Å; I1228-L1245 HydrophobicContact CD1-CD2 3.73Å; I1228-L1245 HydrophobicContact CG1-CD2 4.43Å
1246	S	75.7	Confident	75.4	Confident	35 Å²	35	47.1 Å²	47.1	25%	0.245	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136.6	177.2	51.9	0	0	0	0	110.5	F1167 K1168	F1167-S1246 CarbonylContact C-O 3.53Å; F1167-S1246 WeakPolarHBondContact CA-O 3.17Å; K1168-S1246 PolarHBondContact N-O 2.99Å; K1168-S1246 PolarHBondContact O-N 3.41Å; K1168-S1246 PolarHBondContact O-OG 3.38Å
1247	S	76.1	Confident	75.7	Confident	52 Å²	52	45.2 Å²	45.2	36%	0.364	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	156.5	167.2	46	0	0	0	0	110.5	T1249	S1247-T1249 PolarHBondContact O-N 3.36Å
1248	A	74.7	Confident	75.7	Confident	2 Å²	2	41.2 Å²	41.2	2%	0.017	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-60.7	123.7	164.9	0	0	0	0	0	109.9	L1165 G1166	L1165-A1248 HydrophobicContact CB-CB 3.62Å; L1165-A1248 HydrophobicContact CD1-CB 4.45Å; G1166-A1248 PolarHBondContact O-N 2.96Å
1249	T	78.6	Confident	76	Confident	34 Å²	34	45 Å²	45	21%	0.209	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-78.3	157.9	175.2	52.9	0	0	0	0	110.6	S1247 E1251 Q1252 V1253	S1247-T1249 PolarHBondContact O-N 3.36Å; T1249-E1251 PolarHBondContact O-N 3.49Å; T1249-E1251 VanDerWaalsContact O-N 3.11Å; T1249-Q1252 PolarHBondContact O-N 3.31Å; T1249-Q1252 PolarHBondContact OG1-NE2 3.17Å; T1249-V1253 PolarHBondContact O-N 3.5Å
1250	L	77.6	Confident	75.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-54.8	-31.3	174	180	68.3	0	0	0	112.8	Y977 A1135 I1142 I1144 F1156 Q1252 V1253 V1254	Y977-L1250 HydrophobicContact CD2-CD2 4.4Å; Y977-L1250 HydrophobicContact CG-CD2 4.35Å; A1135-L1250 HydrophobicContact CB-CD2 3.55Å; I1142-L1250 HydrophobicContact CD1-CD1 3.75Å; I1142-L1250 HydrophobicContact CD1-CD2 3.84Å; I1142-L1250 HydrophobicContact CD1-CG 4.38Å; I1142-L1250 HydrophobicContact CG2-CD1 4.29Å; I1142-L1250 HydrophobicContact CG2-CD2 4.26Å; I1144-L1250 HydrophobicContact CD1-CD1 4.45Å; F1156-L1250 HydrophobicContact CD2-CB 4.4Å; F1156-L1250 HydrophobicContact CD2-CD1 4.13Å; F1156-L1250 HydrophobicContact CE2-CB 3.88Å; F1156-L1250 HydrophobicContact CE2-CD1 4.27Å; L1250-Q1252 VanDerWaalsContact C-N 3.33Å; L1250-Q1252 PolarHBondContact O-N 3.16Å; L1250-V1253 WeakPolarHBondContact O-CB 3.33Å; L1250-V1253 PolarHBondContact O-N 2.86Å; L1250-V1254 HydrophobicContact CD1-CG2 4.36Å; L1250-V1254 HydrophobicContact CG-CG2 4.25Å; L1250-V1254 WeakPolarHBondContact O-CB 3.31Å; L1250-V1254 WeakPolarHBondContact O-CG2 3.29Å; L1250-V1254 PolarHBondContact O-N 3.47Å
1251	E	76.1	Confident	75.1	Confident	84 Å²	84	51 Å²	51	39%	0.393	28%	0.276	S	S	.	.	H	α-helix	trans	-54.9	-44.8	172.4	-177.7	176	-155.2	0	0	112.5	Y1132 T1249 V1254 E1255	Y1132-E1251 HydrophobicContact CD2-CB 4.34Å; Y1132-E1251 HydrophobicContact CG-CB 4.28Å; T1249-E1251 PolarHBondContact O-N 3.49Å; T1249-E1251 VanDerWaalsContact O-N 3.11Å; E1251-V1254 PolarHBondContact O-N 3.48Å; E1251-E1255 WeakPolarHBondContact O-CB 3.39Å; E1251-E1255 PolarHBondContact O-N 2.64Å
1252	Q	76.3	Confident	74	Confident	36 Å²	36	50 Å²	50	17%	0.168	27%	0.27	C	S	.	.	H	α-helix	trans	-74.4	-34.1	179.8	-62.2	171.8	31	0	0	112	L1165 K1168 T1249 L1250 E1255 K1256	L1165-Q1252 HydrophobicContact CD1-CB 4.18Å; L1165-Q1252 WeakPolarHBondContact CD1-O 3.32Å; K1168-Q1252 VanDerWaalsContact NZ-CD 3.28Å; T1249-Q1252 PolarHBondContact O-N 3.31Å; T1249-Q1252 PolarHBondContact OG1-NE2 3.17Å; L1250-Q1252 VanDerWaalsContact C-N 3.33Å; L1250-Q1252 PolarHBondContact O-N 3.16Å; Q1252-E1255 PolarHBondContact O-N 2.99Å; Q1252-K1256 WeakPolarHBondContact O-CB 3.5Å; Q1252-K1256 PolarHBondContact O-N 2.92Å
1253	V	77.5	Confident	71.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-49.9	171.8	175.6	0	0	0	0	109.8	F1156 L1159 T1163 L1165 T1249 L1250 E1255 K1256 V1257	F1156-V1253 HydrophobicContact CE2-CG2 4.5Å; L1159-V1253 HydrophobicContact CB-CG1 3.93Å; T1163-V1253 HydrophobicContact CG2-CG1 3.91Å; L1165-V1253 HydrophobicContact CD1-CB 4.33Å; L1165-V1253 HydrophobicContact CD1-CG2 3.91Å; T1249-V1253 PolarHBondContact O-N 3.5Å; L1250-V1253 WeakPolarHBondContact O-CB 3.33Å; L1250-V1253 PolarHBondContact O-N 2.86Å; V1253-E1255 PolarHBondContact O-N 2.9Å; V1253-K1256 PolarHBondContact O-N 2.98Å; V1253-V1257 VanDerWaalsContact O-CG2 3.3Å; V1253-V1257 WeakPolarHBondContact O-CG2 3.47Å; V1253-V1257 PolarHBondContact O-N 2.93Å
1254	V	76.8	Confident	69.4	Low	22 Å²	22	53 Å²	53	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-60.8	-45.3	176.8	171.8	0	0	0	0	111.2	Y977 I1144 L1250 E1251 K1256 V1257 S1258	Y977-V1254 HydrophobicContact CD1-CG2 3.8Å; Y977-V1254 HydrophobicContact CE1-CB 4.33Å; Y977-V1254 HydrophobicContact CE1-CG1 4.07Å; Y977-V1254 HydrophobicContact CE1-CG2 3.51Å; I1144-V1254 HydrophobicContact CD1-CG2 3.68Å; I1144-V1254 HydrophobicContact CG1-CG2 4.28Å; I1144-V1254 HydrophobicContact CG2-CG2 4.43Å; L1250-V1254 HydrophobicContact CD1-CG2 4.36Å; L1250-V1254 HydrophobicContact CG-CG2 4.25Å; L1250-V1254 WeakPolarHBondContact O-CB 3.31Å; L1250-V1254 WeakPolarHBondContact O-CG2 3.29Å; L1250-V1254 PolarHBondContact O-N 3.47Å; E1251-V1254 PolarHBondContact O-N 3.48Å; V1254-K1256 PolarHBondContact O-N 2.82Å; V1254-V1257 PolarHBondContact O-N 3.15Å; V1254-S1258 VanDerWaalsContact O-CB 3.23Å; V1254-S1258 WeakPolarHBondContact O-CB 3.26Å; V1254-S1258 PolarHBondContact O-N 3.14Å; V1254-S1258 PolarHBondContact O-OG 3.23Å
1255	E	75.1	Confident	67.3	Low	113 Å²	113	56.1 Å²	56.1	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-56.5	-50.4	177	-174	177.2	-161.2	0	0	110.7	E1251 Q1252 V1253 S1258 N1259	E1251-E1255 WeakPolarHBondContact O-CB 3.39Å; E1251-E1255 PolarHBondContact O-N 2.64Å; Q1252-E1255 PolarHBondContact O-N 2.99Å; V1253-E1255 PolarHBondContact O-N 2.9Å; E1255-S1258 PolarHBondContact O-N 3.47Å; E1255-S1258 PolarHBondContact O-OG 3.27Å; E1255-N1259 VanDerWaalsContact O-CG 3.27Å; E1255-N1259 PolarHBondContact O-N 3.03Å; E1255-N1259 PolarHBondContact O-ND2 3.17Å
1256	K	74.7	Confident	65.2	Low	72 Å²	72	59.5 Å²	59.5	31%	0.313	33%	0.331	S	S	.	.	H	α-helix	trans	-66	-41.7	-179.9	-163.4	165.6	179	-175.5	0	112.8	T1163 N1164 L1165 Q1252 V1253 V1254 S1258 N1259 M1260	T1163-K1256 HydrophobicContact CG2-CB 4.37Å; T1163-K1256 VanDerWaalsContact O-CD 3.23Å; T1163-K1256 WeakPolarHBondContact O-CD 3.45Å; T1163-K1256 WeakPolarHBondContact O-CE 3.37Å; T1163-K1256 PolarHBondContact O-NZ 3.39Å; N1164-K1256 PolarHBondContact O-NZ 2.78Å; L1165-K1256 HydrophobicContact CD1-CB 4.15Å; L1165-K1256 HydrophobicContact CD1-CD 4.15Å; L1165-K1256 HydrophobicContact CD2-CD 3.86Å; L1165-K1256 HydrophobicContact CG-CD 3.82Å; Q1252-K1256 WeakPolarHBondContact O-CB 3.5Å; Q1252-K1256 PolarHBondContact O-N 2.92Å; V1253-K1256 PolarHBondContact O-N 2.98Å; V1254-K1256 PolarHBondContact O-N 2.82Å; K1256-S1258 VanDerWaalsContact C-N 3.33Å; K1256-S1258 PolarHBondContact O-N 3.39Å; K1256-N1259 PolarHBondContact O-N 3.15Å; K1256-M1260 HydrophobicContact CD-CE 4.43Å; K1256-M1260 HydrophobicContact CG-CE 4.06Å; K1256-M1260 HydrophobicContact CG-SD 4.41Å; K1256-M1260 VanDerWaalsContact O-CG 3.29Å; K1256-M1260 WeakPolarHBondContact O-CG 3.19Å; K1256-M1260 PolarHBondContact O-N 2.89Å
1257	V	73.3	Confident	63.2	Low	20 Å²	20	63.9 Å²	63.9	12%	0.121	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-38.9	172.9	174.2	0	0	0	0	111.5	L1151 T1163 V1253 V1254 N1259 M1260 S1261	L1151-V1257 HydrophobicContact CB-CG1 4.04Å; L1151-V1257 HydrophobicContact CD1-CG1 4.06Å; T1163-V1257 HydrophobicContact CG2-CG2 3.49Å; T1163-V1257 VanDerWaalsContact CG2-CG2 3.49Å; V1253-V1257 VanDerWaalsContact O-CG2 3.3Å; V1253-V1257 WeakPolarHBondContact O-CG2 3.47Å; V1253-V1257 PolarHBondContact O-N 2.93Å; V1254-V1257 PolarHBondContact O-N 3.15Å; V1257-N1259 VanDerWaalsContact C-N 3.3Å; V1257-N1259 PolarHBondContact O-N 3.09Å; V1257-M1260 PolarHBondContact O-N 2.98Å; V1257-S1261 PolarHBondContact O-N 3.44Å; V1257-S1261 PolarHBondContact O-OG 3.48Å
1258	S	69.4	Low	61.3	Low	29 Å²	29	68.7 Å²	68.7	20%	0.203	37%	0.371	C	S	.	.	H	α-helix	trans	-69.2	-28.2	178.2	78.4	0	0	0	0	113	V1254 E1255 K1256 S1261 I1262	V1254-S1258 VanDerWaalsContact O-CB 3.23Å; V1254-S1258 WeakPolarHBondContact O-CB 3.26Å; V1254-S1258 PolarHBondContact O-N 3.14Å; V1254-S1258 PolarHBondContact O-OG 3.23Å; E1255-S1258 PolarHBondContact O-N 3.47Å; E1255-S1258 PolarHBondContact O-OG 3.27Å; K1256-S1258 VanDerWaalsContact C-N 3.33Å; K1256-S1258 PolarHBondContact O-N 3.39Å; S1258-S1261 PolarHBondContact O-OG 3.33Å; S1258-I1262 WeakPolarHBondContact O-CD1 3.46Å; S1258-I1262 VanDerWaalsContact O-CG1 3.3Å; S1258-I1262 WeakPolarHBondContact O-CG1 3.44Å
1259	N	69.8	Low	59.4	Low	91 Å²	91	74.7 Å²	74.7	49%	0.487	41%	0.408	S	S	.	.	H	α-helix	trans	-80.3	-41.1	174.5	-68.9	-17.9	0	0	0	111.9	E1255 K1256 V1257 S1261 I1262	E1255-N1259 VanDerWaalsContact O-CG 3.27Å; E1255-N1259 PolarHBondContact O-N 3.03Å; E1255-N1259 PolarHBondContact O-ND2 3.17Å; K1256-N1259 PolarHBondContact O-N 3.15Å; V1257-N1259 VanDerWaalsContact C-N 3.3Å; V1257-N1259 PolarHBondContact O-N 3.09Å; N1259-S1261 PolarHBondContact O-N 3.29Å; N1259-I1262 PolarHBondContact O-N 3.01Å; N1259-I1262 VanDerWaalsContact O-N 3.11Å
1260	M	63.8	Low	57.1	Low	108 Å²	108	83 Å²	83	53%	0.532	44%	0.436	S	S	.	.	H	α-helix	trans	-57.5	-31	173.4	-75	167	166	0	0	112.5	K1256 V1257 I1262	K1256-M1260 HydrophobicContact CD-CE 4.43Å; K1256-M1260 HydrophobicContact CG-CE 4.06Å; K1256-M1260 HydrophobicContact CG-SD 4.41Å; K1256-M1260 VanDerWaalsContact O-CG 3.29Å; K1256-M1260 WeakPolarHBondContact O-CG 3.19Å; K1256-M1260 PolarHBondContact O-N 2.89Å; V1257-M1260 PolarHBondContact O-N 2.98Å; M1260-I1262 VanDerWaalsContact C-N 3.32Å; M1260-I1262 PolarHBondContact O-N 2.95Å
1261	S	57.1	Low	55	Low	51 Å²	51	88.7 Å²	88.7	36%	0.357	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	18.9	178.3	49.6	0	0	0	0	114.6	R1147 V1257 S1258 N1259	R1147-S1261 PolarHBondContact NH1-O 3.19Å; R1147-S1261 VanDerWaalsContact NH1-O 3.09Å; V1257-S1261 PolarHBondContact O-N 3.44Å; V1257-S1261 PolarHBondContact O-OG 3.48Å; S1258-S1261 PolarHBondContact O-OG 3.33Å; N1259-S1261 PolarHBondContact O-N 3.29Å
1262	I	51.2	Low	52.8	Low	63 Å²	63	92 Å²	92	32%	0.323	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-25.4	174.6	-63.7	167.2	0	0	0	112.7	R1147 S1258 N1259 M1260	R1147-I1262 VanDerWaalsContact NH2-CD1 3.29Å; S1258-I1262 WeakPolarHBondContact O-CD1 3.46Å; S1258-I1262 VanDerWaalsContact O-CG1 3.3Å; S1258-I1262 WeakPolarHBondContact O-CG1 3.44Å; N1259-I1262 PolarHBondContact O-N 3.01Å; N1259-I1262 VanDerWaalsContact O-N 3.11Å; M1260-I1262 VanDerWaalsContact C-N 3.32Å; M1260-I1262 PolarHBondContact O-N 2.95Å
1263	A	34.7	Very low	50.6	Low	70 Å²	70	95.7 Å²	95.7	58%	0.579	52%	0.521	S	S	*	.			trans	-91.8	104.1	176.4	0	0	0	0	0	109.4
1264	P	34.6	Very low	48.3	Very low	93 Å²	93	105.2 Å²	105.2	60%	0.604	57%	0.565	S	S	*	*	S	Bend		-132.3	-11.5	76.5	15.9	6.3	0	0	0	116.7	Q1266 L1267	P1264-Q1266 VanDerWaalsContact C-N 3.26Å; P1264-Q1266 PolarHBondContact O-N 2.87Å; P1264-Q1266 VanDerWaalsContact O-N 3.1Å; P1264-L1267 PolarHBondContact O-N 3.29Å
1265	D	37.1	Very low	46	Very low	148 Å²	148	109 Å²	109	79%	0.791	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-0.9	-163.4	-63.8	-15	0	0	0	115.6
1266	Q	38.6	Very low	43.8	Very low	126 Å²	126	113 Å²	113	59%	0.589	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	9.4	179.1	-66.4	-164	-17.2	0	0	114.6	P1264	P1264-Q1266 VanDerWaalsContact C-N 3.26Å; P1264-Q1266 PolarHBondContact O-N 2.87Å; P1264-Q1266 VanDerWaalsContact O-N 3.1Å
1267	L	34	Very low	41.7	Very low	127 Å²	127	117.7 Å²	117.7	67%	0.665	63%	0.634	S	S	*	*	S	Bend	trans	-87.4	-7.1	-179.2	-88.8	156	0	0	0	114.9	P1264	P1264-L1267 PolarHBondContact O-N 3.29Å
1268	I	35.9	Very low	39.5	Very low	154 Å²	154	124.8 Å²	124.8	79%	0.79	67%	0.67	S	S	*	*	S	Bend	trans	-90.2	-5.8	-175.1	-64.5	174	0	0	0	113.2
1269	T	34.8	Very low	37.6	Very low	127 Å²	127	127 Å²	127	78%	0.779	70%	0.697	S	S	*	*	S	Bend	trans	-125.3	23	-175	42.1	0	0	0	0	115
1270	R	31.8	Very low	35.6	Very low	210 Å²	210	127 Å²	127	79%	0.792	71%	0.71	S	S	*	*	S	Bend	trans	-128.2	15.8	-177.7	-82.1	-173.1	169.6	176.4	-1.8	116.3
1271	T	33.5	Very low	34	Very low	119 Å²	119	129.1 Å²	129.1	73%	0.73	72%	0.723	S	S	*	*	S	Bend	trans	-114.4	13.1	-176	45.3	0	0	0	0	115.5
1272	N	29.8	Very low	32.7	Very low	152 Å²	152	133.1 Å²	133.1	81%	0.813	75%	0.748	S	S	*	*	S	Bend	trans	-125.3	147.7	169.8	-83.5	-23.5	0	0	0	111.4
1273	S	29.7	Very low	31.6	Very low	115 Å²	115	138.5 Å²	138.5	80%	0.804	77%	0.772	S	S	*	*			trans	68.8	65.6	-179.4	65.9	0	0	0	0	117.4
1274	Q	28.1	Very low	31.3	Very low	200 Å²	200	144.7 Å²	144.7	94%	0.935	79%	0.786	S	S	*	*			trans	-91.2	99.7	133.8	-82.1	-173	-20.2	0	0	108.1
1275	S	28.5	Very low	31.1	Very low	101 Å²	101	146.9 Å²	146.9	71%	0.706	80%	0.797	S	S	*	*			trans	-174.8	151.8	157.9	23.5	0	0	0	0	110.6
1276	E	30	Very low	30.8	Very low	196 Å²	196	145.2 Å²	145.2	92%	0.916	79%	0.794	S	S	*	*			trans	77.5	133.5	168.2	-65.2	176	-177.4	0	0	118.7
1277	Q	29.9	Very low	30.2	Very low	171 Å²	171	148.5 Å²	148.5	80%	0.799	81%	0.807	S	S	*	*			trans	-124.7	161.9	-169.7	-66.4	177.7	-37.2	0	0	109.2
1278	I	27.3	Very low	29.9	Very low	169 Å²	169	153.6 Å²	153.6	87%	0.867	82%	0.817	S	S	*	*			trans	67.5	114.4	159.7	-58.3	145.9	0	0	0	115.9
1279	G	29.3	Very low	29.6	Very low	75 Å²	75	151.9 Å²	151.9	77%	0.773	81%	0.814	S	S	*	*			trans	160.1	130.7	167.2	0	0	0	0	0	112.2
1280	A	28.9	Very low	29.3	Very low	92 Å²	92	152.5 Å²	152.5	76%	0.76	81%	0.813	S	S	*	*			trans	-83.6	133.7	-179.5	0	0	0	0	0	112
1281	N	28.4	Very low	29.2	Very low	153 Å²	153	145.7 Å²	145.7	82%	0.818	80%	0.802	S	S	*	*			trans	150.8	120.1	146.9	-80.2	-23.4	0	0	0	111.1	E1283	N1281-E1283 PolarHBondContact O-N 3.09Å
1282	P	31.2	Very low	29	Very low	135 Å²	135	149 Å²	149	88%	0.877	81%	0.806	S	S	*	*			trans	-95.5	73.1	176.7	36.9	-32.5	0	0	0	112.1
1283	E	27	Very low	29.1	Very low	175 Å²	175	147.5 Å²	147.5	82%	0.818	80%	0.802	S	S	*	*			trans	-121.7	154.8	161.3	-72.5	-158.1	144.4	0	0	110.7	N1281	N1281-E1283 PolarHBondContact O-N 3.09Å
1284	F	28.6	Very low	29.1	Very low	200 Å²	200	146.5 Å²	146.5	88%	0.877	79%	0.791	S	S	*	*			trans	94.8	75.1	-172.4	-75	-91.5	0	0	0	117.9
1285	V	31.5	Very low	29.3	Very low	139 Å²	139	141.7 Å²	141.7	84%	0.842	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-95.8	126.5	141	176.8	0	0	0	0	107.1	K1287	V1285-K1287 PolarHBondContact O-N 3.37Å
1286	P	29.1	Very low	29.5	Very low	113 Å²	113	145.5 Å²	145.5	73%	0.734	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-70.9	126	-165.8	25.9	-34.3	0	0	0	112.9	R1288	P1286-R1288 PolarHBondContact O-N 3.45Å
1287	K	26.2	Very low	29.5	Very low	196 Å²	196	143.9 Å²	143.9	85%	0.852	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-62	117.6	165.9	-70.2	175.9	178.9	173	0	109.3	V1285	V1285-K1287 PolarHBondContact O-N 3.37Å
1288	R	28.9	Very low	29.7	Very low	233 Å²	233	138 Å²	138	88%	0.879	76%	0.755	S	S	*	*			trans	-124.8	102.3	153.2	-134.4	174.7	-170.6	178.2	3.1	110.6	P1286	P1286-R1288 PolarHBondContact O-N 3.45Å
1289	T	29	Very low	30.4	Very low	118 Å²	118	134.3 Å²	134.3	72%	0.724	74%	0.736	S	S	*	*			trans	64	82.1	156.6	56	0	0	0	0	117.5	A1291	T1289-A1291 PolarHBondContact O-N 3.44Å
1290	D	29.6	Very low	30.8	Very low	141 Å²	141	139.8 Å²	139.8	75%	0.754	73%	0.734	S	S	*	*			trans	-22.3	97.3	136.7	-57.4	-70.1	0	0	0	114.9
1291	A	28.8	Very low	31.2	Very low	67 Å²	67	141.6 Å²	141.6	55%	0.554	73%	0.73	S	S	*	*			trans	-151.4	-15.2	168.3	0	0	0	0	0	114.8	T1289	T1289-A1291 PolarHBondContact O-N 3.44Å
1292	F	29.5	Very low	31.5	Very low	189 Å²	189	136.6 Å²	136.6	83%	0.829	71%	0.707	S	S	*	*	S	Bend	trans	-102.2	-0.7	-170.1	-99.7	-88.1	0	0	0	116.1	T1294	F1292-T1294 PolarHBondContact O-N 3.17Å
1293	T	32.4	Very low	31.9	Very low	119 Å²	119	134.8 Å²	134.8	73%	0.73	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-4.7	-179.8	46.1	0	0	0	0	114.3
1294	T	29.5	Very low	32.7	Very low	94 Å²	94	131.1 Å²	131.1	58%	0.577	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-12.2	-175.8	47.9	0	0	0	0	115.1	F1292 W1296	F1292-T1294 PolarHBondContact O-N 3.17Å; T1294-W1296 VanDerWaalsContact C-N 3.33Å; T1294-W1296 PolarHBondContact O-N 3.08Å
1295	S	30.9	Very low	33.4	Very low	100 Å²	100	123.5 Å²	123.5	70%	0.699	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-15.2	179.2	-166.6	0	0	0	0	114.1	K1297	S1295-K1297 VanDerWaalsContact C-N 3.32Å; S1295-K1297 PolarHBondContact O-N 3.41Å
1296	W	33.4	Very low	33.9	Very low	181 Å²	181	119.6 Å²	119.6	69%	0.686	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.9	5.7	-179.8	-83.1	72.2	0	0	0	114.7	T1294 G1298 D1299	T1294-W1296 VanDerWaalsContact C-N 3.33Å; T1294-W1296 PolarHBondContact O-N 3.08Å; W1296-G1298 PolarHBondContact O-N 2.58Å; W1296-G1298 VanDerWaalsContact O-N 3.17Å; W1296-D1299 PolarHBondContact O-N 3.27Å
1297	K	30.7	Very low	34.6	Very low	161 Å²	161	116.3 Å²	116.3	70%	0.7	60%	0.603	S	S	*	*	H	α-helix	trans	-64.4	-16.3	177.6	-75.8	-172.3	174.9	-177.9	0	114.2	S1295	S1295-K1297 VanDerWaalsContact C-N 3.32Å; S1295-K1297 PolarHBondContact O-N 3.41Å
1298	G	34.2	Very low	35.5	Very low	48 Å²	48	117.3 Å²	117.3	50%	0.495	60%	0.601	S	S	.	*	H	α-helix	trans	-65.1	-35.4	175.6	0	0	0	0	0	114.4	W1296 L1301 C1302	W1296-G1298 PolarHBondContact O-N 2.58Å; W1296-G1298 VanDerWaalsContact O-N 3.17Å; G1298-L1301 WeakPolarHBondContact O-CB 3.39Å; G1298-L1301 PolarHBondContact O-N 2.93Å; G1298-C1302 PolarHBondContact O-N 2.82Å
1299	D	41.1	Very low	36.1	Very low	91 Å²	91	112.6 Å²	112.6	49%	0.487	59%	0.587	S	S	.	*	H	α-helix	trans	-79	-24.6	-174.4	-83.6	-8.9	0	0	0	113.6	W1296 L1301 C1302 E1303	W1296-D1299 PolarHBondContact O-N 3.27Å; D1299-L1301 PolarHBondContact O-N 3.13Å; D1299-C1302 WeakPolarHBondContact O-CB 3.45Å; D1299-C1302 PolarHBondContact O-N 3.43Å; D1299-C1302 VanDerWaalsContact O-N 3.13Å; D1299-E1303 PolarHBondContact O-N 3.4Å
1300	R	38.2	Very low	36.8	Very low	191 Å²	191	109.7 Å²	109.7	72%	0.721	57%	0.567	S	S	*	*	H	α-helix	trans	-65.9	-26.6	169.2	-74	-170.4	-179.9	-176	0.7	112.1	N1304	R1300-N1304 VanDerWaalsContact O-CB 3.23Å; R1300-N1304 WeakPolarHBondContact O-CB 3.37Å; R1300-N1304 VanDerWaalsContact O-CG 3.23Å; R1300-N1304 PolarHBondContact O-N 2.85Å
1301	L	37.8	Very low	37.3	Very low	130 Å²	130	109 Å²	109	68%	0.681	56%	0.564	S	S	*	*	H	α-helix	trans	-71.6	-35.9	172.1	-123.5	159	0	0	0	110.9	G1298 D1299 A1305	G1298-L1301 WeakPolarHBondContact O-CB 3.39Å; G1298-L1301 PolarHBondContact O-N 2.93Å; D1299-L1301 PolarHBondContact O-N 3.13Å; L1301-A1305 WeakPolarHBondContact O-CB 3.42Å; L1301-A1305 PolarHBondContact O-N 2.99Å
1302	C	34.1	Very low	38	Very low	48 Å²	48	113.5 Å²	113.5	32%	0.324	57%	0.567	S	S	.	*	H	α-helix	trans	-66.3	-47.3	170.2	-77.1	0	0	0	0	112.8	G1298 D1299 A1305 L1306	G1298-C1302 PolarHBondContact O-N 2.82Å; D1299-C1302 WeakPolarHBondContact O-CB 3.45Å; D1299-C1302 PolarHBondContact O-N 3.43Å; D1299-C1302 VanDerWaalsContact O-N 3.13Å; C1302-A1305 PolarHBondContact O-N 2.97Å; C1302-L1306 WeakPolarHBondContact O-CB 3.35Å; C1302-L1306 PolarHBondContact O-N 3.46Å
1303	E	40.3	Very low	38.8	Very low	96 Å²	96	108.5 Å²	108.5	45%	0.449	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-41.4	177.7	-75.5	-168.5	143.9	0	0	111.6	D1299 L1306 A1307 K1903	D1299-E1303 PolarHBondContact O-N 3.4Å; E1303-L1306 PolarHBondContact O-N 2.95Å; E1303-A1307 WeakPolarHBondContact O-CB 3.45Å; E1303-A1307 PolarHBondContact O-N 3.48Å; E1303-K1903 IonicContact OE1-NZ 2.61Å
1304	N	42.4	Very low	39.4	Very low	98 Å²	98	110 Å²	110	52%	0.524	55%	0.552	S	S	.	*	H	α-helix	trans	-70.3	-34	176.2	-72.1	-6.2	0	0	0	113.3	R1300 R1308	R1300-N1304 VanDerWaalsContact O-CB 3.23Å; R1300-N1304 WeakPolarHBondContact O-CB 3.37Å; R1300-N1304 VanDerWaalsContact O-CG 3.23Å; R1300-N1304 PolarHBondContact O-N 2.85Å; N1304-R1308 WeakPolarHBondContact O-CB 3.11Å; N1304-R1308 VanDerWaalsContact O-CG 3.26Å; N1304-R1308 WeakPolarHBondContact O-CG 3.38Å; N1304-R1308 PolarHBondContact O-N 3.03Å
1305	A	44.4	Very low	40	Very low	41 Å²	41	108.1 Å²	108.1	34%	0.339	54%	0.539	S	S	.	.	H	α-helix	trans	-68.6	-44.1	174	0	0	0	0	0	111.3	L1301 C1302 A1307 R1308 F1309	L1301-A1305 WeakPolarHBondContact O-CB 3.42Å; L1301-A1305 PolarHBondContact O-N 2.99Å; C1302-A1305 PolarHBondContact O-N 2.97Å; A1305-A1307 VanDerWaalsContact C-N 3.35Å; A1305-A1307 PolarHBondContact O-N 3.16Å; A1305-R1308 PolarHBondContact O-N 2.86Å; A1305-F1309 WeakPolarHBondContact O-CB 3.19Å; A1305-F1309 PolarHBondContact O-N 3.35Å
1306	L	42	Very low	40.7	Very low	56 Å²	56	107.2 Å²	107.2	29%	0.293	53%	0.526	S	S	.	.	H	α-helix	trans	-66.6	-36.9	177.1	-145.3	95.1	0	0	0	111.7	C1302 E1303 F1309 L1310 Y1351	C1302-L1306 WeakPolarHBondContact O-CB 3.35Å; C1302-L1306 PolarHBondContact O-N 3.46Å; E1303-L1306 PolarHBondContact O-N 2.95Å; L1306-F1309 PolarHBondContact O-N 3.18Å; L1306-L1310 HydrophobicContact CD2-CD1 4.05Å; L1306-L1310 HydrophobicContact CG-CD1 4.29Å; L1306-L1310 WeakPolarHBondContact O-CB 3.32Å; L1306-L1310 WeakPolarHBondContact O-CG 3.4Å; L1306-L1310 PolarHBondContact O-N 3.39Å; L1306-Y1351 HydrophobicContact CD1-CD2 4.24Å; L1306-Y1351 HydrophobicContact CD1-CG 4.38Å
1307	A	43.5	Very low	41.3	Very low	44 Å²	44	100.5 Å²	100.5	36%	0.364	51%	0.512	S	S	.	.	H	α-helix	trans	-73.2	-27.4	176.3	0	0	0	0	0	113.6	E1303 A1305	E1303-A1307 WeakPolarHBondContact O-CB 3.45Å; E1303-A1307 PolarHBondContact O-N 3.48Å; A1305-A1307 VanDerWaalsContact C-N 3.35Å; A1305-A1307 PolarHBondContact O-N 3.16Å
1308	R	44.1	Very low	41.8	Very low	217 Å²	217	96.1 Å²	96.1	82%	0.819	50%	0.496	S	S	*	.	H	α-helix	trans	-75.1	-31.1	168.7	-76.7	175.9	-177.3	-178.1	-0.1	112.5	N1304 A1305	N1304-R1308 WeakPolarHBondContact O-CB 3.11Å; N1304-R1308 VanDerWaalsContact O-CG 3.26Å; N1304-R1308 WeakPolarHBondContact O-CG 3.38Å; N1304-R1308 PolarHBondContact O-N 3.03Å; A1305-R1308 PolarHBondContact O-N 2.86Å
1309	F	41.8	Very low	42.3	Very low	134 Å²	134	96 Å²	96	59%	0.588	49%	0.488	S	S	*	.	H	α-helix	trans	-77.5	-33.1	176.6	-102.9	-88.3	0	0	0	113.6	A1305 L1306 N1311 A1650	A1305-F1309 WeakPolarHBondContact O-CB 3.19Å; A1305-F1309 PolarHBondContact O-N 3.35Å; L1306-F1309 PolarHBondContact O-N 3.18Å; F1309-N1311 PolarHBondContact O-N 2.81Å; F1309-A1650 HydrophobicContact CE1-CB 3.56Å; F1309-A1650 HydrophobicContact CZ-CB 3.72Å
1310	L	43.6	Very low	42.7	Very low	58 Å²	58	97.9 Å²	97.9	30%	0.304	49%	0.492	S	S	.	.	S	Bend	trans	-93.6	95.6	177.2	-69.8	170	0	0	0	109.8	L1306 Y1312 L1315	L1306-L1310 HydrophobicContact CD2-CD1 4.05Å; L1306-L1310 HydrophobicContact CG-CD1 4.29Å; L1306-L1310 WeakPolarHBondContact O-CB 3.32Å; L1306-L1310 WeakPolarHBondContact O-CG 3.4Å; L1306-L1310 PolarHBondContact O-N 3.39Å; L1310-Y1312 PolarHBondContact O-N 2.97Å; L1310-L1315 HydrophobicContact CB-CD1 4.08Å; L1310-L1315 HydrophobicContact CD1-CD1 4.49Å
1311	N	40.2	Very low	42.8	Very low	127 Å²	127	95.2 Å²	95.2	68%	0.679	49%	0.489	S	S	*	.			trans	-53.6	105.5	-178.2	-145.1	-2.1	0	0	0	110.6	F1309 S1313 F1314	F1309-N1311 PolarHBondContact O-N 2.81Å; N1311-S1313 PolarHBondContact O-N 3.45Å; N1311-S1313 VanDerWaalsContact O-N 3.09Å; N1311-F1314 PolarHBondContact O-N 2.91Å
1312	Y	43.2	Very low	43	Very low	160 Å²	160	95.4 Å²	95.4	63%	0.627	49%	0.485	S	S	*	.	H	α-helix	trans	-63.2	-27.6	-158.6	-142.5	-95.1	0	0	0	112.9	L1310 F1314 L1316	L1310-Y1312 PolarHBondContact O-N 2.97Å; Y1312-F1314 PolarHBondContact O-N 3.29Å; Y1312-L1316 HydrophobicContact CD1-CD1 4.03Å; Y1312-L1316 HydrophobicContact CE1-CD1 3.98Å; Y1312-L1316 PolarHBondContact O-N 3.46Å; Y1312-L1316 VanDerWaalsContact O-N 3.1Å
1313	S	47.8	Very low	43.6	Very low	85 Å²	85	99 Å²	99	59%	0.594	50%	0.496	S	S	*	.	H	α-helix	trans	-59.6	-41.5	178.1	51.3	0	0	0	0	113.8	N1311 L1316 G1317	N1311-S1313 PolarHBondContact O-N 3.45Å; N1311-S1313 VanDerWaalsContact O-N 3.09Å; S1313-L1316 PolarHBondContact O-N 2.69Å; S1313-G1317 PolarHBondContact O-N 3.21Å
1314	F	43.5	Very low	43.9	Very low	149 Å²	149	99.9 Å²	99.9	65%	0.654	50%	0.504	S	S	*	.	H	α-helix	trans	-70.2	-39.3	-176.8	-171.7	-100.8	0	0	0	112.1	N1311 Y1312 G1317 L1318	N1311-F1314 PolarHBondContact O-N 2.91Å; Y1312-F1314 PolarHBondContact O-N 3.29Å; F1314-G1317 PolarHBondContact O-N 3.49Å; F1314-L1318 HydrophobicContact CD1-CD1 4Å; F1314-L1318 HydrophobicContact CE1-CD1 3.53Å; F1314-L1318 HydrophobicContact CZ-CD1 4.04Å; F1314-L1318 PolarHBondContact O-N 3.38Å; F1314-L1318 VanDerWaalsContact O-N 3.17Å
1315	L	44	Very low	43.9	Very low	56 Å²	56	101.8 Å²	101.8	29%	0.293	52%	0.515	S	S	.	.	H	α-helix	trans	-71.1	-34.6	176.3	-66.3	169.8	0	0	0	111.8	L1310 L1318 S1319 F1340	L1310-L1315 HydrophobicContact CB-CD1 4.08Å; L1310-L1315 HydrophobicContact CD1-CD1 4.49Å; L1315-L1318 PolarHBondContact O-N 3.01Å; L1315-S1319 PolarHBondContact O-N 2.87Å; L1315-F1340 HydrophobicContact CB-CE2 4.4Å; L1315-F1340 HydrophobicContact CB-CZ 4.37Å; L1315-F1340 HydrophobicContact CD1-CZ 4.45Å; L1315-F1340 HydrophobicContact CD2-CE2 3.86Å; L1315-F1340 HydrophobicContact CD2-CZ 4.16Å
1316	L	44.1	Very low	43.9	Very low	81 Å²	81	103.6 Å²	103.6	42%	0.424	52%	0.519	S	S	.	.	H	α-helix	trans	-69	-37.1	174.5	-136.2	92.5	0	0	0	112.5	Y1312 S1313 S1319 K1320	Y1312-L1316 HydrophobicContact CD1-CD1 4.03Å; Y1312-L1316 HydrophobicContact CE1-CD1 3.98Å; Y1312-L1316 PolarHBondContact O-N 3.46Å; Y1312-L1316 VanDerWaalsContact O-N 3.1Å; S1313-L1316 PolarHBondContact O-N 2.69Å; L1316-S1319 PolarHBondContact O-N 3.41Å; L1316-S1319 PolarHBondContact O-OG 2.76Å; L1316-K1320 PolarHBondContact O-N 2.65Å
1317	G	46.8	Very low	43.7	Very low	39 Å²	39	108.7 Å²	108.7	40%	0.402	54%	0.538	S	S	.	.	H	α-helix	trans	-62.7	-43.3	174.1	0	0	0	0	0	112.1	S1313 F1314 K1320 M1321	S1313-G1317 PolarHBondContact O-N 3.21Å; F1314-G1317 PolarHBondContact O-N 3.49Å; G1317-K1320 PolarHBondContact O-N 2.68Å; G1317-M1321 PolarHBondContact O-N 3.05Å
1318	L	41.3	Very low	43.5	Very low	69 Å²	69	114.5 Å²	114.5	36%	0.361	56%	0.562	S	S	.	*	H	α-helix	trans	-67.4	-36	174.4	-86.4	162.9	0	0	0	113.3	F1314 L1315 F1322	F1314-L1318 HydrophobicContact CD1-CD1 4Å; F1314-L1318 HydrophobicContact CE1-CD1 3.53Å; F1314-L1318 HydrophobicContact CZ-CD1 4.04Å; F1314-L1318 PolarHBondContact O-N 3.38Å; F1314-L1318 VanDerWaalsContact O-N 3.17Å; L1315-L1318 PolarHBondContact O-N 3.01Å; L1318-F1322 HydrophobicContact CD2-CD2 4.44Å; L1318-F1322 HydrophobicContact CD2-CE2 4.17Å; L1318-F1322 WeakPolarHBondContact O-CD2 3.32Å; L1318-F1322 PolarHBondContact O-N 3.1Å
1319	S	45.3	Very low	43.1	Very low	45 Å²	45	110.7 Å²	110.7	32%	0.315	56%	0.557	S	S	.	*	H	α-helix	trans	-63	-49.9	173.6	96.9	0	0	0	0	110.4	L1315 L1316 M1321 F1322 E1323	L1315-S1319 PolarHBondContact O-N 2.87Å; L1316-S1319 PolarHBondContact O-N 3.41Å; L1316-S1319 PolarHBondContact O-OG 2.76Å; S1319-M1321 VanDerWaalsContact C-N 3.34Å; S1319-M1321 PolarHBondContact O-N 2.99Å; S1319-F1322 PolarHBondContact O-N 3.23Å; S1319-F1322 VanDerWaalsContact O-N 3.09Å; S1319-E1323 WeakPolarHBondContact O-CB 3.49Å; S1319-E1323 WeakPolarHBondContact O-CG 3.32Å; S1319-E1323 PolarHBondContact O-N 2.85Å; S1319-E1323 PolarHBondContact OG-OE2 3.42Å
1320	K	48.6	Very low	42.7	Very low	132 Å²	132	112 Å²	112	57%	0.574	56%	0.559	S	S	*	*	H	α-helix	trans	-60.1	-39	179.6	-75.5	-176.1	172.8	-174.9	0	113.2	L1316 G1317 N1324	L1316-K1320 PolarHBondContact O-N 2.65Å; G1317-K1320 PolarHBondContact O-N 2.68Å; K1320-N1324 PolarHBondContact O-N 3.44Å
1321	M	40.5	Very low	42.1	Very low	134 Å²	134	117.2 Å²	117.2	66%	0.66	59%	0.587	S	S	*	*	H	α-helix	trans	-62.8	-40.6	174.6	-86.1	-164.3	70.2	0	0	113	G1317 S1319	G1317-M1321 PolarHBondContact O-N 3.05Å; S1319-M1321 VanDerWaalsContact C-N 3.34Å; S1319-M1321 PolarHBondContact O-N 2.99Å
1322	F	42.4	Very low	41.8	Very low	135 Å²	135	116 Å²	116	59%	0.592	59%	0.589	S	S	*	*	H	α-helix	trans	-84.8	-21.4	179.9	-82.8	-77.9	0	0	0	114	L1318 S1319 N1326	L1318-F1322 HydrophobicContact CD2-CD2 4.44Å; L1318-F1322 HydrophobicContact CD2-CE2 4.17Å; L1318-F1322 WeakPolarHBondContact O-CD2 3.32Å; L1318-F1322 PolarHBondContact O-N 3.1Å; S1319-F1322 PolarHBondContact O-N 3.23Å; S1319-F1322 VanDerWaalsContact O-N 3.09Å; F1322-N1326 PolarHBondContact O-ND2 3.17Å
1323	E	46.4	Very low	41.3	Very low	122 Å²	122	117.7 Å²	117.7	57%	0.57	60%	0.599	S	S	*	*	H	α-helix	trans	-71	-37.3	174.3	-78.1	172.9	122	0	0	112.1	S1319	S1319-E1323 WeakPolarHBondContact O-CB 3.49Å; S1319-E1323 WeakPolarHBondContact O-CG 3.32Å; S1319-E1323 PolarHBondContact O-N 2.85Å; S1319-E1323 PolarHBondContact OG-OE2 3.42Å
1324	N	45.3	Very low	40.9	Very low	115 Å²	115	120.7 Å²	120.7	62%	0.615	61%	0.609	S	S	*	*	H	α-helix	trans	-71.2	-32.8	-178.1	-88.7	-13.3	0	0	0	114.4	K1320	K1320-N1324 PolarHBondContact O-N 3.44Å
1325	N	43.7	Very low	40.9	Very low	139 Å²	139	117 Å²	117	74%	0.743	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-6.7	-176.5	-77.1	-6	0	0	0	114.9
1326	N	43.5	Very low	41.1	Very low	79 Å²	79	119.1 Å²	119.1	42%	0.422	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.3	10	-173.7	-78.9	-51.5	0	0	0	115.2	F1322 I1328 L1329	F1322-N1326 PolarHBondContact O-ND2 3.17Å; N1326-I1328 PolarHBondContact O-N 3.14Å; N1326-L1329 PolarHBondContact O-N 3.25Å
1327	K	38.4	Very low	41.5	Very low	162 Å²	162	116.1 Å²	116.1	70%	0.704	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-11.8	-176.9	-77.7	-175.1	175.1	176.9	0	115.9
1328	I	39.1	Very low	42.1	Very low	166 Å²	166	117.1 Å²	117.1	85%	0.851	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-9.8	-174.2	-60.1	176.6	0	0	0	113.3	N1326	N1326-I1328 PolarHBondContact O-N 3.14Å
1329	L	34.9	Very low	43	Very low	137 Å²	137	116.9 Å²	116.9	72%	0.717	60%	0.597	S	S	*	*	S	Bend	trans	-116.5	9.6	-172.6	-89.1	152.2	0	0	0	115.6	N1326 N1331	N1326-L1329 PolarHBondContact O-N 3.25Å; L1329-N1331 PolarHBondContact O-N 3.15Å
1330	Y	34.4	Very low	43.9	Very low	163 Å²	163	119.4 Å²	119.4	64%	0.639	60%	0.602	S	S	*	*			trans	-84.7	83.2	179.4	-90.7	-95.8	0	0	0	112.6	I1336	Y1330-I1336 HydrophobicContact CE1-CD1 3.94Å
1331	N	30.5	Very low	44.7	Very low	167 Å²	167	114.5 Å²	114.5	89%	0.893	59%	0.585	S	S	*	*			trans	-158.7	54.1	163.4	-108.1	-19	0	0	0	115.3	L1329	L1329-N1331 PolarHBondContact O-N 3.15Å
1332	S	34.3	Very low	45.9	Very low	102 Å²	102	109.1 Å²	109.1	71%	0.713	56%	0.558	S	S	*	*			trans	-150	127.5	152.8	64.8	0	0	0	0	110.1
1333	K	31.8	Very low	46.9	Very low	195 Å²	195	105 Å²	105	85%	0.848	54%	0.541	S	S	*	.			trans	-68.9	153.5	174.1	-70.5	176.7	178	174.8	0	110.2
1334	D	39.6	Very low	48	Very low	148 Å²	148	102.1 Å²	102.1	79%	0.791	53%	0.528	S	S	*	.	S	Bend	trans	75.6	126.6	172	-49.8	-37.6	0	0	0	117.7
1335	C	43.6	Very low	49	Very low	71 Å²	71	97.1 Å²	97.1	48%	0.48	50%	0.502	S	S	.	.			trans	66	54.9	175.8	-66.2	0	0	0	0	118.2	V1337 M1869	C1335-V1337 PolarHBondContact O-N 3.43Å; C1335-M1869 HydrophobicContact CB-CE 3.93Å; C1335-M1869 HydrophobicContact CB-SD 3.76Å
1336	I	48	Very low	50	Low	101 Å²	101	91.3 Å²	91.3	52%	0.518	47%	0.471	S	S	.	.			trans	-74.3	106.7	162.5	-55.1	177.8	0	0	0	109.7	Y1330 T1338	Y1330-I1336 HydrophobicContact CE1-CD1 3.94Å; I1336-T1338 HydrophobicContact CG2-CG2 4.35Å; I1336-T1338 PolarHBondContact O-N 3.4Å
1337	V	54	Low	51.1	Low	18 Å²	18	89.3 Å²	89.3	11%	0.109	46%	0.462	C	S	.	.			trans	-70.7	94.4	171	-176.8	0	0	0	0	109.5	C1335 Q1342 M1869	C1335-V1337 PolarHBondContact O-N 3.43Å; V1337-Q1342 HydrophobicContact CG1-CG 4.31Å; V1337-Q1342 VanDerWaalsContact CG1-NE2 3.34Å; V1337-M1869 HydrophobicContact CG2-CE 3.19Å; V1337-M1869 HydrophobicContact CG2-CG 3.81Å; V1337-M1869 HydrophobicContact CG2-SD 3.59Å; V1337-M1869 VanDerWaalsContact CG2-SD 3.59Å
1338	T	59.1	Low	52.5	Low	59 Å²	59	86.4 Å²	86.4	36%	0.362	45%	0.449	S	S	.	.			trans	-73.3	128.5	167.1	64.1	0	0	0	0	109	I1336 F1340 C1341	I1336-T1338 HydrophobicContact CG2-CG2 4.35Å; I1336-T1338 PolarHBondContact O-N 3.4Å; T1338-F1340 PolarHBondContact O-N 3.09Å; T1338-F1340 VanDerWaalsContact O-N 3.16Å; T1338-C1341 PolarHBondContact O-N 3.29Å; T1338-C1341 PolarHBondContact OG1-N 3.4Å; T1338-C1341 PolarHBondContact OG1-SG 3.15Å
1339	P	60	Low	53.9	Low	64 Å²	64	80.8 Å²	80.8	42%	0.416	42%	0.417	S	S	.	.	H	α-helix	trans	-59	-28.8	175	22.1	-31.7	0	0	0	111.1	C1341 Q1342 I1343 V1635	P1339-C1341 PolarHBondContact O-N 3.31Å; P1339-Q1342 WeakPolarHBondContact O-CB 3.19Å; P1339-Q1342 PolarHBondContact O-N 3.35Å; P1339-Q1342 VanDerWaalsContact O-N 3.14Å; P1339-I1343 VanDerWaalsContact O-CG1 3.31Å; P1339-I1343 WeakPolarHBondContact O-CG1 3.39Å; P1339-I1343 PolarHBondContact O-N 3.22Å; P1339-V1635 HydrophobicContact CB-CG2 4.48Å
1340	F	63.9	Low	55.3	Low	98 Å²	98	77.7 Å²	77.7	43%	0.43	40%	0.396	S	S	.	.	H	α-helix	trans	-56.1	-46.2	175.3	-160.6	-85.7	0	0	0	114	L1315 T1338 Q1342 I1343 E1344	L1315-F1340 HydrophobicContact CB-CE2 4.4Å; L1315-F1340 HydrophobicContact CB-CZ 4.37Å; L1315-F1340 HydrophobicContact CD1-CZ 4.45Å; L1315-F1340 HydrophobicContact CD2-CE2 3.86Å; L1315-F1340 HydrophobicContact CD2-CZ 4.16Å; T1338-F1340 PolarHBondContact O-N 3.09Å; T1338-F1340 VanDerWaalsContact O-N 3.16Å; F1340-Q1342 VanDerWaalsContact C-N 3.25Å; F1340-Q1342 PolarHBondContact O-N 3.31Å; F1340-I1343 WeakPolarHBondContact O-CB 3.44Å; F1340-I1343 PolarHBondContact O-N 3.16Å; F1340-E1344 PolarHBondContact O-N 3.39Å
1341	C	64.9	Low	56.8	Low	30 Å²	30	74 Å²	74	20%	0.203	38%	0.381	C	S	.	.	H	α-helix	trans	-65.3	-29	177.5	-79.4	0	0	0	0	113	T1338 P1339 A1345	T1338-C1341 PolarHBondContact O-N 3.29Å; T1338-C1341 PolarHBondContact OG1-N 3.4Å; T1338-C1341 PolarHBondContact OG1-SG 3.15Å; P1339-C1341 PolarHBondContact O-N 3.31Å; C1341-A1345 WeakPolarHBondContact O-CB 3.43Å; C1341-A1345 PolarHBondContact O-N 2.85Å; C1341-A1345 VanDerWaalsContact O-N 3.14Å
1342	Q	65.1	Low	58.4	Low	21 Å²	21	68.1 Å²	68.1	10%	0.098	35%	0.35	C	S	.	.	H	α-helix	trans	-73.5	-39	174.2	-57.6	-174	-26.8	0	0	111.6	V1337 P1339 F1340 A1345 I1346 L1898	V1337-Q1342 HydrophobicContact CG1-CG 4.31Å; V1337-Q1342 VanDerWaalsContact CG1-NE2 3.34Å; P1339-Q1342 WeakPolarHBondContact O-CB 3.19Å; P1339-Q1342 PolarHBondContact O-N 3.35Å; P1339-Q1342 VanDerWaalsContact O-N 3.14Å; F1340-Q1342 VanDerWaalsContact C-N 3.25Å; F1340-Q1342 PolarHBondContact O-N 3.31Å; Q1342-A1345 PolarHBondContact O-N 3Å; Q1342-I1346 WeakPolarHBondContact O-CD1 3.44Å; Q1342-I1346 VanDerWaalsContact O-CG1 3.27Å; Q1342-I1346 WeakPolarHBondContact O-CG1 3.33Å; Q1342-I1346 PolarHBondContact O-N 3.01Å; Q1342-L1898 HydrophobicContact CB-CD2 4.33Å; Q1342-L1898 PolarHBondContact NE2-O 2.84Å
1343	I	65.3	Low	59.8	Low	48 Å²	48	67.6 Å²	67.6	25%	0.246	34%	0.335	C	S	.	.	H	α-helix	trans	-56.6	-53.4	172.2	-66	168.6	0	0	0	109.9	P1339 F1340 A1345 I1346 V1347 V1635 V1639	P1339-I1343 VanDerWaalsContact O-CG1 3.31Å; P1339-I1343 WeakPolarHBondContact O-CG1 3.39Å; P1339-I1343 PolarHBondContact O-N 3.22Å; F1340-I1343 WeakPolarHBondContact O-CB 3.44Å; F1340-I1343 PolarHBondContact O-N 3.16Å; I1343-A1345 VanDerWaalsContact C-N 3.32Å; I1343-A1345 PolarHBondContact O-N 3.09Å; I1343-I1346 PolarHBondContact O-N 2.89Å; I1343-V1347 HydrophobicContact CG2-CG2 4.45Å; I1343-V1347 WeakPolarHBondContact O-CG2 3.2Å; I1343-V1347 PolarHBondContact O-N 3.28Å; I1343-V1635 HydrophobicContact CD1-CG1 3.9Å; I1343-V1635 HydrophobicContact CG1-CG1 3.5Å; I1343-V1639 HydrophobicContact CB-CG2 3.95Å; I1343-V1639 HydrophobicContact CD1-CG2 4.42Å; I1343-V1639 HydrophobicContact CG1-CG2 3.52Å; I1343-V1639 HydrophobicContact CG2-CG2 3.78Å
1344	E	68.2	Low	61.1	Low	62 Å²	62	61.4 Å²	61.4	29%	0.29	31%	0.311	S	S	.	.	H	α-helix	trans	-54.1	-46.9	177.8	-170.7	-161.5	162.2	0	0	111.4	F1340 I1346 V1347 K1348	F1340-E1344 PolarHBondContact O-N 3.39Å; E1344-I1346 PolarHBondContact O-N 3.49Å; E1344-V1347 PolarHBondContact O-N 3.06Å; E1344-K1348 VanDerWaalsContact O-CB 3.31Å; E1344-K1348 WeakPolarHBondContact O-CB 3.34Å; E1344-K1348 PolarHBondContact O-N 3.41Å
1345	A	65.9	Low	62.3	Low	9 Å²	9	58.3 Å²	58.3	7%	0.074	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-42.8	179.8	0	0	0	0	0	113	C1341 Q1342 I1343 R1349 F1894 A1897	C1341-A1345 WeakPolarHBondContact O-CB 3.43Å; C1341-A1345 PolarHBondContact O-N 2.85Å; C1341-A1345 VanDerWaalsContact O-N 3.14Å; Q1342-A1345 PolarHBondContact O-N 3Å; I1343-A1345 VanDerWaalsContact C-N 3.32Å; I1343-A1345 PolarHBondContact O-N 3.09Å; A1345-R1349 WeakPolarHBondContact O-CB 3.45Å; A1345-R1349 PolarHBondContact O-N 3.42Å; A1345-F1894 HydrophobicContact CB-CD2 4.19Å; A1345-F1894 HydrophobicContact CB-CE2 4.34Å; A1345-F1894 WeakPolarHBondContact O-CD2 3.36Å; A1345-F1894 WeakPolarHBondContact O-CE2 3.36Å; A1345-A1897 HydrophobicContact CB-CB 3.6Å
1346	I	66	Low	63.3	Low	17 Å²	17	58.9 Å²	58.9	9%	0.087	29%	0.289	C	S	.	.	H	α-helix	trans	-68.5	-42.8	179.5	-66.1	163.8	0	0	0	110.7	Q1342 I1343 E1344 R1349 R1350 F1636 V1639 F1894 L1898	Q1342-I1346 WeakPolarHBondContact O-CD1 3.44Å; Q1342-I1346 VanDerWaalsContact O-CG1 3.27Å; Q1342-I1346 WeakPolarHBondContact O-CG1 3.33Å; Q1342-I1346 PolarHBondContact O-N 3.01Å; I1343-I1346 PolarHBondContact O-N 2.89Å; E1344-I1346 PolarHBondContact O-N 3.49Å; I1346-R1349 PolarHBondContact O-N 2.76Å; I1346-R1350 WeakPolarHBondContact O-CG 3.48Å; I1346-R1350 PolarHBondContact O-N 3.14Å; I1346-F1636 HydrophobicContact CD1-CD2 4.38Å; I1346-V1639 HydrophobicContact CB-CG1 4.04Å; I1346-V1639 HydrophobicContact CG2-CG1 3.57Å; I1346-F1894 HydrophobicContact CG1-CE2 4.47Å; I1346-L1898 HydrophobicContact CD1-CD2 4.25Å; I1346-L1898 HydrophobicContact CG1-CD2 4.05Å
1347	V	65.3	Low	63.9	Low	37 Å²	37	57.5 Å²	57.5	22%	0.224	28%	0.282	C	S	.	.	H	α-helix	trans	-62.5	-48.2	175.7	173.2	0	0	0	0	110.7	I1343 E1344 R1349 R1350 Y1351 V1639	I1343-V1347 HydrophobicContact CG2-CG2 4.45Å; I1343-V1347 WeakPolarHBondContact O-CG2 3.2Å; I1343-V1347 PolarHBondContact O-N 3.28Å; E1344-V1347 PolarHBondContact O-N 3.06Å; V1347-R1349 VanDerWaalsContact C-N 3.32Å; V1347-R1349 PolarHBondContact O-N 3.23Å; V1347-R1350 PolarHBondContact O-N 2.84Å; V1347-R1350 VanDerWaalsContact O-N 3.09Å; V1347-Y1351 PolarHBondContact O-N 3.44Å; V1347-V1639 HydrophobicContact CG2-CG1 4.09Å
1348	K	68.4	Low	64.3	Low	102 Å²	102	64.9 Å²	64.9	44%	0.443	31%	0.313	S	S	.	.	H	α-helix	trans	-60.3	-39.1	178.6	-169.8	164.3	-173.4	162.7	0	112.3	E1344 L1352	E1344-K1348 VanDerWaalsContact O-CB 3.31Å; E1344-K1348 WeakPolarHBondContact O-CB 3.34Å; E1344-K1348 PolarHBondContact O-N 3.41Å; K1348-L1352 HydrophobicContact CG-CD1 4.42Å; K1348-L1352 WeakPolarHBondContact O-CG 3.17Å; K1348-L1352 PolarHBondContact O-N 3.36Å
1349	R	68.9	Low	64.3	Low	47 Å²	47	68.9 Å²	68.9	18%	0.177	32%	0.322	C	S	.	.	H	α-helix	trans	-62.6	-44.1	172.6	175.2	176.4	171.3	-164.4	-2.7	112.5	A1345 I1346 V1347 K1353 D1883 L1886 F1894	A1345-R1349 WeakPolarHBondContact O-CB 3.45Å; A1345-R1349 PolarHBondContact O-N 3.42Å; I1346-R1349 PolarHBondContact O-N 2.76Å; V1347-R1349 VanDerWaalsContact C-N 3.32Å; V1347-R1349 PolarHBondContact O-N 3.23Å; R1349-K1353 WeakPolarHBondContact O-CB 3.5Å; R1349-K1353 PolarHBondContact O-N 2.89Å; R1349-D1883 IonicContact CZ-OD2 3.57Å; R1349-D1883 IonicContact NE-OD2 3.94Å; R1349-D1883 PolarHBondContact NE-OD2 3.29Å; R1349-D1883 IonicContact NH2-OD2 3.94Å; R1349-D1883 PolarHBondContact NH2-OD2 2.86Å; R1349-L1886 HydrophobicContact CG-CD1 4.35Å; R1349-F1894 HydrophobicContact CB-CD2 3.81Å; R1349-F1894 HydrophobicContact CB-CE2 3.7Å; R1349-F1894 HydrophobicContact CB-CZ 4.46Å; R1349-F1894 VanDerWaalsContact CD-CZ 3.41Å; R1349-F1894 HydrophobicContact CG-CD2 4.44Å; R1349-F1894 HydrophobicContact CG-CE2 4.23Å
1350	R	63.9	Low	64	Low	73 Å²	73	66.7 Å²	66.7	28%	0.275	31%	0.309	S	S	.	.	H	α-helix	trans	-61.8	-45.7	177.9	-75.2	-179	173.5	-132.3	-17.8	111.2	I1346 V1347 K1353 L1354 E1622 S1643	I1346-R1350 WeakPolarHBondContact O-CG 3.48Å; I1346-R1350 PolarHBondContact O-N 3.14Å; V1347-R1350 PolarHBondContact O-N 2.84Å; V1347-R1350 VanDerWaalsContact O-N 3.09Å; R1350-K1353 PolarHBondContact O-N 3.34Å; R1350-L1354 PolarHBondContact O-N 2.83Å; R1350-L1354 VanDerWaalsContact O-N 3.1Å; R1350-E1622 IonicContact CZ-OE1 3.16Å; R1350-E1622 IonicContact CZ-OE2 3.87Å; R1350-E1622 IonicContact NH1-OE1 3.45Å; R1350-E1622 IonicContact NH1-OE2 3.35Å; R1350-E1622 IonicContact NH2-OE1 2.74Å; R1350-E1622 IonicContact NH2-OE2 2.63Å; R1350-E1622 PolarHBondContact NH2-OE2 3.28Å; R1350-S1643 WeakPolarHBondContact CD-OG 3.3Å; R1350-S1643 PolarHBondContact NH1-OG 3.03Å
1351	Y	65.9	Low	63.6	Low	84 Å²	84	66.1 Å²	66.1	33%	0.329	31%	0.31	S	S	.	.	H	α-helix	trans	-58.8	-52.4	176.8	178.5	-98.1	0	0	0	112.7	L1306 V1347 K1353 L1354 V1355	L1306-Y1351 HydrophobicContact CD1-CD2 4.24Å; L1306-Y1351 HydrophobicContact CD1-CG 4.38Å; V1347-Y1351 PolarHBondContact O-N 3.44Å; Y1351-K1353 PolarHBondContact O-N 3.49Å; Y1351-L1354 PolarHBondContact O-N 3.34Å; Y1351-L1354 VanDerWaalsContact O-N 3.16Å; Y1351-V1355 HydrophobicContact CD1-CG2 4.44Å; Y1351-V1355 HydrophobicContact CD2-CG2 4.37Å; Y1351-V1355 HydrophobicContact CE1-CG2 4.04Å; Y1351-V1355 HydrophobicContact CE2-CG2 3.97Å; Y1351-V1355 WeakPolarHBondContact O-CG2 3.41Å; Y1351-V1355 PolarHBondContact O-N 2.88Å; Y1351-V1355 VanDerWaalsContact O-N 3.09Å
1352	L	64.9	Low	63.3	Low	44 Å²	44	68.5 Å²	68.5	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-33.7	179	-75	172.2	0	0	0	113	K1348 R1356 L1886	K1348-L1352 HydrophobicContact CG-CD1 4.42Å; K1348-L1352 WeakPolarHBondContact O-CG 3.17Å; K1348-L1352 PolarHBondContact O-N 3.36Å; L1352-R1356 WeakPolarHBondContact O-CB 3.44Å; L1352-R1356 WeakPolarHBondContact O-CD 3.45Å; L1352-R1356 VanDerWaalsContact O-CG 3.25Å; L1352-R1356 WeakPolarHBondContact O-CG 3.05Å; L1352-R1356 PolarHBondContact O-N 2.88Å; L1352-L1886 HydrophobicContact CB-CD2 4.3Å; L1352-L1886 HydrophobicContact CD1-CD2 4.21Å
1353	K	62.3	Low	62.9	Low	91 Å²	91	69.4 Å²	69.4	40%	0.396	32%	0.321	S	S	.	.	H	α-helix	trans	-71.4	-44.1	177.8	-169.3	166.9	-169.7	154.1	0	112.3	R1349 R1350 Y1351 R1356 D1357 D1883	R1349-K1353 WeakPolarHBondContact O-CB 3.5Å; R1349-K1353 PolarHBondContact O-N 2.89Å; R1350-K1353 PolarHBondContact O-N 3.34Å; Y1351-K1353 PolarHBondContact O-N 3.49Å; K1353-R1356 PolarHBondContact O-N 3.32Å; K1353-D1357 PolarHBondContact O-N 3.02Å; K1353-D1883 IonicContact NZ-OD1 2.65Å; K1353-D1883 PolarHBondContact NZ-OD1 2.71Å; K1353-D1883 IonicContact NZ-OD2 2.76Å; K1353-D1883 PolarHBondContact NZ-OD2 3.47Å
1354	L	60	Low	62.3	Low	66 Å²	66	68.7 Å²	68.7	35%	0.346	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-48	178	-174.9	69.3	0	0	0	111.6	R1350 Y1351 R1356 D1357 L1361	R1350-L1354 PolarHBondContact O-N 2.83Å; R1350-L1354 VanDerWaalsContact O-N 3.1Å; Y1351-L1354 PolarHBondContact O-N 3.34Å; Y1351-L1354 VanDerWaalsContact O-N 3.16Å; L1354-R1356 VanDerWaalsContact C-N 3.3Å; L1354-R1356 PolarHBondContact O-N 2.79Å; L1354-D1357 PolarHBondContact O-N 3.33Å; L1354-L1361 HydrophobicContact CG-CD1 4.37Å
1355	V	65.5	Low	61.6	Low	82 Å²	82	68 Å²	68	50%	0.497	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-29.9	-177.9	176.2	0	0	0	0	112.5	Y1351	Y1351-V1355 HydrophobicContact CD1-CG2 4.44Å; Y1351-V1355 HydrophobicContact CD2-CG2 4.37Å; Y1351-V1355 HydrophobicContact CE1-CG2 4.04Å; Y1351-V1355 HydrophobicContact CE2-CG2 3.97Å; Y1351-V1355 WeakPolarHBondContact O-CG2 3.41Å; Y1351-V1355 PolarHBondContact O-N 2.88Å; Y1351-V1355 VanDerWaalsContact O-N 3.09Å
1356	R	64.7	Low	61.5	Low	83 Å²	83	72 Å²	72	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-83.6	-24.8	-178.4	-76.1	179.4	172.3	174	9.9	114.5	L1352 K1353 L1354 K1358 S1885 E1890	L1352-R1356 WeakPolarHBondContact O-CB 3.44Å; L1352-R1356 WeakPolarHBondContact O-CD 3.45Å; L1352-R1356 VanDerWaalsContact O-CG 3.25Å; L1352-R1356 WeakPolarHBondContact O-CG 3.05Å; L1352-R1356 PolarHBondContact O-N 2.88Å; K1353-R1356 PolarHBondContact O-N 3.32Å; L1354-R1356 VanDerWaalsContact C-N 3.3Å; L1354-R1356 PolarHBondContact O-N 2.79Å; R1356-K1358 PolarHBondContact O-N 2.79Å; R1356-S1885 PolarHBondContact NH1-O 3.49Å; R1356-E1890 IonicContact CZ-OE1 2.66Å; R1356-E1890 IonicContact CZ-OE2 3.69Å; R1356-E1890 IonicContact NH1-OE1 3.17Å; R1356-E1890 PolarHBondContact NH1-OE1 3.17Å; R1356-E1890 IonicContact NH1-OE2 3.61Å; R1356-E1890 PolarHBondContact NH1-OE2 2.82Å; R1356-E1890 IonicContact NH2-OE1 3.14Å; R1356-E1890 PolarHBondContact NH2-OE1 3.33Å; R1356-E1890 IonicContact NH2-OE2 3.39Å; R1356-E1890 PolarHBondContact NH2-OE2 3.11Å
1357	D	60	Low	61.2	Low	72 Å²	72	73.8 Å²	73.8	39%	0.385	34%	0.343	S	S	.	.			trans	-95.5	84.6	179	-165	-14.5	0	0	0	110.5	K1353 L1354 W1359 A1360 L1361	K1353-D1357 PolarHBondContact O-N 3.02Å; L1354-D1357 PolarHBondContact O-N 3.33Å; D1357-W1359 PolarHBondContact O-N 2.85Å; D1357-W1359 VanDerWaalsContact O-N 3.16Å; D1357-W1359 PolarHBondContact OD1-N 2.87Å; D1357-A1360 HydrophobicContact CB-CB 3.85Å; D1357-A1360 WeakPolarHBondContact O-CB 3.47Å; D1357-A1360 PolarHBondContact O-N 2.93Å; D1357-A1360 PolarHBondContact OD1-N 3.44Å; D1357-L1361 PolarHBondContact O-N 2.87Å
1358	K	62.7	Low	60.8	Low	174 Å²	174	73 Å²	73	76%	0.757	34%	0.339	S	S	*	.	H	α-helix	trans	-56.5	-31.5	-177.6	-64.4	-169	176	-165.8	0	113.6	R1356 F1362	R1356-K1358 PolarHBondContact O-N 2.79Å; K1358-F1362 PolarHBondContact O-N 3.33Å; K1358-F1362 VanDerWaalsContact O-N 3.08Å
1359	W	59.3	Low	60.5	Low	143 Å²	143	70.8 Å²	70.8	54%	0.542	34%	0.34	S	S	.	.	H	α-helix	trans	-73	-39.7	177.8	-72.1	107.9	0	0	0	111.2	F789 D1357 L1361 F1362 F1363	F789-W1359 HydrophobicContact CE1-CH2 4.21Å; D1357-W1359 PolarHBondContact O-N 2.85Å; D1357-W1359 VanDerWaalsContact O-N 3.16Å; D1357-W1359 PolarHBondContact OD1-N 2.87Å; W1359-L1361 VanDerWaalsContact C-N 3.34Å; W1359-F1362 PolarHBondContact O-N 3.27Å; W1359-F1363 HydrophobicContact CE3-CD2 4.49Å; W1359-F1363 AromaticContact CE3-CE2 3.78Å; W1359-F1363 HydrophobicContact CE3-CE2 3.78Å; W1359-F1363 HydrophobicContact CE3-CZ 4.48Å; W1359-F1363 HydrophobicContact CZ3-CE2 4.38Å; W1359-F1363 VanDerWaalsContact O-CD2 3.26Å; W1359-F1363 WeakPolarHBondContact O-CD2 3.44Å; W1359-F1363 PolarHBondContact O-N 2.89Å
1360	A	52.8	Low	60.5	Low	18 Å²	18	72.2 Å²	72.2	15%	0.149	35%	0.35	C	S	.	.	H	α-helix	trans	-58.7	-47.1	170.8	0	0	0	0	0	110.8	D1357 F1362 F1363 M1364	D1357-A1360 HydrophobicContact CB-CB 3.85Å; D1357-A1360 WeakPolarHBondContact O-CB 3.47Å; D1357-A1360 PolarHBondContact O-N 2.93Å; D1357-A1360 PolarHBondContact OD1-N 3.44Å; A1360-F1362 PolarHBondContact O-N 3.11Å; A1360-F1363 PolarHBondContact O-N 3.25Å; A1360-M1364 HydrophobicContact CB-CE 4.5Å; A1360-M1364 HydrophobicContact CB-SD 3.93Å; A1360-M1364 WeakPolarHBondContact O-CB 3.5Å; A1360-M1364 WeakPolarHBondContact O-CG 3.18Å; A1360-M1364 PolarHBondContact O-N 3.11Å
1361	L	56.5	Low	60.4	Low	85 Å²	85	72.6 Å²	72.6	45%	0.445	36%	0.357	S	S	.	.	H	α-helix	trans	-57.7	-44.9	177.4	-160.5	86.1	0	0	0	112.7	L1354 D1357 W1359 V1365	L1354-L1361 HydrophobicContact CG-CD1 4.37Å; D1357-L1361 PolarHBondContact O-N 2.87Å; W1359-L1361 VanDerWaalsContact C-N 3.34Å; L1361-V1365 WeakPolarHBondContact O-CB 3.39Å; L1361-V1365 PolarHBondContact O-N 3.09Å
1362	F	58.8	Low	60.3	Low	81 Å²	81	72.7 Å²	72.7	36%	0.355	36%	0.363	S	S	.	.	I	π-helix	trans	-61.2	-53.5	177.7	176.8	-90.2	0	0	0	112.4	K1358 W1359 A1360 M1364 L1366 F1367	K1358-F1362 PolarHBondContact O-N 3.33Å; K1358-F1362 VanDerWaalsContact O-N 3.08Å; W1359-F1362 PolarHBondContact O-N 3.27Å; A1360-F1362 PolarHBondContact O-N 3.11Å; F1362-M1364 VanDerWaalsContact C-N 3.33Å; F1362-M1364 PolarHBondContact O-N 3.11Å; F1362-L1366 HydrophobicContact CD2-CB 4.37Å; F1362-L1366 HydrophobicContact CD2-CD2 3.69Å; F1362-L1366 HydrophobicContact CE2-CD2 3.71Å; F1362-L1366 PolarHBondContact O-N 3.19Å; F1362-L1366 VanDerWaalsContact O-N 3.14Å; F1362-F1367 PolarHBondContact O-N 2.96Å
1363	F	55.1	Low	60.4	Low	39 Å²	39	73.4 Å²	73.4	17%	0.171	37%	0.372	C	S	.	.	I	π-helix	trans	-73.3	-24	-176.4	-75.1	-63	0	0	0	113.9	A797 L801 W1359 A1360 P1368	A797-F1363 HydrophobicContact CB-CZ 4.25Å; L801-F1363 HydrophobicContact CD1-CE1 3.98Å; W1359-F1363 HydrophobicContact CE3-CD2 4.49Å; W1359-F1363 AromaticContact CE3-CE2 3.78Å; W1359-F1363 HydrophobicContact CE3-CE2 3.78Å; W1359-F1363 HydrophobicContact CE3-CZ 4.48Å; W1359-F1363 HydrophobicContact CZ3-CE2 4.38Å; W1359-F1363 VanDerWaalsContact O-CD2 3.26Å; W1359-F1363 WeakPolarHBondContact O-CD2 3.44Å; W1359-F1363 PolarHBondContact O-N 2.89Å; A1360-F1363 PolarHBondContact O-N 3.25Å; F1363-P1368 WeakPolarHBondContact O-CD 3.49Å
1364	M	52.7	Low	60.4	Low	33 Å²	33	74.9 Å²	74.9	16%	0.163	38%	0.381	C	S	.	.	I	π-helix	trans	-95.9	-25.3	-175.8	-63.9	174.7	163.1	0	0	113.8	A1360 F1362 A1653 V1654 E1656	A1360-M1364 HydrophobicContact CB-CE 4.5Å; A1360-M1364 HydrophobicContact CB-SD 3.93Å; A1360-M1364 WeakPolarHBondContact O-CB 3.5Å; A1360-M1364 WeakPolarHBondContact O-CG 3.18Å; A1360-M1364 PolarHBondContact O-N 3.11Å; F1362-M1364 VanDerWaalsContact C-N 3.33Å; F1362-M1364 PolarHBondContact O-N 3.11Å; M1364-A1653 CarbonylContact O-C 3.57Å; M1364-V1654 HydrophobicContact CB-CB 4.03Å; M1364-V1654 HydrophobicContact CB-CG1 3.69Å; M1364-V1654 HydrophobicContact CB-CG2 3.84Å; M1364-V1654 HydrophobicContact CG-CG1 3.96Å; M1364-V1654 WeakPolarHBondContact O-CG2 3.37Å; M1364-V1654 HydrophobicContact SD-CG1 3.57Å; M1364-V1654 VanDerWaalsContact SD-CG1 3.57Å; M1364-E1656 HydrophobicContact CE-CB 4.17Å
1365	V	53.9	Low	60.6	Low	47 Å²	47	75.5 Å²	75.5	29%	0.285	39%	0.388	S	S	.	.	I	π-helix	trans	-117	-56.5	-179	-174.9	0	0	0	0	111.6	L1361 A1369 V1654	L1361-V1365 WeakPolarHBondContact O-CB 3.39Å; L1361-V1365 PolarHBondContact O-N 3.09Å; V1365-A1369 WeakPolarHBondContact O-CB 3.21Å; V1365-A1369 PolarHBondContact O-N 3.45Å; V1365-V1654 HydrophobicContact CG2-CG2 3.9Å
1366	L	63.2	Low	60.5	Low	93 Å²	93	75.2 Å²	75.2	49%	0.487	39%	0.386	S	S	.	.	I	π-helix	trans	-72.4	-43.1	-171.9	-164.6	75.2	0	0	0	112.5	F1362 A1369 I1370	F1362-L1366 HydrophobicContact CD2-CB 4.37Å; F1362-L1366 HydrophobicContact CD2-CD2 3.69Å; F1362-L1366 HydrophobicContact CE2-CD2 3.71Å; F1362-L1366 PolarHBondContact O-N 3.19Å; F1362-L1366 VanDerWaalsContact O-N 3.14Å; L1366-A1369 PolarHBondContact O-N 3.43Å; L1366-I1370 HydrophobicContact CD2-CD1 4.31Å; L1366-I1370 HydrophobicContact CG-CD1 4.01Å; L1366-I1370 WeakPolarHBondContact O-CG1 3.42Å; L1366-I1370 PolarHBondContact O-N 2.87Å
1367	F	61.2	Low	60.5	Low	55 Å²	55	77.8 Å²	77.8	24%	0.241	40%	0.4	C	S	.	.	H	α-helix	trans	-64.7	-45.8	-177.6	178	-99.2	0	0	0	113.3	L801 F1362 A1369 I1370 L1371	L801-F1367 HydrophobicContact CD2-CE2 3.66Å; L801-F1367 HydrophobicContact CD2-CZ 3.81Å; F1362-F1367 PolarHBondContact O-N 2.96Å; F1367-A1369 VanDerWaalsContact C-N 3.31Å; F1367-A1369 PolarHBondContact O-N 3.01Å; F1367-I1370 PolarHBondContact O-N 3.39Å; F1367-L1371 HydrophobicContact CD1-CD1 4.09Å; F1367-L1371 HydrophobicContact CE1-CD1 3.45Å; F1367-L1371 VanDerWaalsContact CE1-CD1 3.45Å; F1367-L1371 HydrophobicContact CE1-CG 4.27Å; F1367-L1371 HydrophobicContact CE2-CD1 4.43Å; F1367-L1371 HydrophobicContact CE2-CG 4.48Å; F1367-L1371 HydrophobicContact CZ-CD1 3.65Å; F1367-L1371 HydrophobicContact CZ-CG 4.15Å; F1367-L1371 PolarHBondContact O-N 3.17Å
1368	P	56.7	Low	60.4	Low	22 Å²	22	77.1 Å²	77.1	14%	0.143	40%	0.404	C	S	.	.	H	α-helix	trans	-62.2	-34.4	171.6	-24.5	35.6	0	0	0	113.7	F1363 L1371 L1372 A1653	F1363-P1368 WeakPolarHBondContact O-CD 3.49Å; P1368-L1371 PolarHBondContact O-N 3.49Å; P1368-L1372 VanDerWaalsContact O-CB 3.32Å; P1368-L1372 WeakPolarHBondContact O-CB 3.48Å; P1368-L1372 PolarHBondContact O-N 3.4Å; P1368-A1653 HydrophobicContact CB-CB 3.52Å; P1368-A1653 HydrophobicContact CG-CB 3.91Å
1369	A	61.8	Low	60.3	Low	55 Å²	55	73 Å²	73	46%	0.455	39%	0.39	S	S	.	.	H	α-helix	trans	-67.9	-38.4	176.7	0	0	0	0	0	112.5	V1365 L1366 F1367 L1372 S1373	V1365-A1369 WeakPolarHBondContact O-CB 3.21Å; V1365-A1369 PolarHBondContact O-N 3.45Å; L1366-A1369 PolarHBondContact O-N 3.43Å; F1367-A1369 VanDerWaalsContact C-N 3.31Å; F1367-A1369 PolarHBondContact O-N 3.01Å; A1369-L1372 PolarHBondContact O-N 2.87Å; A1369-S1373 WeakPolarHBondContact O-CB 3.3Å; A1369-S1373 PolarHBondContact O-N 3.24Å
1370	I	68.6	Low	60.4	Low	76 Å²	76	69.8 Å²	69.8	39%	0.39	39%	0.389	S	S	.	.	H	α-helix	trans	-64.2	-46.4	172.9	-67.7	163.9	0	0	0	110.4	L1366 F1367 S1373 M1374	L1366-I1370 HydrophobicContact CD2-CD1 4.31Å; L1366-I1370 HydrophobicContact CG-CD1 4.01Å; L1366-I1370 WeakPolarHBondContact O-CG1 3.42Å; L1366-I1370 PolarHBondContact O-N 2.87Å; F1367-I1370 PolarHBondContact O-N 3.39Å; I1370-S1373 PolarHBondContact O-N 3.4Å; I1370-M1374 HydrophobicContact CG2-CE 4.49Å; I1370-M1374 HydrophobicContact CG2-SD 4.16Å; I1370-M1374 WeakPolarHBondContact O-CG 3.3Å; I1370-M1374 PolarHBondContact O-N 3.17Å
1371	L	62.2	Low	60.7	Low	81 Å²	81	73.4 Å²	73.4	42%	0.424	41%	0.405	S	S	.	.	H	α-helix	trans	-62.7	-42.3	176.5	-74.3	178.5	0	0	0	112.2	F1367 P1368 S1373 M1374 V1375	F1367-L1371 HydrophobicContact CD1-CD1 4.09Å; F1367-L1371 HydrophobicContact CE1-CD1 3.45Å; F1367-L1371 VanDerWaalsContact CE1-CD1 3.45Å; F1367-L1371 HydrophobicContact CE1-CG 4.27Å; F1367-L1371 HydrophobicContact CE2-CD1 4.43Å; F1367-L1371 HydrophobicContact CE2-CG 4.48Å; F1367-L1371 HydrophobicContact CZ-CD1 3.65Å; F1367-L1371 HydrophobicContact CZ-CG 4.15Å; F1367-L1371 PolarHBondContact O-N 3.17Å; P1368-L1371 PolarHBondContact O-N 3.49Å; L1371-S1373 VanDerWaalsContact C-N 3.34Å; L1371-S1373 PolarHBondContact O-N 3.17Å; L1371-M1374 PolarHBondContact O-N 2.98Å; L1371-V1375 WeakPolarHBondContact O-CG2 3.3Å; L1371-V1375 PolarHBondContact O-N 3.24Å
1372	L	63.1	Low	60.5	Low	87 Å²	87	72 Å²	72	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-61.3	-44.1	175.2	-175.5	63.8	0	0	0	110.6	P1368 A1369 M1374 V1375 T1376	P1368-L1372 VanDerWaalsContact O-CB 3.32Å; P1368-L1372 WeakPolarHBondContact O-CB 3.48Å; P1368-L1372 PolarHBondContact O-N 3.4Å; A1369-L1372 PolarHBondContact O-N 2.87Å; L1372-M1374 VanDerWaalsContact C-N 3.34Å; L1372-M1374 PolarHBondContact O-N 3.04Å; L1372-V1375 PolarHBondContact O-N 2.81Å; L1372-T1376 HydrophobicContact CD1-CG2 4.45Å; L1372-T1376 WeakPolarHBondContact O-CG2 3.25Å; L1372-T1376 PolarHBondContact O-N 2.83Å; L1372-T1376 PolarHBondContact O-OG1 3.42Å; L1372-T1376 VanDerWaalsContact O-OG1 3.11Å
1373	S	67.9	Low	60.1	Low	59 Å²	59	71 Å²	71	41%	0.413	40%	0.404	S	S	.	.	H	α-helix	trans	-62.7	-38.4	175.8	-174	0	0	0	0	112.9	A1369 I1370 L1371 T1376 K1377	A1369-S1373 WeakPolarHBondContact O-CB 3.3Å; A1369-S1373 PolarHBondContact O-N 3.24Å; I1370-S1373 PolarHBondContact O-N 3.4Å; L1371-S1373 VanDerWaalsContact C-N 3.34Å; L1371-S1373 PolarHBondContact O-N 3.17Å; S1373-T1376 WeakPolarHBondContact CA-OG1 3.09Å; S1373-T1376 PolarHBondContact O-OG1 3.12Å; S1373-K1377 WeakPolarHBondContact O-CB 3.25Å; S1373-K1377 WeakPolarHBondContact O-CG 3.47Å; S1373-K1377 PolarHBondContact O-N 3.46Å
1374	M	62.9	Low	59.8	Low	121 Å²	121	71.7 Å²	71.7	60%	0.596	41%	0.414	S	S	*	.	H	α-helix	trans	-65.6	-43.9	173.6	-76.5	176.2	154.6	0	0	111.6	I1370 L1371 L1372 K1377 A1378	I1370-M1374 HydrophobicContact CG2-CE 4.49Å; I1370-M1374 HydrophobicContact CG2-SD 4.16Å; I1370-M1374 WeakPolarHBondContact O-CG 3.3Å; I1370-M1374 PolarHBondContact O-N 3.17Å; L1371-M1374 PolarHBondContact O-N 2.98Å; L1372-M1374 VanDerWaalsContact C-N 3.34Å; L1372-M1374 PolarHBondContact O-N 3.04Å; M1374-K1377 PolarHBondContact O-N 3.32Å; M1374-A1378 WeakPolarHBondContact O-CB 3.49Å; M1374-A1378 PolarHBondContact O-N 3.13Å
1375	V	63	Low	59.4	Low	79 Å²	79	73.4 Å²	73.4	48%	0.479	43%	0.426	S	S	.	.	H	α-helix	trans	-66.8	-43.7	177.3	170.7	0	0	0	0	111.2	L1371 L1372 K1377 A1378 I1379	L1371-V1375 WeakPolarHBondContact O-CG2 3.3Å; L1371-V1375 PolarHBondContact O-N 3.24Å; L1372-V1375 PolarHBondContact O-N 2.81Å; V1375-K1377 VanDerWaalsContact C-N 3.28Å; V1375-K1377 PolarHBondContact O-N 3.26Å; V1375-A1378 PolarHBondContact O-N 3.22Å; V1375-I1379 HydrophobicContact CG1-CD1 3.72Å; V1375-I1379 HydrophobicContact CG1-CG1 4.35Å; V1375-I1379 WeakPolarHBondContact O-CB 3.41Å; V1375-I1379 VanDerWaalsContact O-CG1 3.3Å; V1375-I1379 WeakPolarHBondContact O-CG1 3.33Å; V1375-I1379 PolarHBondContact O-N 3.1Å
1376	T	63	Low	58.8	Low	76 Å²	76	72.5 Å²	72.5	47%	0.466	43%	0.426	S	S	.	.	H	α-helix	trans	-64.3	-33.9	175.2	54.2	0	0	0	0	112.1	L1372 S1373 S1380	L1372-T1376 HydrophobicContact CD1-CG2 4.45Å; L1372-T1376 WeakPolarHBondContact O-CG2 3.25Å; L1372-T1376 PolarHBondContact O-N 2.83Å; L1372-T1376 PolarHBondContact O-OG1 3.42Å; L1372-T1376 VanDerWaalsContact O-OG1 3.11Å; S1373-T1376 WeakPolarHBondContact CA-OG1 3.09Å; S1373-T1376 PolarHBondContact O-OG1 3.12Å; T1376-S1380 WeakPolarHBondContact O-CB 3.42Å; T1376-S1380 PolarHBondContact O-N 2.99Å
1377	K	65.6	Low	57.4	Low	138 Å²	138	72.7 Å²	72.7	60%	0.6	43%	0.428	S	S	*	.	H	α-helix	trans	-70.6	-40.2	172.3	-79.3	-174.2	175.1	-165.3	0	112.1	S1373 M1374 V1375 S1380 I1381	S1373-K1377 WeakPolarHBondContact O-CB 3.25Å; S1373-K1377 WeakPolarHBondContact O-CG 3.47Å; S1373-K1377 PolarHBondContact O-N 3.46Å; M1374-K1377 PolarHBondContact O-N 3.32Å; V1375-K1377 VanDerWaalsContact C-N 3.28Å; V1375-K1377 PolarHBondContact O-N 3.26Å; K1377-S1380 PolarHBondContact O-N 2.93Å; K1377-I1381 WeakPolarHBondContact O-CB 3.44Å; K1377-I1381 WeakPolarHBondContact O-CD1 3.43Å; K1377-I1381 VanDerWaalsContact O-CG1 3.24Å; K1377-I1381 WeakPolarHBondContact O-CG1 3.3Å; K1377-I1381 PolarHBondContact O-N 3.38Å
1378	A	58	Low	56	Low	58 Å²	58	77 Å²	77	48%	0.479	45%	0.451	S	S	.	.	H	α-helix	trans	-64.3	-42.9	176	0	0	0	0	0	111.7	M1374 V1375 I1381 A1382	M1374-A1378 WeakPolarHBondContact O-CB 3.49Å; M1374-A1378 PolarHBondContact O-N 3.13Å; V1375-A1378 PolarHBondContact O-N 3.22Å; A1378-I1381 PolarHBondContact O-N 3.49Å; A1378-A1382 WeakPolarHBondContact O-CB 3.49Å; A1378-A1382 PolarHBondContact O-N 3.37Å
1379	I	59.2	Low	55	Low	87 Å²	87	81.5 Å²	81.5	45%	0.446	47%	0.471	S	S	.	.	H	α-helix	trans	-64	-41.8	172.2	-65.5	166.1	0	0	0	110.5	V1375 I1381 A1382 N1383	V1375-I1379 HydrophobicContact CG1-CD1 3.72Å; V1375-I1379 HydrophobicContact CG1-CG1 4.35Å; V1375-I1379 WeakPolarHBondContact O-CB 3.41Å; V1375-I1379 VanDerWaalsContact O-CG1 3.3Å; V1375-I1379 WeakPolarHBondContact O-CG1 3.33Å; V1375-I1379 PolarHBondContact O-N 3.1Å; I1379-I1381 VanDerWaalsContact C-N 3.31Å; I1379-I1381 PolarHBondContact O-N 2.94Å; I1379-A1382 PolarHBondContact O-N 3.21Å; I1379-N1383 WeakPolarHBondContact O-CB 3.32Å; I1379-N1383 VanDerWaalsContact O-CG 3.27Å; I1379-N1383 PolarHBondContact O-N 3.05Å; I1379-N1383 PolarHBondContact O-OD1 2.9Å
1380	S	61.7	Low	53.8	Low	75 Å²	75	82.4 Å²	82.4	52%	0.524	47%	0.468	S	S	.	.	H	α-helix	trans	-63.4	-35.6	175.5	-175.5	0	0	0	0	112.8	T1376 K1377 S1384	T1376-S1380 WeakPolarHBondContact O-CB 3.42Å; T1376-S1380 PolarHBondContact O-N 2.99Å; K1377-S1380 PolarHBondContact O-N 2.93Å; S1380-S1384 WeakPolarHBondContact O-CB 3.43Å; S1380-S1384 PolarHBondContact O-N 3.28Å; S1380-S1384 PolarHBondContact O-OG 3.32Å
1381	I	60.3	Low	52.3	Low	95 Å²	95	83.7 Å²	83.7	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-69.8	-48.6	174.8	-69.7	161.9	0	0	0	109.4	K1377 A1378 I1379 N1383 S1384 T1385	K1377-I1381 WeakPolarHBondContact O-CB 3.44Å; K1377-I1381 WeakPolarHBondContact O-CD1 3.43Å; K1377-I1381 VanDerWaalsContact O-CG1 3.24Å; K1377-I1381 WeakPolarHBondContact O-CG1 3.3Å; K1377-I1381 PolarHBondContact O-N 3.38Å; A1378-I1381 PolarHBondContact O-N 3.49Å; I1379-I1381 VanDerWaalsContact C-N 3.31Å; I1379-I1381 PolarHBondContact O-N 2.94Å; I1381-N1383 VanDerWaalsContact C-N 3.35Å; I1381-N1383 PolarHBondContact O-N 2.79Å; I1381-S1384 WeakPolarHBondContact CA-OG 3.48Å; I1381-S1384 PolarHBondContact O-N 3.14Å; I1381-S1384 VanDerWaalsContact O-N 3.1Å; I1381-S1384 PolarHBondContact O-OG 3.06Å; I1381-T1385 PolarHBondContact O-N 3.34Å; I1381-T1385 PolarHBondContact O-OG1 2.92Å
1382	A	52.1	Low	51.2	Low	56 Å²	56	86.1 Å²	86.1	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-59.8	-41.3	178.1	0	0	0	0	0	112.8	A1378 I1379 T1385 G1386	A1378-A1382 WeakPolarHBondContact O-CB 3.49Å; A1378-A1382 PolarHBondContact O-N 3.37Å; I1379-A1382 PolarHBondContact O-N 3.21Å; A1382-T1385 WeakPolarHBondContact CA-OG1 3.33Å; A1382-T1385 PolarHBondContact O-N 3.14Å; A1382-T1385 PolarHBondContact O-OG1 2.75Å; A1382-G1386 PolarHBondContact O-N 2.68Å; A1382-G1386 VanDerWaalsContact O-N 3.16Å
1383	N	50.4	Low	50.4	Low	60 Å²	60	86 Å²	86	32%	0.321	49%	0.492	S	S	.	.	H	α-helix	trans	-68.5	-40.5	173.6	-70.3	13.9	0	0	0	111	I1379 I1381 T1385 G1386 N1387	I1379-N1383 WeakPolarHBondContact O-CB 3.32Å; I1379-N1383 VanDerWaalsContact O-CG 3.27Å; I1379-N1383 PolarHBondContact O-N 3.05Å; I1379-N1383 PolarHBondContact O-OD1 2.9Å; I1381-N1383 VanDerWaalsContact C-N 3.35Å; I1381-N1383 PolarHBondContact O-N 2.79Å; N1383-T1385 VanDerWaalsContact C-N 3.29Å; N1383-T1385 PolarHBondContact O-N 3.29Å; N1383-G1386 WeakPolarHBondContact O-CA 3.22Å; N1383-G1386 PolarHBondContact O-N 2.89Å; N1383-N1387 PolarHBondContact O-N 2.83Å; N1383-N1387 PolarHBondContact O-OD1 3.36Å; N1383-N1387 VanDerWaalsContact O-OD1 3.09Å
1384	S	49.3	Very low	49	Very low	53 Å²	53	88.8 Å²	88.8	37%	0.371	50%	0.499	S	S	.	.	H	α-helix	trans	-64	-33.4	175.5	67.5	0	0	0	0	112.9	S1380 I1381 G1386 M1388	S1380-S1384 WeakPolarHBondContact O-CB 3.43Å; S1380-S1384 PolarHBondContact O-N 3.28Å; S1380-S1384 PolarHBondContact O-OG 3.32Å; I1381-S1384 WeakPolarHBondContact CA-OG 3.48Å; I1381-S1384 PolarHBondContact O-N 3.14Å; I1381-S1384 VanDerWaalsContact O-N 3.1Å; I1381-S1384 PolarHBondContact O-OG 3.06Å; S1384-G1386 VanDerWaalsContact C-N 3.3Å; S1384-M1388 VanDerWaalsContact O-CB 3.31Å; S1384-M1388 WeakPolarHBondContact O-CB 3.35Å; S1384-M1388 VanDerWaalsContact O-CG 3.23Å; S1384-M1388 WeakPolarHBondContact O-CG 3.36Å; S1384-M1388 PolarHBondContact O-N 3.3Å
1385	T	44	Very low	48.2	Very low	69 Å²	69	84.2 Å²	84.2	42%	0.423	48%	0.476	S	S	.	.	H	α-helix	trans	-72.6	-21.9	172.9	47.1	0	0	0	0	113.3	I1381 A1382 N1383	I1381-T1385 PolarHBondContact O-N 3.34Å; I1381-T1385 PolarHBondContact O-OG1 2.92Å; A1382-T1385 WeakPolarHBondContact CA-OG1 3.33Å; A1382-T1385 PolarHBondContact O-N 3.14Å; A1382-T1385 PolarHBondContact O-OG1 2.75Å; N1383-T1385 VanDerWaalsContact C-N 3.29Å; N1383-T1385 PolarHBondContact O-N 3.29Å
1386	G	39.9	Very low	47.2	Very low	28 Å²	28	81.9 Å²	81.9	29%	0.289	46%	0.462	S	S	.	.	H	α-helix	trans	-73.7	-58.7	168.3	0	0	0	0	0	111.2	A1382 N1383 S1384 M1388 M1389 D1390	A1382-G1386 PolarHBondContact O-N 2.68Å; A1382-G1386 VanDerWaalsContact O-N 3.16Å; N1383-G1386 WeakPolarHBondContact O-CA 3.22Å; N1383-G1386 PolarHBondContact O-N 2.89Å; S1384-G1386 VanDerWaalsContact C-N 3.3Å; G1386-M1388 VanDerWaalsContact C-N 3.28Å; G1386-M1388 PolarHBondContact O-N 3.11Å; G1386-M1389 WeakPolarHBondContact O-CA 3.2Å; G1386-M1389 WeakPolarHBondContact O-CB 3.41Å; G1386-M1389 PolarHBondContact O-N 3.38Å; G1386-D1390 PolarHBondContact O-N 2.67Å
1387	N	35.5	Very low	46.6	Very low	96 Å²	96	78.8 Å²	78.8	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-58.3	-34.1	-179.9	-74.4	71.4	0	0	0	113.8	N1383 M1389 D1390 D1391	N1383-N1387 PolarHBondContact O-N 2.83Å; N1383-N1387 PolarHBondContact O-OD1 3.36Å; N1383-N1387 VanDerWaalsContact O-OD1 3.09Å; N1387-M1389 PolarHBondContact O-N 2.89Å; N1387-D1390 PolarHBondContact O-N 3.39Å; N1387-D1391 PolarHBondContact O-N 3.13Å; N1387-D1391 VanDerWaalsContact O-N 3.17Å
1388	M	30.4	Very low	45.8	Very low	147 Å²	147	74.3 Å²	74.3	72%	0.724	42%	0.424	S	S	*	.	H	α-helix	trans	-70.7	-10.4	174	-72	-174.9	87.5	0	0	114.1	S1384 G1386	S1384-M1388 VanDerWaalsContact O-CB 3.31Å; S1384-M1388 WeakPolarHBondContact O-CB 3.35Å; S1384-M1388 VanDerWaalsContact O-CG 3.23Å; S1384-M1388 WeakPolarHBondContact O-CG 3.36Å; S1384-M1388 PolarHBondContact O-N 3.3Å; G1386-M1388 VanDerWaalsContact C-N 3.28Å; G1386-M1388 PolarHBondContact O-N 3.11Å
1389	M	36.1	Very low	45	Very low	115 Å²	115	74 Å²	74	57%	0.567	42%	0.418	S	S	*	.	H	α-helix	trans	-93.9	-33.1	168.9	-71.2	-170.2	168.1	0	0	112.6	G1386 N1387	G1386-M1389 WeakPolarHBondContact O-CA 3.2Å; G1386-M1389 WeakPolarHBondContact O-CB 3.41Å; G1386-M1389 PolarHBondContact O-N 3.38Å; N1387-M1389 PolarHBondContact O-N 2.89Å
1390	D	37.1	Very low	44.3	Very low	74 Å²	74	72.5 Å²	72.5	40%	0.396	42%	0.416	S	S	.	.	H	α-helix	trans	-76.3	-36	-178.5	-69.8	-53.7	0	0	0	113.5	G1386 N1387 S1606	G1386-D1390 PolarHBondContact O-N 2.67Å; N1387-D1390 PolarHBondContact O-N 3.39Å; D1390-S1606 PolarHBondContact OD1-OG 2.84Å
1391	D	36.3	Very low	43.1	Very low	103 Å²	103	75.9 Å²	75.9	55%	0.551	43%	0.433	S	S	*	.	S	Bend	trans	-97.3	-30.8	-168.1	-73.5	-43	0	0	0	116.5	N1387	N1387-D1391 PolarHBondContact O-N 3.13Å; N1387-D1391 VanDerWaalsContact O-N 3.17Å
1392	D	40.3	Very low	42.1	Very low	132 Å²	132	74.8 Å²	74.8	71%	0.706	45%	0.445	S	S	*	.			trans	-134.8	33.1	-156	-89.5	-37.8	0	0	0	117.9	E1394	D1392-E1394 PolarHBondContact O-N 3.2Å
1393	V	45.6	Very low	41.5	Very low	86 Å²	86	77.9 Å²	77.9	52%	0.521	45%	0.454	S	S	.	.			trans	-82.8	75.5	172.3	-167.6	0	0	0	0	112.2	M1395	V1393-M1395 VanDerWaalsContact C-N 3.34Å; V1393-M1395 HydrophobicContact CG1-CE 4.19Å; V1393-M1395 HydrophobicContact CG1-CG 3.84Å; V1393-M1395 PolarHBondContact O-N 3.16Å
1394	E	37.3	Very low	41.2	Very low	117 Å²	117	79.4 Å²	79.4	55%	0.547	47%	0.469	S	S	.	.			trans	-62.7	91.8	164.9	-79.8	-158.8	147	0	0	110.8	D1392 T1396 S1399	D1392-E1394 PolarHBondContact O-N 3.2Å; E1394-T1396 PolarHBondContact O-N 2.95Å; E1394-S1399 WeakPolarHBondContact O-CB 3.49Å; E1394-S1399 PolarHBondContact O-OG 2.95Å
1395	M	46.6	Very low	41.3	Very low	24 Å²	24	80.1 Å²	80.1	12%	0.118	47%	0.468	C	S	.	.			trans	-74.5	50.7	170.4	-66.4	-147.5	-156.5	0	0	112.6	V1393 S1602 L1604	V1393-M1395 VanDerWaalsContact C-N 3.34Å; V1393-M1395 HydrophobicContact CG1-CE 4.19Å; V1393-M1395 HydrophobicContact CG1-CG 3.84Å; V1393-M1395 PolarHBondContact O-N 3.16Å; M1395-S1602 WeakPolarHBondContact CE-OG 3.18Å; M1395-S1602 PolarHBondContact SD-OG 3.03Å; M1395-L1604 HydrophobicContact CE-CD1 4.43Å
1396	T	43.4	Very low	41.7	Very low	30 Å²	30	77.6 Å²	77.6	18%	0.184	46%	0.455	C	S	.	.			trans	-59.2	144.9	156.7	76.6	0	0	0	0	107.8	E1394 F1398 S1399	E1394-T1396 PolarHBondContact O-N 2.95Å; T1396-F1398 PolarHBondContact O-N 3.02Å; T1396-S1399 PolarHBondContact O-N 3.45Å; T1396-S1399 PolarHBondContact O-OG 2.94Å; T1396-S1399 WeakPolarHBondContact OG1-CB 3.13Å
1397	P	48.7	Very low	42.7	Very low	12 Å²	12	78 Å²	78	8%	0.078	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-10.4	-165.2	14.9	-28.9	0	0	0	116	M1430 I1580	P1397-M1430 HydrophobicContact CB-CE 4.27Å; P1397-M1430 HydrophobicContact CG-CE 3.58Å; P1397-I1580 HydrophobicContact CB-CG1 4.34Å
1398	F	48.6	Very low	44	Very low	43 Å²	43	74.7 Å²	74.7	19%	0.189	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	33.7	-178.7	-62.3	-72.2	0	0	0	114.7	T1396 S1400 L1405 I1407 M1430 F1431 I1580	T1396-F1398 PolarHBondContact O-N 3.02Å; F1398-S1400 VanDerWaalsContact C-N 3.32Å; F1398-S1400 PolarHBondContact O-N 2.95Å; F1398-L1405 HydrophobicContact CD1-CD1 3.96Å; F1398-I1407 HydrophobicContact CE1-CD1 4.06Å; F1398-I1407 HydrophobicContact CZ-CD1 4.23Å; F1398-M1430 HydrophobicContact CD2-CE 4.45Å; F1398-M1430 HydrophobicContact CE2-CE 4.07Å; F1398-M1430 HydrophobicContact CE2-SD 4.39Å; F1398-F1431 HydrophobicContact CE1-CE1 4.44Å; F1398-F1431 HydrophobicContact CE2-CE1 4.09Å; F1398-F1431 HydrophobicContact CE2-CZ 4.38Å; F1398-F1431 AromaticContact CZ-CE1 3.95Å; F1398-F1431 HydrophobicContact CZ-CE1 3.95Å; F1398-F1431 AromaticContact CZ-CZ 3.94Å; F1398-F1431 HydrophobicContact CZ-CZ 3.94Å; F1398-I1580 HydrophobicContact CE1-CD1 4.08Å; F1398-I1580 HydrophobicContact CE2-CD1 4.39Å; F1398-I1580 HydrophobicContact CZ-CD1 3.67Å; F1398-I1580 HydrophobicContact CZ-CG1 4.22Å
1399	S	43.1	Very low	45.7	Very low	51 Å²	51	69.8 Å²	69.8	36%	0.357	41%	0.405	S	S	.	.			trans	-75.5	3.5	-176.2	52.5	0	0	0	0	117.6	E1394 T1396 V1401	E1394-S1399 WeakPolarHBondContact O-CB 3.49Å; E1394-S1399 PolarHBondContact O-OG 2.95Å; T1396-S1399 PolarHBondContact O-N 3.45Å; T1396-S1399 PolarHBondContact O-OG 2.94Å; T1396-S1399 WeakPolarHBondContact OG1-CB 3.13Å; S1399-V1401 PolarHBondContact O-N 2.63Å; S1399-V1401 VanDerWaalsContact O-N 3.14Å
1400	S	42.5	Very low	47	Very low	57 Å²	57	66 Å²	66	40%	0.399	39%	0.387	S	S	.	.			trans	-75.7	104.3	178.2	50.9	0	0	0	0	111.7	F1398 G1402	F1398-S1400 VanDerWaalsContact C-N 3.32Å; F1398-S1400 PolarHBondContact O-N 2.95Å; S1400-G1402 PolarHBondContact O-N 3.11Å
1401	V	37.7	Very low	48.2	Very low	146 Å²	146	64.4 Å²	64.4	89%	0.885	38%	0.377	S	S	*	.			trans	-62.9	116.1	174.6	178.6	0	0	0	0	110.6	S1399	S1399-V1401 PolarHBondContact O-N 2.63Å; S1399-V1401 VanDerWaalsContact O-N 3.14Å
1402	G	39.1	Very low	49.1	Very low	72 Å²	72	63.3 Å²	63.3	74%	0.742	37%	0.374	S	S	*	.	S	Bend	trans	126	-41.9	157.7	0	0	0	0	0	117.1	S1400	S1400-G1402 PolarHBondContact O-N 3.11Å
1403	D	38.9	Very low	49.7	Very low	121 Å²	121	60 Å²	60	65%	0.647	35%	0.354	S	S	*	.	S	Bend	trans	-106.6	150.6	-159.4	-61.4	-31.8	0	0	0	115.3	L1405	D1403-L1405 PolarHBondContact O-N 3.23Å; D1403-L1405 VanDerWaalsContact O-N 3.12Å
1404	S	45	Very low	50	Low	92 Å²	92	59.9 Å²	59.9	64%	0.643	36%	0.355	S	S	*	.			trans	-66.4	100.8	-174.1	-49.8	0	0	0	0	113.9	A1406 S1492	S1404-A1406 PolarHBondContact O-N 3.04Å; S1404-S1492 PolarHBondContact O-OG 3.12Å
1405	L	50.8	Low	50.8	Low	67 Å²	67	59.6 Å²	59.6	35%	0.351	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	114.1	-174.9	-66.4	162.9	0	0	0	113.4	F1398 D1403 T1494	F1398-L1405 HydrophobicContact CD1-CD1 3.96Å; D1403-L1405 PolarHBondContact O-N 3.23Å; D1403-L1405 VanDerWaalsContact O-N 3.12Å; L1405-T1494 HydrophobicContact CD2-CG2 3.4Å
1406	A	53.3	Low	51.4	Low	17 Å²	17	58.6 Å²	58.6	14%	0.14	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	139.4	173	0	0	0	0	0	113.2	S1404 A1491 W1493 T1494	S1404-A1406 PolarHBondContact O-N 3.04Å; A1406-A1491 HydrophobicContact CB-CB 3.82Å; A1406-W1493 HydrophobicContact CB-CD2 3.99Å; A1406-W1493 HydrophobicContact CB-CE3 3.59Å; A1406-W1493 HydrophobicContact CB-CH2 4.25Å; A1406-W1493 HydrophobicContact CB-CZ3 3.73Å; A1406-T1494 PolarHBondContact O-N 2.8Å; A1406-T1494 PolarHBondContact O-OG1 3.2Å
1407	I	59.5	Low	51.8	Low	35 Å²	35	62.1 Å²	62.1	18%	0.179	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	133	175.2	-60	178.7	0	0	0	108.7	F1398 F1409 G1495 F1497 I1580	F1398-I1407 HydrophobicContact CE1-CD1 4.06Å; F1398-I1407 HydrophobicContact CZ-CD1 4.23Å; I1407-F1409 HydrophobicContact CB-CE2 4.46Å; I1407-F1409 HydrophobicContact CG2-CE2 3.8Å; I1407-F1409 HydrophobicContact CG2-CZ 3.88Å; I1407-G1495 WeakPolarHBondContact CA-O 3.27Å; I1407-F1497 HydrophobicContact CG2-CD2 4.09Å; I1407-F1497 HydrophobicContact CG2-CE2 3.82Å; I1407-I1580 HydrophobicContact CD1-CD1 4.04Å
1408	F	64.4	Low	52.3	Low	27 Å²	27	65.8 Å²	65.8	12%	0.118	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	156	176.6	76.6	-76.1	0	0	0	112.7	F672 L1482 W1493 G1496 F1497 W1565	F672-F1408 AromaticContact CE1-CE1 3.58Å; F672-F1408 HydrophobicContact CE1-CE1 3.58Å; F672-F1408 HydrophobicContact CE1-CZ 4.21Å; F672-F1408 AromaticContact CZ-CE1 3.91Å; F672-F1408 HydrophobicContact CZ-CE1 3.91Å; F1408-L1482 HydrophobicContact CD1-CD2 4.1Å; F1408-L1482 HydrophobicContact CE1-CD2 3.85Å; F1408-L1482 HydrophobicContact CZ-CD1 4.07Å; F1408-L1482 HydrophobicContact CZ-CD2 4.11Å; F1408-W1493 HydrophobicContact CB-CE3 4.42Å; F1408-W1493 HydrophobicContact CB-CH2 4.25Å; F1408-W1493 HydrophobicContact CB-CZ3 3.73Å; F1408-W1493 HydrophobicContact CD1-CE3 4.27Å; F1408-W1493 HydrophobicContact CD1-CZ3 4.41Å; F1408-G1496 VanDerWaalsContact CE1-CA 3.42Å; F1408-G1496 CarbonylContact O-C 3.57Å; F1408-G1496 WeakPolarHBondContact O-CA 3.49Å; F1408-F1497 PolarHBondContact O-N 3.14Å; F1408-W1565 HydrophobicContact CE1-CB 3.89Å; F1408-W1565 HydrophobicContact CE1-CG 4.23Å; F1408-W1565 HydrophobicContact CZ-CB 3.72Å; F1408-W1565 AromaticContact CZ-CD1 3.58Å; F1408-W1565 HydrophobicContact CZ-CD2 4.14Å; F1408-W1565 AromaticContact CZ-CG 3.55Å; F1408-W1565 HydrophobicContact CZ-CG 3.55Å
1409	F	64.7	Low	52.9	Low	44 Å²	44	66 Å²	66	19%	0.193	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.7	178.9	-64.9	-88.3	0	0	0	110.1	I1407 F1411 L1427 F1497	I1407-F1409 HydrophobicContact CB-CE2 4.46Å; I1407-F1409 HydrophobicContact CG2-CE2 3.8Å; I1407-F1409 HydrophobicContact CG2-CZ 3.88Å; F1409-F1411 HydrophobicContact CB-CD2 4.4Å; F1409-F1411 HydrophobicContact CB-CE2 4.01Å; F1409-F1411 AromaticContact CD1-CE2 3.66Å; F1409-F1411 HydrophobicContact CD1-CE2 3.66Å; F1409-F1411 AromaticContact CD1-CZ 3.9Å; F1409-F1411 HydrophobicContact CD1-CZ 3.9Å; F1409-F1411 HydrophobicContact CG-CE2 4.27Å; F1409-L1427 HydrophobicContact CE1-CD1 3.67Å; F1409-L1427 HydrophobicContact CE2-CD1 4.37Å; F1409-L1427 HydrophobicContact CZ-CD1 3.44Å; F1409-L1427 VanDerWaalsContact CZ-CD1 3.44Å; F1409-F1497 CarbonylContact C-O 3.56Å; F1409-F1497 WeakPolarHBondContact CA-O 3.38Å; F1409-F1497 HydrophobicContact CD1-CB 4.18Å; F1409-F1497 AromaticContact CD1-CD2 3.79Å; F1409-F1497 HydrophobicContact CD1-CD2 3.79Å; F1409-F1497 HydrophobicContact CD1-CG 4.43Å; F1409-F1497 HydrophobicContact CE1-CB 4.49Å; F1409-F1497 AromaticContact CE1-CD2 3.34Å; F1409-F1497 HydrophobicContact CE1-CD2 3.34Å; F1409-F1497 AromaticContact CE1-CE2 3.93Å; F1409-F1497 HydrophobicContact CE1-CE2 3.93Å; F1409-F1497 HydrophobicContact CE1-CG 4.27Å; F1409-F1497 AromaticContact CZ-CD2 3.94Å; F1409-F1497 HydrophobicContact CZ-CD2 3.94Å; F1409-F1497 HydrophobicContact CZ-CE2 4.17Å
1410	N	63.2	Low	53.7	Low	36 Å²	36	64.3 Å²	64.3	19%	0.193	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	90.1	176.5	-171.7	19.6	0	0	0	111.6	E1478 F1497 S1498 G1499	N1410-E1478 PolarHBondContact ND2-OE1 3.43Å; N1410-F1497 PolarHBondContact N-O 3.5Å; N1410-S1498 CarbonylContact O-C 3.52Å; N1410-S1498 WeakPolarHBondContact O-CA 3.47Å; N1410-S1498 WeakPolarHBondContact O-CB 3.42Å; N1410-G1499 PolarHBondContact O-N 3.44Å
1411	F	63.7	Low	54.5	Low	41 Å²	41	65.1 Å²	65.1	18%	0.18	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	106.6	179.9	-59.9	-60.7	0	0	0	110.4	F1409 I1416 A1420 W1423 F1497	F1409-F1411 HydrophobicContact CB-CD2 4.4Å; F1409-F1411 HydrophobicContact CB-CE2 4.01Å; F1409-F1411 AromaticContact CD1-CE2 3.66Å; F1409-F1411 HydrophobicContact CD1-CE2 3.66Å; F1409-F1411 AromaticContact CD1-CZ 3.9Å; F1409-F1411 HydrophobicContact CD1-CZ 3.9Å; F1409-F1411 HydrophobicContact CG-CE2 4.27Å; F1411-I1416 HydrophobicContact CB-CG2 4.35Å; F1411-I1416 HydrophobicContact CD1-CG2 3.88Å; F1411-I1416 HydrophobicContact CG-CG2 4.32Å; F1411-A1420 HydrophobicContact CD2-CB 3.69Å; F1411-A1420 HydrophobicContact CE2-CB 4.03Å; F1411-A1420 HydrophobicContact CG-CB 4.07Å; F1411-W1423 HydrophobicContact CD1-CZ3 4.45Å; F1411-W1423 HydrophobicContact CE1-CE3 4.16Å; F1411-W1423 AromaticContact CE1-CZ3 3.69Å; F1411-W1423 HydrophobicContact CE1-CZ3 3.69Å; F1411-W1423 HydrophobicContact CE2-CE3 4.38Å; F1411-W1423 AromaticContact CZ-CE3 3.79Å; F1411-W1423 HydrophobicContact CZ-CE3 3.79Å; F1411-W1423 AromaticContact CZ-CZ3 3.81Å; F1411-W1423 HydrophobicContact CZ-CZ3 3.81Å; F1411-F1497 HydrophobicContact CE1-CB 4.46Å; F1411-F1497 HydrophobicContact CZ-CB 4.19Å
1412	T	53.7	Low	55.7	Low	79 Å²	79	61.6 Å²	61.6	49%	0.485	36%	0.355	S	S	.	.			trans	-93.2	-19.2	-169.6	56.2	0	0	0	0	114.3	G1499	T1412-G1499 PolarHBondContact N-O 3.2Å; T1412-G1499 VanDerWaalsContact N-O 3.15Å; T1412-G1499 PolarHBondContact OG1-O 3.01Å
1413	H	54.5	Low	57	Low	62 Å²	62	58.7 Å²	58.7	29%	0.287	32%	0.321	S	S	.	.			trans	-101.1	137.4	-172.2	-159.3	-99.1	0	0	0	114.7	D1415 I1416 K1417 A1501	H1413-D1415 IonicContact CE1-OD2 2.77Å; H1413-D1415 PolarHBondContact CE1-OD2 3.12Å; H1413-D1415 PolarHBondContact ND1-N 2.71Å; H1413-D1415 IonicContact ND1-OD2 2.68Å; H1413-D1415 PolarHBondContact ND1-OD2 3.34Å; H1413-D1415 PolarHBondContact O-N 2.79Å; H1413-I1416 HydrophobicContact CB-CB 4.5Å; H1413-I1416 HydrophobicContact CB-CD1 4.26Å; H1413-I1416 HydrophobicContact CB-CG1 4.39Å; H1413-I1416 PolarHBondContact O-N 3.13Å; H1413-K1417 PolarHBondContact O-N 3.22Å; H1413-A1501 HydrophobicContact CB-CB 3.95Å; H1413-A1501 VanDerWaalsContact CD2-CB 3.49Å; H1413-A1501 WeakPolarHBondContact CD2-CB 3.31Å; H1413-A1501 VanDerWaalsContact ND1-CB 3.32Å; H1413-A1501 WeakPolarHBondContact ND1-CB 3.19Å
1414	P	52.2	Low	57.9	Low	84 Å²	84	57.7 Å²	57.7	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-60.2	-32.9	-179.9	21.8	-34.6	0	0	0	115.3	K1417	P1414-K1417 WeakPolarHBondContact O-CB 3.13Å; P1414-K1417 PolarHBondContact O-N 3.38Å
1415	D	53.2	Low	58.7	Low	112 Å²	112	58.9 Å²	58.9	60%	0.599	31%	0.305	S	S	*	.	H	α-helix	trans	-67	-47.1	176.8	-63.9	-32.3	0	0	0	111.4	H1413 K1417 T1418	H1413-D1415 IonicContact CE1-OD2 2.77Å; H1413-D1415 PolarHBondContact CE1-OD2 3.12Å; H1413-D1415 PolarHBondContact ND1-N 2.71Å; H1413-D1415 IonicContact ND1-OD2 2.68Å; H1413-D1415 PolarHBondContact ND1-OD2 3.34Å; H1413-D1415 PolarHBondContact O-N 2.79Å; D1415-K1417 PolarHBondContact O-N 3.28Å; D1415-T1418 PolarHBondContact O-N 3.29Å; D1415-T1418 VanDerWaalsContact O-N 3.13Å; D1415-T1418 PolarHBondContact O-OG1 3.44Å
1416	I	59.8	Low	59.3	Low	3 Å²	3	56.5 Å²	56.5	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-63.7	-27.3	176.1	-60.6	175.5	0	0	0	110.4	F1411 H1413 T1418 E1419 A1420 W1423 A1500	F1411-I1416 HydrophobicContact CB-CG2 4.35Å; F1411-I1416 HydrophobicContact CD1-CG2 3.88Å; F1411-I1416 HydrophobicContact CG-CG2 4.32Å; H1413-I1416 HydrophobicContact CB-CB 4.5Å; H1413-I1416 HydrophobicContact CB-CD1 4.26Å; H1413-I1416 HydrophobicContact CB-CG1 4.39Å; H1413-I1416 PolarHBondContact O-N 3.13Å; I1416-T1418 PolarHBondContact O-N 3.28Å; I1416-E1419 PolarHBondContact O-N 2.92Å; I1416-A1420 WeakPolarHBondContact O-CB 3.3Å; I1416-A1420 PolarHBondContact O-N 2.93Å; I1416-W1423 HydrophobicContact CG2-CZ3 4.43Å; I1416-A1500 VanDerWaalsContact CD1-C 3.41Å
1417	K	52.1	Low	59.6	Low	103 Å²	103	56.6 Å²	56.6	45%	0.448	29%	0.289	S	S	.	.	H	α-helix	trans	-56.3	-32.2	174.6	-160.1	178.4	-177.6	174.5	0	112.8	H1413 P1414 D1415 V1421 Y1470	H1413-K1417 PolarHBondContact O-N 3.22Å; P1414-K1417 WeakPolarHBondContact O-CB 3.13Å; P1414-K1417 PolarHBondContact O-N 3.38Å; D1415-K1417 PolarHBondContact O-N 3.28Å; K1417-V1421 VanDerWaalsContact O-CG2 3.28Å; K1417-V1421 WeakPolarHBondContact O-CG2 3.15Å; K1417-V1421 PolarHBondContact O-N 2.89Å; K1417-Y1470 HydrophobicContact CD-CE1 4.48Å; K1417-Y1470 WeakPolarHBondContact CE-OH 3.34Å
1418	T	58.7	Low	59.5	Low	89 Å²	89	59.2 Å²	59.2	55%	0.546	30%	0.303	S	S	.	.	H	α-helix	trans	-71.8	-48.1	176.5	65.1	0	0	0	0	111.5	D1415 I1416 V1421 H1422	D1415-T1418 PolarHBondContact O-N 3.29Å; D1415-T1418 VanDerWaalsContact O-N 3.13Å; D1415-T1418 PolarHBondContact O-OG1 3.44Å; I1416-T1418 PolarHBondContact O-N 3.28Å; T1418-V1421 PolarHBondContact O-N 3Å; T1418-H1422 PolarHBondContact O-CD2 3.17Å
1419	E	60.6	Low	59.2	Low	48 Å²	48	61.6 Å²	61.6	22%	0.224	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-40.9	176.9	-63.7	-177.9	170.5	0	0	111.9	I1416 V1421 H1422 W1423	I1416-E1419 PolarHBondContact O-N 2.92Å; E1419-V1421 VanDerWaalsContact C-N 3.29Å; E1419-V1421 PolarHBondContact O-N 2.94Å; E1419-H1422 WeakPolarHBondContact O-CA 3.25Å; E1419-H1422 WeakPolarHBondContact O-CB 3.32Å; E1419-H1422 PolarHBondContact O-N 3.44Å; E1419-W1423 HydrophobicContact CB-CZ2 3.99Å; E1419-W1423 PolarHBondContact O-N 3.2Å
1420	A	60.4	Low	58.8	Low	16 Å²	16	61.3 Å²	61.3	13%	0.132	32%	0.315	C	S	.	.	H	α-helix	trans	-63.4	-29.4	176.8	0	0	0	0	0	113.3	F1411 I1416 H1422 W1423 K1424	F1411-A1420 HydrophobicContact CD2-CB 3.69Å; F1411-A1420 HydrophobicContact CE2-CB 4.03Å; F1411-A1420 HydrophobicContact CG-CB 4.07Å; I1416-A1420 WeakPolarHBondContact O-CB 3.3Å; I1416-A1420 PolarHBondContact O-N 2.93Å; A1420-H1422 VanDerWaalsContact C-N 3.31Å; A1420-W1423 HydrophobicContact CB-CE3 4.36Å; A1420-W1423 PolarHBondContact O-N 2.91Å; A1420-K1424 VanDerWaalsContact O-CB 3.28Å; A1420-K1424 WeakPolarHBondContact O-CB 3.27Å; A1420-K1424 PolarHBondContact O-N 3.32Å
1421	V	60.1	Low	58.3	Low	73 Å²	73	63.8 Å²	63.8	44%	0.442	32%	0.324	S	S	.	.	H	α-helix	trans	-69	-30.4	171.5	166.5	0	0	0	0	111.7	K1417 T1418 E1419 K1425	K1417-V1421 VanDerWaalsContact O-CG2 3.28Å; K1417-V1421 WeakPolarHBondContact O-CG2 3.15Å; K1417-V1421 PolarHBondContact O-N 2.89Å; T1418-V1421 PolarHBondContact O-N 3Å; E1419-V1421 VanDerWaalsContact C-N 3.29Å; E1419-V1421 PolarHBondContact O-N 2.94Å; V1421-K1425 PolarHBondContact O-N 2.99Å
1422	H	62.5	Low	57.6	Low	73 Å²	73	69.8 Å²	69.8	34%	0.338	35%	0.345	S	S	.	.	H	α-helix	trans	-73	-44.5	171.4	-62.4	-64.9	0	0	0	111.5	T1418 E1419 A1420 K1424 K1425 Y1426	T1418-H1422 PolarHBondContact O-CD2 3.17Å; E1419-H1422 WeakPolarHBondContact O-CA 3.25Å; E1419-H1422 WeakPolarHBondContact O-CB 3.32Å; E1419-H1422 PolarHBondContact O-N 3.44Å; A1420-H1422 VanDerWaalsContact C-N 3.31Å; H1422-K1424 VanDerWaalsContact C-N 3.31Å; H1422-K1424 PolarHBondContact O-N 2.86Å; H1422-K1425 PolarHBondContact O-N 3.44Å; H1422-K1425 VanDerWaalsContact O-N 3.11Å; H1422-Y1426 PolarHBondContact O-N 3.49Å
1423	W	66.2	Low	57.3	Low	10 Å²	10	71.6 Å²	71.6	4%	0.038	35%	0.352	C	S	.	.	H	α-helix	trans	-60.7	-38.6	174.8	-55.1	-15.9	0	0	0	112	F1411 I1416 E1419 A1420 K1425 Y1426 L1427 V1562 M1581 A1584 M1585	F1411-W1423 HydrophobicContact CD1-CZ3 4.45Å; F1411-W1423 HydrophobicContact CE1-CE3 4.16Å; F1411-W1423 AromaticContact CE1-CZ3 3.69Å; F1411-W1423 HydrophobicContact CE1-CZ3 3.69Å; F1411-W1423 HydrophobicContact CE2-CE3 4.38Å; F1411-W1423 AromaticContact CZ-CE3 3.79Å; F1411-W1423 HydrophobicContact CZ-CE3 3.79Å; F1411-W1423 AromaticContact CZ-CZ3 3.81Å; F1411-W1423 HydrophobicContact CZ-CZ3 3.81Å; I1416-W1423 HydrophobicContact CG2-CZ3 4.43Å; E1419-W1423 HydrophobicContact CB-CZ2 3.99Å; E1419-W1423 PolarHBondContact O-N 3.2Å; A1420-W1423 HydrophobicContact CB-CE3 4.36Å; A1420-W1423 PolarHBondContact O-N 2.91Å; W1423-K1425 VanDerWaalsContact C-N 3.32Å; W1423-K1425 PolarHBondContact O-N 3.05Å; W1423-Y1426 WeakPolarHBondContact O-CB 3.43Å; W1423-Y1426 PolarHBondContact O-N 3.49Å; W1423-L1427 WeakPolarHBondContact O-CG 3.37Å; W1423-L1427 PolarHBondContact O-N 3.49Å; W1423-V1562 HydrophobicContact CH2-CG2 3.9Å; W1423-V1562 HydrophobicContact CZ3-CG2 4.4Å; W1423-M1581 HydrophobicContact CE3-SD 4.45Å; W1423-M1581 HydrophobicContact CZ3-CE 4.43Å; W1423-M1581 HydrophobicContact CZ3-SD 4.34Å; W1423-A1584 HydrophobicContact CB-CB 4.17Å; W1423-A1584 HydrophobicContact CG-CB 4.26Å; W1423-M1585 HydrophobicContact CH2-CE 4.45Å; W1423-M1585 HydrophobicContact CZ2-CE 4.35Å; W1423-M1585 HydrophobicContact CZ2-CG 4.24Å
1424	K	57.8	Low	56.9	Low	101 Å²	101	75.5 Å²	75.5	44%	0.439	36%	0.364	S	S	.	.	H	α-helix	trans	-56.2	-42.1	172.8	177.6	176.1	179.3	174.7	0	112.2	A1420 H1422 L1428	A1420-K1424 VanDerWaalsContact O-CB 3.28Å; A1420-K1424 WeakPolarHBondContact O-CB 3.27Å; A1420-K1424 PolarHBondContact O-N 3.32Å; H1422-K1424 VanDerWaalsContact C-N 3.31Å; H1422-K1424 PolarHBondContact O-N 2.86Å; K1424-L1428 HydrophobicContact CG-CD1 3.87Å; K1424-L1428 WeakPolarHBondContact O-CB 3.22Å; K1424-L1428 WeakPolarHBondContact O-CD1 3.44Å; K1424-L1428 VanDerWaalsContact O-CG 3.26Å; K1424-L1428 WeakPolarHBondContact O-CG 3.37Å; K1424-L1428 PolarHBondContact O-N 3.34Å; K1424-L1428 VanDerWaalsContact O-N 3.09Å
1425	K	61.3	Low	56.2	Low	117 Å²	117	80.8 Å²	80.8	51%	0.509	37%	0.373	S	S	.	.	H	α-helix	trans	-66.2	-43.9	177.3	-76.6	-176	175.8	-177.8	0	111.7	V1421 H1422 W1423 Q1429 Y1587	V1421-K1425 PolarHBondContact O-N 2.99Å; H1422-K1425 PolarHBondContact O-N 3.44Å; H1422-K1425 VanDerWaalsContact O-N 3.11Å; W1423-K1425 VanDerWaalsContact C-N 3.32Å; W1423-K1425 PolarHBondContact O-N 3.05Å; K1425-Q1429 VanDerWaalsContact O-CB 3.31Å; K1425-Q1429 WeakPolarHBondContact O-CB 3.33Å; K1425-Q1429 PolarHBondContact O-N 3.3Å; K1425-Y1587 HydrophobicContact CB-CE1 3.99Å
1426	Y	62.7	Low	55.4	Low	16 Å²	16	82 Å²	82	6%	0.063	38%	0.384	C	S	.	.	H	α-helix	trans	-55.9	-54.7	175.4	177	-106.4	0	0	0	111.5	H1422 W1423 L1428 Q1429 M1430 N1583 A1584 Y1587	H1422-Y1426 PolarHBondContact O-N 3.49Å; W1423-Y1426 WeakPolarHBondContact O-CB 3.43Å; W1423-Y1426 PolarHBondContact O-N 3.49Å; Y1426-L1428 PolarHBondContact O-N 3.27Å; Y1426-Q1429 PolarHBondContact O-N 3.15Å; Y1426-Q1429 VanDerWaalsContact O-N 3.12Å; Y1426-M1430 HydrophobicContact CE1-SD 3.74Å; Y1426-M1430 WeakPolarHBondContact O-CB 3.3Å; Y1426-M1430 PolarHBondContact O-N 3.03Å; Y1426-N1583 HydrophobicContact CE1-CB 3.91Å; Y1426-N1583 WeakPolarHBondContact OH-CB 3.48Å; Y1426-A1584 HydrophobicContact CD1-CB 3.82Å; Y1426-A1584 HydrophobicContact CE1-CB 4.42Å; Y1426-Y1587 AromaticContact CD2-CD2 3.62Å; Y1426-Y1587 HydrophobicContact CD2-CD2 3.62Å; Y1426-Y1587 HydrophobicContact CD2-CE2 4.35Å; Y1426-Y1587 AromaticContact CD2-CG 3.75Å; Y1426-Y1587 HydrophobicContact CD2-CG 3.75Å; Y1426-Y1587 HydrophobicContact CG-CD2 4.37Å; Y1426-Y1587 HydrophobicContact CG-CG 4.07Å
1427	L	61.3	Low	54.2	Low	19 Å²	19	88.1 Å²	88.1	10%	0.099	42%	0.416	C	S	.	.	H	α-helix	trans	-59.6	-48.1	-177.1	-68.3	164.4	0	0	0	111.5	F1409 W1423 Q1429 M1430 F1431 I1580	F1409-L1427 HydrophobicContact CE1-CD1 3.67Å; F1409-L1427 HydrophobicContact CE2-CD1 4.37Å; F1409-L1427 HydrophobicContact CZ-CD1 3.44Å; F1409-L1427 VanDerWaalsContact CZ-CD1 3.44Å; W1423-L1427 WeakPolarHBondContact O-CG 3.37Å; W1423-L1427 PolarHBondContact O-N 3.49Å; L1427-Q1429 VanDerWaalsContact C-N 3.27Å; L1427-Q1429 PolarHBondContact O-N 3.45Å; L1427-M1430 PolarHBondContact O-N 3.08Å; L1427-F1431 HydrophobicContact CB-CE2 4.41Å; L1427-F1431 WeakPolarHBondContact O-CD2 3.45Å; L1427-F1431 PolarHBondContact O-N 3.06Å; L1427-I1580 HydrophobicContact CD2-CG2 3.92Å
1428	L	57.4	Low	53.1	Low	90 Å²	90	93.5 Å²	93.5	47%	0.471	44%	0.44	S	S	.	.	H	α-helix	trans	-59.8	-36	176.8	-73	170.3	0	0	0	112.7	K1424 Y1426 R1432	K1424-L1428 HydrophobicContact CG-CD1 3.87Å; K1424-L1428 WeakPolarHBondContact O-CB 3.22Å; K1424-L1428 WeakPolarHBondContact O-CD1 3.44Å; K1424-L1428 VanDerWaalsContact O-CG 3.26Å; K1424-L1428 WeakPolarHBondContact O-CG 3.37Å; K1424-L1428 PolarHBondContact O-N 3.34Å; K1424-L1428 VanDerWaalsContact O-N 3.09Å; Y1426-L1428 PolarHBondContact O-N 3.27Å; L1428-R1432 VanDerWaalsContact O-CB 3.24Å; L1428-R1432 WeakPolarHBondContact O-CB 3.24Å; L1428-R1432 PolarHBondContact O-N 3.31Å; L1428-R1432 VanDerWaalsContact O-N 3.12Å
1429	Q	57.7	Low	52	Low	78 Å²	78	92.9 Å²	92.9	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-76.7	-37.5	179.1	-169.5	164.2	-14.1	0	0	112.2	K1425 Y1426 L1427 R1432 N1433 Y1587	K1425-Q1429 VanDerWaalsContact O-CB 3.31Å; K1425-Q1429 WeakPolarHBondContact O-CB 3.33Å; K1425-Q1429 PolarHBondContact O-N 3.3Å; Y1426-Q1429 PolarHBondContact O-N 3.15Å; Y1426-Q1429 VanDerWaalsContact O-N 3.12Å; L1427-Q1429 VanDerWaalsContact C-N 3.27Å; L1427-Q1429 PolarHBondContact O-N 3.45Å; Q1429-R1432 PolarHBondContact O-N 2.73Å; Q1429-N1433 PolarHBondContact O-N 3.2Å; Q1429-N1433 VanDerWaalsContact O-N 3.12Å; Q1429-Y1587 PolarHBondContact OE1-OH 3.21Å; Q1429-Y1587 VanDerWaalsContact OE1-OH 3.04Å
1430	M	54.8	Low	50.7	Low	38 Å²	38	96 Å²	96	19%	0.187	47%	0.469	C	S	.	.	H	α-helix	trans	-59.9	-45.6	173.6	-169.9	-176.3	-173.2	0	0	111.4	P1397 F1398 Y1426 L1427	P1397-M1430 HydrophobicContact CB-CE 4.27Å; P1397-M1430 HydrophobicContact CG-CE 3.58Å; F1398-M1430 HydrophobicContact CD2-CE 4.45Å; F1398-M1430 HydrophobicContact CE2-CE 4.07Å; F1398-M1430 HydrophobicContact CE2-SD 4.39Å; Y1426-M1430 HydrophobicContact CE1-SD 3.74Å; Y1426-M1430 WeakPolarHBondContact O-CB 3.3Å; Y1426-M1430 PolarHBondContact O-N 3.03Å; L1427-M1430 PolarHBondContact O-N 3.08Å
1431	F	53.8	Low	49.5	Very low	88 Å²	88	103.2 Å²	103.2	39%	0.386	51%	0.505	S	S	.	.	H	α-helix	trans	-68.8	-33.4	174.5	-67.6	-59.8	0	0	0	112.9	F1398 L1427 F1444	F1398-F1431 HydrophobicContact CE1-CE1 4.44Å; F1398-F1431 HydrophobicContact CE2-CE1 4.09Å; F1398-F1431 HydrophobicContact CE2-CZ 4.38Å; F1398-F1431 AromaticContact CZ-CE1 3.95Å; F1398-F1431 HydrophobicContact CZ-CE1 3.95Å; F1398-F1431 AromaticContact CZ-CZ 3.94Å; F1398-F1431 HydrophobicContact CZ-CZ 3.94Å; L1427-F1431 HydrophobicContact CB-CE2 4.41Å; L1427-F1431 WeakPolarHBondContact O-CD2 3.45Å; L1427-F1431 PolarHBondContact O-N 3.06Å; F1431-F1444 HydrophobicContact CD1-CZ 4.22Å; F1431-F1444 HydrophobicContact CE1-CZ 4.15Å
1432	R	48.7	Very low	48.4	Very low	167 Å²	167	108.4 Å²	108.4	63%	0.63	52%	0.524	S	S	*	.	H	α-helix	trans	-75.2	-23.7	-177.3	-164.1	174.5	-170.8	-179.7	3.3	114.3	L1428 Q1429 R1435	L1428-R1432 VanDerWaalsContact O-CB 3.24Å; L1428-R1432 WeakPolarHBondContact O-CB 3.24Å; L1428-R1432 PolarHBondContact O-N 3.31Å; L1428-R1432 VanDerWaalsContact O-N 3.12Å; Q1429-R1432 PolarHBondContact O-N 2.73Å; R1432-R1435 WeakPolarHBondContact O-CD 3.34Å; R1432-R1435 WeakPolarHBondContact O-CG 3.31Å
1433	N	48.1	Very low	47.1	Very low	117 Å²	117	111.2 Å²	111.2	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-84.2	-15.7	-177.9	-81	-1.2	0	0	0	114.8	Q1429 R1435	Q1429-N1433 PolarHBondContact O-N 3.2Å; Q1429-N1433 VanDerWaalsContact O-N 3.12Å; N1433-R1435 PolarHBondContact O-N 2.95Å
1434	R	45.2	Very low	45.7	Very low	144 Å²	144	117.4 Å²	117.4	54%	0.543	57%	0.569	S	S	.	*			trans	-93.7	36.7	179.1	-72.9	-167.3	174.8	-161.2	-0.6	114.6	V1436	R1434-V1436 PolarHBondContact O-N 3.36Å
1435	R	38.3	Very low	44.7	Very low	195 Å²	195	116.7 Å²	116.7	74%	0.736	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	22.9	-174.2	-89.1	174	173.1	-160.4	-7.2	118	R1432 N1433	R1432-R1435 WeakPolarHBondContact O-CD 3.34Å; R1432-R1435 WeakPolarHBondContact O-CG 3.31Å; N1433-R1435 PolarHBondContact O-N 2.95Å
1436	V	34.9	Very low	43.7	Very low	136 Å²	136	114 Å²	114	82%	0.824	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-16.1	-170.6	-177.6	0	0	0	0	113.8	R1434 K1438	R1434-V1436 PolarHBondContact O-N 3.36Å; V1436-K1438 PolarHBondContact O-N 3.02Å
1437	L	35.1	Very low	42.5	Very low	133 Å²	133	117.3 Å²	117.3	70%	0.696	58%	0.583	S	S	*	*			trans	-87.5	93.9	177.2	-73.7	164	0	0	0	111.9	G1439 L1440	L1437-G1439 PolarHBondContact O-N 3.09Å; L1437-G1439 VanDerWaalsContact O-N 3.13Å; L1437-L1440 HydrophobicContact CB-CD1 3.8Å; L1437-L1440 HydrophobicContact CD1-CD1 4.08Å
1438	K	29.5	Very low	41.3	Very low	216 Å²	216	118.5 Å²	118.5	94%	0.939	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	109.7	170.5	-72.8	179.3	174.4	178.3	0	110.5	V1436	V1436-K1438 PolarHBondContact O-N 3.02Å
1439	G	35.2	Very low	40.1	Very low	76 Å²	76	119.2 Å²	119.2	78%	0.784	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	139.3	-0.7	174.8	0	0	0	0	0	116.3	L1437	L1437-G1439 PolarHBondContact O-N 3.09Å; L1437-G1439 VanDerWaalsContact O-N 3.13Å
1440	L	34.4	Very low	39.2	Very low	113 Å²	113	121.1 Å²	121.1	59%	0.592	61%	0.611	S	S	*	*			trans	-104.9	4.2	-171.7	-90.9	151.2	0	0	0	115.7	L1437 E1442	L1437-L1440 HydrophobicContact CB-CD1 3.8Å; L1437-L1440 HydrophobicContact CD1-CD1 4.08Å; L1440-E1442 VanDerWaalsContact C-N 3.33Å; L1440-E1442 PolarHBondContact O-N 2.84Å
1441	D	34.1	Very low	38	Very low	168 Å²	168	124.3 Å²	124.3	90%	0.898	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-1.2	-170.6	-74.9	-42.4	0	0	0	115.7
1442	E	38.1	Very low	36.9	Very low	182 Å²	182	129.4 Å²	129.4	85%	0.85	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	-11.2	-170.3	-66.1	-172.7	163.4	0	0	116.6	L1440	L1440-E1442 VanDerWaalsContact C-N 3.33Å; L1440-E1442 PolarHBondContact O-N 2.84Å
1443	N	35.3	Very low	36	Very low	132 Å²	132	124.2 Å²	124.2	71%	0.706	66%	0.658	S	S	*	*			trans	-127	39.7	-166	-73.5	-37.5	0	0	0	116.1
1444	F	35.8	Very low	35.1	Very low	139 Å²	139	125.9 Å²	125.9	61%	0.61	67%	0.667	S	S	*	*			trans	-102	101.8	172.3	-113.1	-88.2	0	0	0	111.1	F1431	F1431-F1444 HydrophobicContact CD1-CZ 4.22Å; F1431-F1444 HydrophobicContact CE1-CZ 4.15Å
1445	T	37.1	Very low	34.7	Very low	87 Å²	87	124.5 Å²	124.5	53%	0.534	68%	0.678	S	S	.	*			trans	-121.8	134.8	-174.3	14.8	0	0	0	0	113.3	Y1462	T1445-Y1462 HydrophobicContact CG2-CD1 3.99Å
1446	I	40.4	Very low	34.5	Very low	59 Å²	59	120.1 Å²	120.1	30%	0.303	67%	0.673	S	S	.	*			trans	-126.4	122.8	179.7	-67	132	0	0	0	108.7	T1448 F1466 L1469	I1446-T1448 HydrophobicContact CG2-CG2 4.45Å; I1446-F1466 HydrophobicContact CD1-CD1 4.11Å; I1446-F1466 HydrophobicContact CD1-CD2 3.41Å; I1446-F1466 VanDerWaalsContact CD1-CD2 3.41Å; I1446-F1466 HydrophobicContact CD1-CE1 4.02Å; I1446-F1466 HydrophobicContact CD1-CE2 3.3Å; I1446-F1466 HydrophobicContact CD1-CG 3.82Å; I1446-F1466 HydrophobicContact CD1-CZ 3.63Å; I1446-F1466 HydrophobicContact CG1-CE1 4.47Å; I1446-F1466 HydrophobicContact CG1-CE2 4.38Å; I1446-F1466 HydrophobicContact CG1-CZ 4.26Å; I1446-F1466 HydrophobicContact CG2-CD1 4.44Å; I1446-F1466 HydrophobicContact CG2-CE1 4.38Å; I1446-L1469 HydrophobicContact CG2-CD1 4.11Å; I1446-L1469 HydrophobicContact CG2-CG 4.41Å
1447	L	37.7	Very low	34.4	Very low	87 Å²	87	120.4 Å²	120.4	46%	0.455	67%	0.67	S	S	.	*			trans	-82.7	127.8	-175.6	-69.8	157.2	0	0	0	111.1	F1481 W1493	L1447-F1481 HydrophobicContact CD1-CZ 4.3Å; L1447-W1493 HydrophobicContact CD1-CZ2 4.37Å
1448	T	35.5	Very low	34.2	Very low	44 Å²	44	122.7 Å²	122.7	27%	0.27	68%	0.677	S	S	.	*			trans	-127.8	-21.4	-177.6	52	0	0	0	0	117.5	I1446 N1468 L1469	I1446-T1448 HydrophobicContact CG2-CG2 4.45Å; T1448-N1468 HydrophobicContact CG2-CB 4.25Å; T1448-L1469 HydrophobicContact CG2-CD2 4.15Å; T1448-L1469 HydrophobicContact CG2-CG 3.93Å
1449	T	32.7	Very low	34.2	Very low	105 Å²	105	117.9 Å²	117.9	64%	0.644	67%	0.668	S	S	*	*			trans	-153.7	135.3	-173.2	46.4	0	0	0	0	113.7
1450	L	37.5	Very low	34.1	Very low	117 Å²	117	119 Å²	119	61%	0.613	66%	0.655	S	S	*	*			trans	-129.8	135.6	166	-90.7	166.8	0	0	0	109.7	L1460	L1450-L1460 HydrophobicContact CD2-CD1 4.34Å; L1450-L1460 HydrophobicContact CD2-CD2 3.88Å
1451	P	30.6	Very low	33.8	Very low	105 Å²	105	120.7 Å²	120.7	68%	0.682	67%	0.665	S	S	*	*			trans	-81.1	160.9	178.9	33.5	-34.7	0	0	0	112.8	G1453	P1451-G1453 PolarHBondContact O-N 2.96Å
1452	E	30.2	Very low	33.7	Very low	196 Å²	196	121.8 Å²	121.8	92%	0.916	66%	0.658	S	S	*	*	S	Bend	trans	-73	90.2	-178.6	-63.9	177.4	168.9	0	0	112.1
1453	G	30.5	Very low	33.4	Very low	58 Å²	58	119 Å²	119	60%	0.598	65%	0.647	S	S	*	*	S	Bend	trans	152.2	137.1	165.6	0	0	0	0	0	116.9	P1451	P1451-G1453 PolarHBondContact O-N 2.96Å
1454	N	28.7	Very low	33.2	Very low	152 Å²	152	118.7 Å²	118.7	81%	0.813	65%	0.653	S	S	*	*			trans	32.6	86.6	168.2	-77.1	-4.6	0	0	0	118.6	T1456	N1454-T1456 PolarHBondContact O-N 3.42Å
1455	C	36	Very low	33	Very low	115 Å²	115	116.3 Å²	116.3	78%	0.777	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	40.9	176.1	-51.5	0	0	0	0	115
1456	T	34.6	Very low	33	Very low	103 Å²	103	116.2 Å²	116.2	63%	0.632	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-27.4	-170.1	47.7	0	0	0	0	117	N1454	N1454-T1456 PolarHBondContact O-N 3.42Å
1457	D	33.7	Very low	32.8	Very low	141 Å²	141	120.4 Å²	120.4	75%	0.754	66%	0.66	S	S	*	*	S	Bend	trans	-135.9	13	-158	-65.6	-76.5	0	0	0	117.5
1458	Q	30.1	Very low	32.7	Very low	182 Å²	182	121.6 Å²	121.6	85%	0.85	67%	0.667	S	S	*	*			trans	-135.1	136.8	176.4	-71.5	-173.7	-21.5	0	0	113.5
1459	P	30.2	Very low	32.7	Very low	114 Å²	114	122.4 Å²	122.4	74%	0.74	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-70.4	135.4	166.9	31.4	-32.5	0	0	0	109.4	D1461	P1459-D1461 PolarHBondContact O-N 3.11Å
1460	L	33.3	Very low	33.3	Very low	99 Å²	99	124.6 Å²	124.6	52%	0.518	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-72.7	118.8	178	-80.1	152.2	0	0	0	110.5	L1450	L1450-L1460 HydrophobicContact CD2-CD1 4.34Å; L1450-L1460 HydrophobicContact CD2-CD2 3.88Å
1461	D	28.3	Very low	33.3	Very low	149 Å²	149	123.3 Å²	123.3	80%	0.797	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-68.3	145.7	175.3	-83	-38.5	0	0	0	112.3	P1459	P1459-D1461 PolarHBondContact O-N 3.11Å
1462	Y	32.2	Very low	33.7	Very low	192 Å²	192	123.5 Å²	123.5	75%	0.753	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-90.6	129	-165.8	-62.2	-108.8	0	0	0	111.5	T1445	T1445-Y1462 HydrophobicContact CG2-CD1 3.99Å
1463	I	31.3	Very low	34.1	Very low	123 Å²	123	122.2 Å²	122.2	63%	0.631	65%	0.653	S	S	*	*			trans	-126.6	137.8	178.8	-60.7	177	0	0	0	110.8
1464	P	31.5	Very low	34.6	Very low	126 Å²	126	123.6 Å²	123.6	82%	0.818	65%	0.646	S	S	*	*			trans	-96.2	9.2	-161.4	-3.1	25.4	0	0	0	116.5
1465	T	30.5	Very low	35.1	Very low	88 Å²	88	122 Å²	122	54%	0.54	64%	0.637	S	S	.	*			trans	-122.3	124.8	-162.9	42.5	0	0	0	0	115.6	E1467	T1465-E1467 PolarHBondContact O-N 3.36Å
1466	F	37.9	Very low	35.4	Very low	85 Å²	85	122.1 Å²	122.1	37%	0.373	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	19.3	-173.1	-136	-50.3	0	0	0	115.5	I1446 L1469	I1446-F1466 HydrophobicContact CD1-CD1 4.11Å; I1446-F1466 HydrophobicContact CD1-CD2 3.41Å; I1446-F1466 VanDerWaalsContact CD1-CD2 3.41Å; I1446-F1466 HydrophobicContact CD1-CE1 4.02Å; I1446-F1466 HydrophobicContact CD1-CE2 3.3Å; I1446-F1466 HydrophobicContact CD1-CG 3.82Å; I1446-F1466 HydrophobicContact CD1-CZ 3.63Å; I1446-F1466 HydrophobicContact CG1-CE1 4.47Å; I1446-F1466 HydrophobicContact CG1-CE2 4.38Å; I1446-F1466 HydrophobicContact CG1-CZ 4.26Å; I1446-F1466 HydrophobicContact CG2-CD1 4.44Å; I1446-F1466 HydrophobicContact CG2-CE1 4.38Å; F1466-L1469 HydrophobicContact CD1-CD1 4.21Å; F1466-L1469 HydrophobicContact CE1-CD1 3.99Å
1467	E	36.2	Very low	36.2	Very low	148 Å²	148	122.2 Å²	122.2	69%	0.692	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-13.6	-160	-70	-169.9	133.1	0	0	116.3	T1465	T1465-E1467 PolarHBondContact O-N 3.36Å
1468	N	35	Very low	37.2	Very low	111 Å²	111	117.8 Å²	117.8	59%	0.594	60%	0.602	S	S	*	*			trans	-111	23.5	-169.5	-78.2	-20.5	0	0	0	116.9	T1448 Y1470	T1448-N1468 HydrophobicContact CG2-CB 4.25Å; N1468-Y1470 PolarHBondContact O-N 3.17Å
1469	L	36.5	Very low	38.5	Very low	62 Å²	62	113.1 Å²	113.1	33%	0.325	58%	0.582	S	S	.	*			trans	-70	17.2	177.3	-85	170.4	0	0	0	115.5	I1446 T1448 F1466	I1446-L1469 HydrophobicContact CG2-CD1 4.11Å; I1446-L1469 HydrophobicContact CG2-CG 4.41Å; T1448-L1469 HydrophobicContact CG2-CD2 4.15Å; T1448-L1469 HydrophobicContact CG2-CG 3.93Å; F1466-L1469 HydrophobicContact CD1-CD1 4.21Å; F1466-L1469 HydrophobicContact CE1-CD1 3.99Å
1470	Y	44	Very low	39.7	Very low	150 Å²	150	111.1 Å²	111.1	59%	0.588	57%	0.566	S	S	*	*			trans	-115.4	85.4	-172.1	-70.3	-83.6	0	0	0	112.3	K1417 N1468	K1417-Y1470 HydrophobicContact CD-CE1 4.48Å; K1417-Y1470 WeakPolarHBondContact CE-OH 3.34Å; N1468-Y1470 PolarHBondContact O-N 3.17Å
1471	N	38.4	Very low	40.9	Very low	91 Å²	91	110.6 Å²	110.6	49%	0.487	56%	0.559	S	S	.	*			trans	-136.1	108.3	170.5	-161.4	-16.1	0	0	0	112	K1473 I1474	N1471-K1473 PolarHBondContact O-N 3.44Å; N1471-I1474 HydrophobicContact CB-CD1 4.33Å; N1471-I1474 PolarHBondContact O-N 3.27Å
1472	P	39.5	Very low	42.4	Very low	108 Å²	108	104 Å²	104	70%	0.701	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-69	-2.8	-172.5	27.5	-35.1	0	0	0	115
1473	K	37.7	Very low	43.7	Very low	169 Å²	169	98.9 Å²	98.9	74%	0.735	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-80.2	-7.3	176.5	-72.2	-174.2	174.1	-176.2	0	115	N1471 L1475	N1471-K1473 PolarHBondContact O-N 3.44Å; K1473-L1475 PolarHBondContact O-N 3.27Å
1474	I	42.1	Very low	44.8	Very low	88 Å²	88	96.2 Å²	96.2	45%	0.451	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-74.4	-13.6	-178	-60.9	171.8	0	0	0	112.4	N1471 V1476 H1477	N1471-I1474 HydrophobicContact CB-CD1 4.33Å; N1471-I1474 PolarHBondContact O-N 3.27Å; I1474-V1476 PolarHBondContact O-N 2.73Å; I1474-H1477 PolarHBondContact O-N 2.94Å
1475	L	39.1	Very low	45.8	Very low	117 Å²	117	90.8 Å²	90.8	61%	0.613	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-55.2	-17	-172.2	-91.9	163.6	0	0	0	117.2	K1473	K1473-L1475 PolarHBondContact O-N 3.27Å
1476	V	41.8	Very low	46.8	Very low	118 Å²	118	91.8 Å²	91.8	72%	0.715	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-90.2	-21.6	-174.7	-170.5	0	0	0	0	112.9	I1474	I1474-V1476 PolarHBondContact O-N 2.73Å
1477	H	51.2	Low	47.2	Very low	105 Å²	105	94.5 Å²	94.5	49%	0.486	46%	0.462	S	S	.	.			trans	-148.7	50.9	-170.2	-76.5	-75.4	0	0	0	114.9	I1474 N1479 D1480 F1481	I1474-H1477 PolarHBondContact O-N 2.94Å; H1477-N1479 PolarHBondContact O-N 2.8Å; H1477-D1480 HydrophobicContact CB-CB 3.91Å; H1477-D1480 IonicContact CE1-OD1 3.18Å; H1477-D1480 IonicContact CE1-OD2 2.67Å; H1477-D1480 IonicContact CG-OD1 3.41Å; H1477-D1480 IonicContact CG-OD2 3.92Å; H1477-D1480 IonicContact ND1-OD1 3.53Å; H1477-D1480 PolarHBondContact ND1-OD1 3.39Å; H1477-D1480 IonicContact ND1-OD2 3.54Å; H1477-D1480 PolarHBondContact ND1-OD2 3.28Å; H1477-D1480 VanDerWaalsContact ND1-OD2 3.12Å; H1477-D1480 PolarHBondContact O-N 3.1Å; H1477-D1480 VanDerWaalsContact O-N 3.15Å; H1477-F1481 PolarHBondContact O-N 3.01Å
1478	E	53.9	Low	47.5	Very low	49 Å²	49	93.1 Å²	93.1	23%	0.229	46%	0.459	C	S	.	.	H	α-helix	trans	-51.7	-38.6	167.3	-70.3	-166.3	133.2	0	0	111.6	N1410 L1482	N1410-E1478 PolarHBondContact ND2-OE1 3.43Å; E1478-L1482 PolarHBondContact O-N 3.2Å
1479	N	57.8	Low	48.1	Very low	83 Å²	83	91 Å²	91	44%	0.444	46%	0.463	S	S	.	.	H	α-helix	trans	-65.9	-39.8	179.2	-70.3	-37.9	0	0	0	112.9	P673 H1477 Y1483	P673-N1479 HydrophobicContact CG-CB 4.26Å; H1477-N1479 PolarHBondContact O-N 2.8Å; N1479-Y1483 VanDerWaalsContact O-CB 3.23Å; N1479-Y1483 WeakPolarHBondContact O-CB 3.25Å; N1479-Y1483 PolarHBondContact O-N 3.17Å
1480	D	56.5	Low	48.4	Very low	73 Å²	73	93 Å²	93	39%	0.39	47%	0.473	S	S	.	.	H	α-helix	trans	-75.7	-31.8	-176.4	-57.1	36.7	0	0	0	111.4	H1477 Y1483 D1484	H1477-D1480 HydrophobicContact CB-CB 3.91Å; H1477-D1480 IonicContact CE1-OD1 3.18Å; H1477-D1480 IonicContact CE1-OD2 2.67Å; H1477-D1480 IonicContact CG-OD1 3.41Å; H1477-D1480 IonicContact CG-OD2 3.92Å; H1477-D1480 IonicContact ND1-OD1 3.53Å; H1477-D1480 PolarHBondContact ND1-OD1 3.39Å; H1477-D1480 IonicContact ND1-OD2 3.54Å; H1477-D1480 PolarHBondContact ND1-OD2 3.28Å; H1477-D1480 VanDerWaalsContact ND1-OD2 3.12Å; H1477-D1480 PolarHBondContact O-N 3.1Å; H1477-D1480 VanDerWaalsContact O-N 3.15Å; D1480-Y1483 WeakPolarHBondContact O-CB 3.43Å; D1480-Y1483 PolarHBondContact O-N 3.27Å; D1480-D1484 WeakPolarHBondContact O-CB 3.38Å; D1480-D1484 PolarHBondContact O-N 3.33Å
1481	F	57.6	Low	48.4	Very low	87 Å²	87	87.4 Å²	87.4	38%	0.382	46%	0.458	S	S	.	.	H	α-helix	trans	-61.9	-49.6	172.3	172.9	-100.1	0	0	0	111.4	L1447 H1477 Y1483 D1484 A1485	L1447-F1481 HydrophobicContact CD1-CZ 4.3Å; H1477-F1481 PolarHBondContact O-N 3.01Å; F1481-Y1483 PolarHBondContact O-N 3.05Å; F1481-D1484 PolarHBondContact O-N 3.4Å; F1481-A1485 VanDerWaalsContact O-CB 3.27Å; F1481-A1485 WeakPolarHBondContact O-CB 3.3Å; F1481-A1485 PolarHBondContact O-N 2.66Å
1482	L	59.9	Low	48.9	Very low	11 Å²	11	86.1 Å²	86.1	6%	0.058	46%	0.456	C	S	.	.	H	α-helix	trans	-63.9	-31.6	177.1	-68.7	167.9	0	0	0	111.8	F672 P673 F1408 E1478 R1486 W1565	F672-L1482 HydrophobicContact CD1-CD1 3.92Å; F672-L1482 HydrophobicContact CD1-CD2 4.24Å; F672-L1482 HydrophobicContact CE1-CD1 3.97Å; F672-L1482 HydrophobicContact CE1-CD2 3.73Å; F672-L1482 HydrophobicContact CE1-CG 4.42Å; F672-L1482 HydrophobicContact CZ-CD2 4.4Å; P673-L1482 HydrophobicContact CG-CB 4.28Å; F1408-L1482 HydrophobicContact CD1-CD2 4.1Å; F1408-L1482 HydrophobicContact CE1-CD2 3.85Å; F1408-L1482 HydrophobicContact CZ-CD1 4.07Å; F1408-L1482 HydrophobicContact CZ-CD2 4.11Å; E1478-L1482 PolarHBondContact O-N 3.2Å; L1482-R1486 VanDerWaalsContact O-CB 3.3Å; L1482-R1486 WeakPolarHBondContact O-CB 3.43Å; L1482-R1486 PolarHBondContact O-N 3.31Å; L1482-W1565 HydrophobicContact CD1-CD2 4.35Å; L1482-W1565 HydrophobicContact CD1-CE3 4.01Å; L1482-W1565 HydrophobicContact CD1-CH2 4.4Å; L1482-W1565 HydrophobicContact CD1-CZ3 4.05Å
1483	Y	60.6	Low	49.6	Very low	85 Å²	85	82.9 Å²	82.9	33%	0.333	43%	0.43	S	S	.	.	H	α-helix	trans	-69.5	-50	174	172.2	-95	0	0	0	112.9	K675 N1479 D1480 F1481 R1486 K1487	K675-Y1483 HydrophobicContact CB-CE2 3.95Å; K675-Y1483 HydrophobicContact CD-CE2 4.2Å; K675-Y1483 HydrophobicContact CG-CE2 3.92Å; N1479-Y1483 VanDerWaalsContact O-CB 3.23Å; N1479-Y1483 WeakPolarHBondContact O-CB 3.25Å; N1479-Y1483 PolarHBondContact O-N 3.17Å; D1480-Y1483 WeakPolarHBondContact O-CB 3.43Å; D1480-Y1483 PolarHBondContact O-N 3.27Å; F1481-Y1483 PolarHBondContact O-N 3.05Å; Y1483-R1486 PolarHBondContact O-N 3.46Å; Y1483-K1487 VanDerWaalsContact O-CB 3.31Å; Y1483-K1487 WeakPolarHBondContact O-CB 3.45Å; Y1483-K1487 PolarHBondContact O-N 3.01Å
1484	D	54	Low	50.5	Low	66 Å²	66	77 Å²	77	35%	0.353	41%	0.408	S	S	.	.	H	α-helix	trans	-72.7	-35.7	-178.2	-88	-28.2	0	0	0	112.4	D1480 F1481 R1486 K1487 L1488	D1480-D1484 WeakPolarHBondContact O-CB 3.38Å; D1480-D1484 PolarHBondContact O-N 3.33Å; F1481-D1484 PolarHBondContact O-N 3.4Å; D1484-R1486 VanDerWaalsContact C-N 3.3Å; D1484-R1486 PolarHBondContact O-N 3.34Å; D1484-K1487 WeakPolarHBondContact O-CB 3.5Å; D1484-K1487 PolarHBondContact O-N 2.86Å; D1484-K1487 WeakPolarHBondContact OD1-CD 3.5Å; D1484-K1487 IonicContact OD1-NZ 3.49Å; D1484-K1487 PolarHBondContact OD1-NZ 3.38Å; D1484-L1488 WeakPolarHBondContact O-CG 3.21Å; D1484-L1488 PolarHBondContact O-N 3.31Å; D1484-L1488 VanDerWaalsContact O-N 3.08Å
1485	A	51.5	Low	51.5	Low	12 Å²	12	72.9 Å²	72.9	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-61.7	-38.1	172.5	0	0	0	0	0	112	F1481	F1481-A1485 VanDerWaalsContact O-CB 3.27Å; F1481-A1485 WeakPolarHBondContact O-CB 3.3Å; F1481-A1485 PolarHBondContact O-N 2.66Å
1486	R	51.6	Low	52.9	Low	109 Å²	109	67.3 Å²	67.3	41%	0.411	36%	0.358	S	S	.	.	H	α-helix	trans	-73.7	-36.7	175.4	-169.5	173.4	-176.5	170	2.7	112.5	L1482 Y1483 D1484 L1488 G1489	L1482-R1486 VanDerWaalsContact O-CB 3.3Å; L1482-R1486 WeakPolarHBondContact O-CB 3.43Å; L1482-R1486 PolarHBondContact O-N 3.31Å; Y1483-R1486 PolarHBondContact O-N 3.46Å; D1484-R1486 VanDerWaalsContact C-N 3.3Å; D1484-R1486 PolarHBondContact O-N 3.34Å; R1486-L1488 VanDerWaalsContact C-N 3.31Å; R1486-L1488 PolarHBondContact O-N 2.87Å; R1486-G1489 PolarHBondContact O-N 3.19Å
1487	K	47.3	Very low	54.4	Low	143 Å²	143	61.8 Å²	61.8	62%	0.622	32%	0.324	S	S	*	.	H	α-helix	trans	-62.7	-33.2	175.8	171.5	-161.2	178.8	-166.5	0	113.2	Y1483 D1484	Y1483-K1487 VanDerWaalsContact O-CB 3.31Å; Y1483-K1487 WeakPolarHBondContact O-CB 3.45Å; Y1483-K1487 PolarHBondContact O-N 3.01Å; D1484-K1487 WeakPolarHBondContact O-CB 3.5Å; D1484-K1487 PolarHBondContact O-N 2.86Å; D1484-K1487 WeakPolarHBondContact OD1-CD 3.5Å; D1484-K1487 IonicContact OD1-NZ 3.49Å; D1484-K1487 PolarHBondContact OD1-NZ 3.38Å
1488	L	42.7	Very low	55.3	Low	119 Å²	119	57.1 Å²	57.1	62%	0.623	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.9	178	-68.3	163.9	0	0	0	113.5	D1484 R1486 I1490	D1484-L1488 WeakPolarHBondContact O-CG 3.21Å; D1484-L1488 PolarHBondContact O-N 3.31Å; D1484-L1488 VanDerWaalsContact O-N 3.08Å; R1486-L1488 VanDerWaalsContact C-N 3.31Å; R1486-L1488 PolarHBondContact O-N 2.87Å; L1488-I1490 HydrophobicContact CB-CD1 3.48Å; L1488-I1490 VanDerWaalsContact CB-CD1 3.48Å; L1488-I1490 HydrophobicContact CB-CG1 3.67Å; L1488-I1490 HydrophobicContact CD1-CD1 3.78Å; L1488-I1490 HydrophobicContact CG-CD1 4.21Å; L1488-I1490 PolarHBondContact O-N 3.25Å
1489	G	46.1	Very low	55.9	Low	66 Å²	66	55 Å²	55	68%	0.68	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	19.2	-179.9	0	0	0	0	0	114.8	R1486 A1491	R1486-G1489 PolarHBondContact O-N 3.19Å; G1489-A1491 PolarHBondContact O-N 3.25Å
1490	I	42.9	Very low	55.9	Low	104 Å²	104	52.5 Å²	52.5	53%	0.533	29%	0.286	S	S	.	.			trans	-75.2	-24.8	-164.9	-71.5	172.1	0	0	0	113.6	L1488	L1488-I1490 HydrophobicContact CB-CD1 3.48Å; L1488-I1490 VanDerWaalsContact CB-CD1 3.48Å; L1488-I1490 HydrophobicContact CB-CG1 3.67Å; L1488-I1490 HydrophobicContact CD1-CD1 3.78Å; L1488-I1490 HydrophobicContact CG-CD1 4.21Å; L1488-I1490 PolarHBondContact O-N 3.25Å
1491	A	43.7	Very low	55.5	Low	33 Å²	33	49.9 Å²	49.9	27%	0.273	28%	0.275	S	S	.	.			trans	-158.8	146.3	173.3	0	0	0	0	0	113.1	A1406 G1489 W1493	A1406-A1491 HydrophobicContact CB-CB 3.82Å; G1489-A1491 PolarHBondContact O-N 3.25Å; A1491-W1493 PolarHBondContact O-N 3.22Å; A1491-W1493 VanDerWaalsContact O-N 3.14Å
1492	S	49.6	Very low	55.2	Low	63 Å²	63	49.1 Å²	49.1	44%	0.441	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	84.8	166.1	40.8	0	0	0	0	110.2	S1404 T1494	S1404-S1492 PolarHBondContact O-OG 3.12Å; S1492-T1494 PolarHBondContact O-N 3.12Å
1493	W	54.9	Low	54.3	Low	41 Å²	41	56 Å²	56	16%	0.155	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	120.8	176.3	-64.4	95.8	0	0	0	111.5	F672 A1406 F1408 L1447 A1491 P1567	F672-W1493 HydrophobicContact CE2-CB 3.79Å; F672-W1493 HydrophobicContact CZ-CB 4.02Å; A1406-W1493 HydrophobicContact CB-CD2 3.99Å; A1406-W1493 HydrophobicContact CB-CE3 3.59Å; A1406-W1493 HydrophobicContact CB-CH2 4.25Å; A1406-W1493 HydrophobicContact CB-CZ3 3.73Å; F1408-W1493 HydrophobicContact CB-CE3 4.42Å; F1408-W1493 HydrophobicContact CB-CH2 4.25Å; F1408-W1493 HydrophobicContact CB-CZ3 3.73Å; F1408-W1493 HydrophobicContact CD1-CE3 4.27Å; F1408-W1493 HydrophobicContact CD1-CZ3 4.41Å; L1447-W1493 HydrophobicContact CD1-CZ2 4.37Å; A1491-W1493 PolarHBondContact O-N 3.22Å; A1491-W1493 VanDerWaalsContact O-N 3.14Å; W1493-P1567 WeakPolarHBondContact O-CG 3.43Å
1494	T	55	Low	53.3	Low	44 Å²	44	60.1 Å²	60.1	27%	0.27	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-14.2	177	48.7	0	0	0	0	113.6	L1405 A1406 S1492 P1567	L1405-T1494 HydrophobicContact CD2-CG2 3.4Å; A1406-T1494 PolarHBondContact O-N 2.8Å; A1406-T1494 PolarHBondContact O-OG1 3.2Å; S1492-T1494 PolarHBondContact O-N 3.12Å; T1494-P1567 WeakPolarHBondContact O-CD 3.4Å
1495	G	64.4	Low	52.6	Low	2 Å²	2	59.4 Å²	59.4	2%	0.021	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.8	-164.5	172.6	0	0	0	0	0	111.2	I1407 W1565	I1407-G1495 WeakPolarHBondContact CA-O 3.27Å; G1495-W1565 CarbonylContact C-O 3.58Å; G1495-W1565 WeakPolarHBondContact CA-O 3.48Å
1496	G	68.6	Low	52.2	Low	0 Å²	0	64.4 Å²	64.4	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.7	-175.6	168.9	0	0	0	0	0	112.1	F1408 W1565	F1408-G1496 VanDerWaalsContact CE1-CA 3.42Å; F1408-G1496 CarbonylContact O-C 3.57Å; F1408-G1496 WeakPolarHBondContact O-CA 3.49Å; G1496-W1565 PolarHBondContact N-O 2.73Å; G1496-W1565 WeakPolarHBondContact O-CA 3.44Å; G1496-W1565 WeakPolarHBondContact O-CB 3.28Å; G1496-W1565 PolarHBondContact O-N 3.02Å
1497	F	73.6	Confident	51.7	Low	2 Å²	2	61.7 Å²	61.7	1%	0.009	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	125.6	-166	-51.9	-76.4	0	0	0	110.1	I1407 F1408 F1409 N1410 F1411 K1563 I1564 S1577 I1580 M1581	I1407-F1497 HydrophobicContact CG2-CD2 4.09Å; I1407-F1497 HydrophobicContact CG2-CE2 3.82Å; F1408-F1497 PolarHBondContact O-N 3.14Å; F1409-F1497 CarbonylContact C-O 3.56Å; F1409-F1497 WeakPolarHBondContact CA-O 3.38Å; F1409-F1497 HydrophobicContact CD1-CB 4.18Å; F1409-F1497 AromaticContact CD1-CD2 3.79Å; F1409-F1497 HydrophobicContact CD1-CD2 3.79Å; F1409-F1497 HydrophobicContact CD1-CG 4.43Å; F1409-F1497 HydrophobicContact CE1-CB 4.49Å; F1409-F1497 AromaticContact CE1-CD2 3.34Å; F1409-F1497 HydrophobicContact CE1-CD2 3.34Å; F1409-F1497 AromaticContact CE1-CE2 3.93Å; F1409-F1497 HydrophobicContact CE1-CE2 3.93Å; F1409-F1497 HydrophobicContact CE1-CG 4.27Å; F1409-F1497 AromaticContact CZ-CD2 3.94Å; F1409-F1497 HydrophobicContact CZ-CD2 3.94Å; F1409-F1497 HydrophobicContact CZ-CE2 4.17Å; N1410-F1497 PolarHBondContact N-O 3.5Å; F1411-F1497 HydrophobicContact CE1-CB 4.46Å; F1411-F1497 HydrophobicContact CZ-CB 4.19Å; F1497-K1563 WeakPolarHBondContact CA-O 3.46Å; F1497-I1564 HydrophobicContact CD1-CG1 4.2Å; F1497-I1564 HydrophobicContact CD1-CG2 4.37Å; F1497-I1564 HydrophobicContact CE1-CG1 4.31Å; F1497-I1564 HydrophobicContact CE1-CG2 4.02Å; F1497-S1577 WeakPolarHBondContact CE1-O 3.35Å; F1497-I1580 HydrophobicContact CE2-CG2 3.97Å; F1497-I1580 HydrophobicContact CZ-CB 4.11Å; F1497-I1580 HydrophobicContact CZ-CG2 3.82Å; F1497-M1581 HydrophobicContact CB-CE 3.76Å; F1497-M1581 HydrophobicContact CD1-CB 4.29Å; F1497-M1581 HydrophobicContact CD1-CE 3.23Å; F1497-M1581 HydrophobicContact CD2-CE 4.3Å; F1497-M1581 HydrophobicContact CE1-CB 3.75Å; F1497-M1581 HydrophobicContact CE1-CE 3.84Å; F1497-M1581 HydrophobicContact CG-CE 3.48Å; F1497-M1581 VanDerWaalsContact CG-CE 3.48Å; F1497-M1581 HydrophobicContact CZ-CB 4.39Å
1498	S	70.2	Confident	51.4	Low	7 Å²	7	58.7 Å²	58.7	5%	0.049	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.1	165	67.3	0	0	0	0	111.2	N1410 K1563 W1565	N1410-S1498 CarbonylContact O-C 3.52Å; N1410-S1498 WeakPolarHBondContact O-CA 3.47Å; N1410-S1498 WeakPolarHBondContact O-CB 3.42Å; S1498-K1563 PolarHBondContact N-O 3.3Å; S1498-K1563 PolarHBondContact O-N 2.87Å; S1498-W1565 PolarHBondContact OG-NE1 2.75Å
1499	G	64.6	Low	51.7	Low	4 Å²	4	56.6 Å²	56.6	4%	0.041	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	127.8	-177.5	0	0	0	0	0	111.6	N1410 T1412 N1561	N1410-G1499 PolarHBondContact O-N 3.44Å; T1412-G1499 PolarHBondContact N-O 3.2Å; T1412-G1499 VanDerWaalsContact N-O 3.15Å; T1412-G1499 PolarHBondContact OG1-O 3.01Å; G1499-N1561 WeakPolarHBondContact CA-O 3.43Å
1500	A	57.8	Low	51.9	Low	32 Å²	32	58 Å²	58	26%	0.264	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.9	178.5	0	0	0	0	0	108.9	I1416 N1561	I1416-A1500 VanDerWaalsContact CD1-C 3.41Å; A1500-N1561 PolarHBondContact N-O 3.13Å; A1500-N1561 VanDerWaalsContact N-O 3.09Å; A1500-N1561 PolarHBondContact O-N 3.16Å; A1500-N1561 VanDerWaalsContact O-N 3.12Å; A1500-N1561 VanDerWaalsContact O-O 3.05Å
1501	A	49.4	Very low	52.4	Low	18 Å²	18	56.2 Å²	56.2	15%	0.149	35%	0.345	C	S	.	.			trans	-73.4	163	161.2	0	0	0	0	0	109.4	H1413 E1503	H1413-A1501 HydrophobicContact CB-CB 3.95Å; H1413-A1501 VanDerWaalsContact CD2-CB 3.49Å; H1413-A1501 WeakPolarHBondContact CD2-CB 3.31Å; H1413-A1501 VanDerWaalsContact ND1-CB 3.32Å; H1413-A1501 WeakPolarHBondContact ND1-CB 3.19Å; A1501-E1503 PolarHBondContact O-N 3.04Å
1502	S	51.3	Low	52.8	Low	70 Å²	70	57.4 Å²	57.4	49%	0.49	35%	0.351	S	S	.	.			trans	-58.6	98.6	174.5	166.2	0	0	0	0	110.8	N1504	S1502-N1504 PolarHBondContact O-N 3.12Å
1503	E	41.3	Very low	53.2	Low	157 Å²	157	60.9 Å²	60.9	73%	0.734	36%	0.358	S	S	*	.			trans	-55.7	117.6	175.4	-64.6	177.1	147.8	0	0	111	A1501 S1505	A1501-E1503 PolarHBondContact O-N 3.04Å; E1503-S1505 PolarHBondContact O-N 3.49Å
1504	N	39.3	Very low	53.2	Low	171 Å²	171	62.3 Å²	62.3	91%	0.914	37%	0.369	S	S	*	.	S	Bend	trans	35.4	27.1	152.7	-65.9	-11.9	0	0	0	120.1	S1502	S1502-N1504 PolarHBondContact O-N 3.12Å
1505	S	39.9	Very low	53.3	Low	50 Å²	50	61 Å²	61	35%	0.35	36%	0.362	S	S	.	.			trans	-75.6	134	177.9	83.2	0	0	0	0	110.8	E1503 A1507 A1508	E1503-S1505 PolarHBondContact O-N 3.49Å; S1505-A1507 PolarHBondContact O-N 3.21Å; S1505-A1508 PolarHBondContact O-N 3.3Å; S1505-A1508 VanDerWaalsContact O-N 3.12Å
1506	P	41.6	Very low	53	Low	117 Å²	117	65.3 Å²	65.3	76%	0.76	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-2.6	171.6	26.5	-33.6	0	0	0	113.1	A1508	P1506-A1508 VanDerWaalsContact C-N 3.28Å
1507	A	42.3	Very low	52.8	Low	52 Å²	52	70.6 Å²	70.6	43%	0.43	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	2.9	171.9	0	0	0	0	0	113.8	S1505 V1509	S1505-A1507 PolarHBondContact O-N 3.21Å; A1507-V1509 PolarHBondContact O-N 3.12Å
1508	A	41.3	Very low	52	Low	81 Å²	81	71.7 Å²	71.7	67%	0.669	42%	0.419	S	S	*	.			trans	-69.6	31.4	172	0	0	0	0	0	114.2	S1505 P1506 N1510	S1505-A1508 PolarHBondContact O-N 3.3Å; S1505-A1508 VanDerWaalsContact O-N 3.12Å; P1506-A1508 VanDerWaalsContact C-N 3.28Å; A1508-N1510 PolarHBondContact O-N 3.47Å
1509	V	47.1	Very low	51.6	Low	74 Å²	74	75.7 Å²	75.7	45%	0.448	44%	0.439	S	S	.	.			trans	-62.3	108.8	158.1	-175.3	0	0	0	0	105.7	A1507 Y1511 L1514	A1507-V1509 PolarHBondContact O-N 3.12Å; V1509-Y1511 PolarHBondContact O-N 3.29Å; V1509-L1514 HydrophobicContact CG1-CB 3.96Å; V1509-L1514 HydrophobicContact CG1-CD1 4.21Å
1510	N	50.9	Low	51.5	Low	97 Å²	97	81.2 Å²	81.2	52%	0.519	46%	0.462	S	S	.	.			trans	-49.3	108.4	176.9	-166.3	-8.7	0	0	0	107.7	A1508 S1512 K1513 L1514	A1508-N1510 PolarHBondContact O-N 3.47Å; N1510-S1512 PolarHBondContact ND2-OG 3.12Å; N1510-S1512 CarbonylContact O-C 3.56Å; N1510-S1512 PolarHBondContact O-N 3.08Å; N1510-S1512 PolarHBondContact OD1-OG 2.62Å; N1510-K1513 HydrophobicContact CB-CB 4.36Å; N1510-K1513 HydrophobicContact CB-CD 4.33Å; N1510-K1513 HydrophobicContact CB-CG 4.23Å; N1510-K1513 WeakPolarHBondContact O-CA 3.31Å; N1510-K1513 WeakPolarHBondContact O-CB 3.22Å; N1510-K1513 PolarHBondContact O-N 3.37Å; N1510-L1514 PolarHBondContact O-N 3.09Å; N1510-L1514 VanDerWaalsContact O-N 3.07Å
1511	Y	54.2	Low	51.7	Low	66 Å²	66	84.2 Å²	84.2	26%	0.259	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-19.7	-166.4	-77.3	-88.4	0	0	0	112.3	V1509 L1514 A1515 T1553 L1556	V1509-Y1511 PolarHBondContact O-N 3.29Å; Y1511-L1514 HydrophobicContact CD1-CD2 4.06Å; Y1511-L1514 HydrophobicContact CE1-CD2 4.31Å; Y1511-L1514 PolarHBondContact O-N 3Å; Y1511-A1515 VanDerWaalsContact O-CB 3.24Å; Y1511-A1515 WeakPolarHBondContact O-CB 3.19Å; Y1511-A1515 PolarHBondContact O-N 3.03Å; Y1511-T1553 WeakPolarHBondContact CD1-O 3.36Å; Y1511-L1556 HydrophobicContact CE1-CB 4.39Å
1512	S	51.5	Low	52.1	Low	57 Å²	57	85.6 Å²	85.6	40%	0.399	47%	0.474	S	S	.	.	H	α-helix	trans	-58.2	-50	163.1	57.4	0	0	0	0	112.8	N1510 L1514 A1515 D1516	N1510-S1512 PolarHBondContact ND2-OG 3.12Å; N1510-S1512 CarbonylContact O-C 3.56Å; N1510-S1512 PolarHBondContact O-N 3.08Å; N1510-S1512 PolarHBondContact OD1-OG 2.62Å; S1512-L1514 VanDerWaalsContact C-N 3.34Å; S1512-L1514 PolarHBondContact O-N 3.25Å; S1512-A1515 PolarHBondContact O-N 3.42Å; S1512-D1516 WeakPolarHBondContact O-CB 3.3Å; S1512-D1516 PolarHBondContact O-N 3.29Å
1513	K	57.2	Low	52.5	Low	137 Å²	137	84.5 Å²	84.5	60%	0.596	47%	0.465	S	S	*	.	H	α-helix	trans	-63.7	-35.4	172.3	-71	-174.8	175.7	-179.5	0	112.7	N1510 H1517	N1510-K1513 HydrophobicContact CB-CB 4.36Å; N1510-K1513 HydrophobicContact CB-CD 4.33Å; N1510-K1513 HydrophobicContact CB-CG 4.23Å; N1510-K1513 WeakPolarHBondContact O-CA 3.31Å; N1510-K1513 WeakPolarHBondContact O-CB 3.22Å; N1510-K1513 PolarHBondContact O-N 3.37Å; K1513-H1517 WeakPolarHBondContact O-CB 3.14Å; K1513-H1517 PolarHBondContact O-CD2 3.19Å; K1513-H1517 PolarHBondContact O-N 3.49Å
1514	L	55.8	Low	53.6	Low	71 Å²	71	80.7 Å²	80.7	37%	0.372	45%	0.45	S	S	.	.	H	α-helix	trans	-68.7	-42.5	175.5	-169.4	72.6	0	0	0	110.7	V1509 N1510 Y1511 S1512 H1517 A1518 T1553	V1509-L1514 HydrophobicContact CG1-CB 3.96Å; V1509-L1514 HydrophobicContact CG1-CD1 4.21Å; N1510-L1514 PolarHBondContact O-N 3.09Å; N1510-L1514 VanDerWaalsContact O-N 3.07Å; Y1511-L1514 HydrophobicContact CD1-CD2 4.06Å; Y1511-L1514 HydrophobicContact CE1-CD2 4.31Å; Y1511-L1514 PolarHBondContact O-N 3Å; S1512-L1514 VanDerWaalsContact C-N 3.34Å; S1512-L1514 PolarHBondContact O-N 3.25Å; L1514-H1517 PolarHBondContact O-N 3.42Å; L1514-A1518 WeakPolarHBondContact O-CB 3.22Å; L1514-A1518 PolarHBondContact O-N 3.17Å; L1514-T1553 HydrophobicContact CD2-CG2 3.87Å; L1514-T1553 HydrophobicContact CG-CG2 4.49Å
1515	A	56.8	Low	54.3	Low	17 Å²	17	74.7 Å²	74.7	14%	0.14	42%	0.419	C	S	.	.	H	α-helix	trans	-62.6	-45.5	172.8	0	0	0	0	0	111.1	Y1511 S1512 H1517 A1518 L1519	Y1511-A1515 VanDerWaalsContact O-CB 3.24Å; Y1511-A1515 WeakPolarHBondContact O-CB 3.19Å; Y1511-A1515 PolarHBondContact O-N 3.03Å; S1512-A1515 PolarHBondContact O-N 3.42Å; A1515-H1517 VanDerWaalsContact C-N 3.34Å; A1515-H1517 PolarHBondContact O-N 3.35Å; A1515-A1518 CarbonylContact O-C 3.56Å; A1515-A1518 PolarHBondContact O-N 3.48Å; A1515-L1519 WeakPolarHBondContact O-CB 3.24Å; A1515-L1519 PolarHBondContact O-N 2.89Å
1516	D	58.8	Low	55	Low	91 Å²	91	76.8 Å²	76.8	49%	0.487	42%	0.423	S	S	.	.	H	α-helix	trans	-61.2	-38.7	173.7	-77.4	-21.3	0	0	0	112.3	S1512 L1519 K1520	S1512-D1516 WeakPolarHBondContact O-CB 3.3Å; S1512-D1516 PolarHBondContact O-N 3.29Å; D1516-L1519 PolarHBondContact O-N 3.39Å; D1516-K1520 WeakPolarHBondContact O-CB 3.35Å; D1516-K1520 VanDerWaalsContact O-CG 3.25Å; D1516-K1520 WeakPolarHBondContact O-CG 3.44Å; D1516-K1520 PolarHBondContact O-N 3.5Å
1517	H	63.3	Low	55.8	Low	111 Å²	111	79.3 Å²	79.3	51%	0.514	42%	0.417	S	S	.	.	H	α-helix	trans	-69.5	-41	174.1	-98.2	-101.7	0	0	0	111.9	K1513 L1514 A1515 L1519 K1520 I1521	K1513-H1517 WeakPolarHBondContact O-CB 3.14Å; K1513-H1517 PolarHBondContact O-CD2 3.19Å; K1513-H1517 PolarHBondContact O-N 3.49Å; L1514-H1517 PolarHBondContact O-N 3.42Å; A1515-H1517 VanDerWaalsContact C-N 3.34Å; A1515-H1517 PolarHBondContact O-N 3.35Å; H1517-L1519 VanDerWaalsContact C-N 3.3Å; H1517-L1519 PolarHBondContact O-N 3.11Å; H1517-K1520 PolarHBondContact O-N 2.87Å; H1517-I1521 WeakPolarHBondContact O-CB 3.38Å; H1517-I1521 WeakPolarHBondContact O-CD1 3.42Å; H1517-I1521 WeakPolarHBondContact O-CG1 3.38Å; H1517-I1521 PolarHBondContact O-N 3.47Å
1518	A	58.3	Low	56.4	Low	26 Å²	26	82.8 Å²	82.8	22%	0.215	43%	0.428	C	S	.	.	H	α-helix	trans	-64.1	-36.5	173.2	0	0	0	0	0	111.4	L1514 A1515 I1521 Y1522	L1514-A1518 WeakPolarHBondContact O-CB 3.22Å; L1514-A1518 PolarHBondContact O-N 3.17Å; A1515-A1518 CarbonylContact O-C 3.56Å; A1515-A1518 PolarHBondContact O-N 3.48Å; A1518-I1521 PolarHBondContact O-N 3.02Å; A1518-Y1522 VanDerWaalsContact O-CB 3.26Å; A1518-Y1522 WeakPolarHBondContact O-CB 3.49Å; A1518-Y1522 PolarHBondContact O-N 2.87Å
1519	L	60.8	Low	56.9	Low	91 Å²	91	81.3 Å²	81.3	48%	0.476	41%	0.409	S	S	.	.	H	α-helix	trans	-69.2	-39.8	174	-145.7	91.6	0	0	0	111.2	A1515 D1516 H1517 Y1522 T1523	A1515-L1519 WeakPolarHBondContact O-CB 3.24Å; A1515-L1519 PolarHBondContact O-N 2.89Å; D1516-L1519 PolarHBondContact O-N 3.39Å; H1517-L1519 VanDerWaalsContact C-N 3.3Å; H1517-L1519 PolarHBondContact O-N 3.11Å; L1519-Y1522 WeakPolarHBondContact O-CB 3.29Å; L1519-Y1522 PolarHBondContact O-N 3.19Å; L1519-T1523 WeakPolarHBondContact O-CG2 3.41Å; L1519-T1523 PolarHBondContact O-N 3.46Å; L1519-T1523 PolarHBondContact O-OG1 3.29Å
1520	K	63.5	Low	57.1	Low	119 Å²	119	81.5 Å²	81.5	52%	0.517	42%	0.418	S	S	.	.	H	α-helix	trans	-63	-45.5	171.6	-77.9	171	-176.2	175.5	0	111.3	D1516 H1517 T1523 N1524	D1516-K1520 WeakPolarHBondContact O-CB 3.35Å; D1516-K1520 VanDerWaalsContact O-CG 3.25Å; D1516-K1520 WeakPolarHBondContact O-CG 3.44Å; D1516-K1520 PolarHBondContact O-N 3.5Å; H1517-K1520 PolarHBondContact O-N 2.87Å; K1520-T1523 WeakPolarHBondContact CA-OG1 3.4Å; K1520-T1523 PolarHBondContact O-N 3.44Å; K1520-T1523 PolarHBondContact O-OG1 3.05Å; K1520-N1524 WeakPolarHBondContact O-CB 3.35Å; K1520-N1524 VanDerWaalsContact O-CG 3.29Å; K1520-N1524 PolarHBondContact O-N 3.37Å; K1520-N1524 PolarHBondContact O-ND2 3.02Å
1521	I	61.6	Low	57.1	Low	95 Å²	95	82.3 Å²	82.3	49%	0.487	43%	0.427	S	S	.	.	H	α-helix	trans	-59.9	-46.7	174.2	-69.7	162.8	0	0	0	109.8	H1517 A1518 T1523 N1524 V1525	H1517-I1521 WeakPolarHBondContact O-CB 3.38Å; H1517-I1521 WeakPolarHBondContact O-CD1 3.42Å; H1517-I1521 WeakPolarHBondContact O-CG1 3.38Å; H1517-I1521 PolarHBondContact O-N 3.47Å; A1518-I1521 PolarHBondContact O-N 3.02Å; I1521-T1523 PolarHBondContact O-N 3.35Å; I1521-N1524 PolarHBondContact O-N 3.3Å; I1521-N1524 VanDerWaalsContact O-N 3.17Å; I1521-V1525 HydrophobicContact CG2-CG2 4.12Å; I1521-V1525 WeakPolarHBondContact O-CB 3.36Å; I1521-V1525 VanDerWaalsContact O-CG2 3.3Å; I1521-V1525 WeakPolarHBondContact O-CG2 3.37Å; I1521-V1525 PolarHBondContact O-N 3.46Å
1522	Y	57.7	Low	56.8	Low	47 Å²	47	84.9 Å²	84.9	18%	0.184	44%	0.441	C	S	.	.	H	α-helix	trans	-54.7	-51	173	173.5	-91.8	0	0	0	111.7	A1518 L1519 N1524 V1525 Q1526 M1543 V1546 R1547	A1518-Y1522 VanDerWaalsContact O-CB 3.26Å; A1518-Y1522 WeakPolarHBondContact O-CB 3.49Å; A1518-Y1522 PolarHBondContact O-N 2.87Å; L1519-Y1522 WeakPolarHBondContact O-CB 3.29Å; L1519-Y1522 PolarHBondContact O-N 3.19Å; Y1522-N1524 VanDerWaalsContact C-N 3.3Å; Y1522-N1524 PolarHBondContact O-N 2.81Å; Y1522-V1525 PolarHBondContact O-N 3Å; Y1522-Q1526 WeakPolarHBondContact O-CB 3.39Å; Y1522-Q1526 PolarHBondContact O-N 3.34Å; Y1522-M1543 HydrophobicContact CD2-CE 4.08Å; Y1522-M1543 HydrophobicContact CD2-SD 3.83Å; Y1522-M1543 HydrophobicContact CE1-CE 3.93Å; Y1522-M1543 HydrophobicContact CE2-CB 4.18Å; Y1522-M1543 HydrophobicContact CE2-CE 3.36Å; Y1522-M1543 WeakPolarHBondContact CE2-O 3.23Å; Y1522-M1543 HydrophobicContact CE2-SD 3.61Å; Y1522-M1543 WeakPolarHBondContact OH-CE 3.24Å; Y1522-V1546 HydrophobicContact CD2-CB 4.19Å; Y1522-V1546 HydrophobicContact CD2-CG1 3.98Å; Y1522-V1546 HydrophobicContact CG-CG1 4.41Å; Y1522-R1547 HydrophobicContact CE2-CB 4.08Å
1523	T	59.8	Low	56.5	Low	47 Å²	47	86.5 Å²	86.5	29%	0.288	45%	0.452	S	S	.	.	H	α-helix	trans	-65.4	-30.4	178	59.2	0	0	0	0	113.3	L1519 K1520 I1521 R1527	L1519-T1523 WeakPolarHBondContact O-CG2 3.41Å; L1519-T1523 PolarHBondContact O-N 3.46Å; L1519-T1523 PolarHBondContact O-OG1 3.29Å; K1520-T1523 WeakPolarHBondContact CA-OG1 3.4Å; K1520-T1523 PolarHBondContact O-N 3.44Å; K1520-T1523 PolarHBondContact O-OG1 3.05Å; I1521-T1523 PolarHBondContact O-N 3.35Å; T1523-R1527 WeakPolarHBondContact O-CD 3.37Å; T1523-R1527 WeakPolarHBondContact O-CG 3.42Å; T1523-R1527 PolarHBondContact O-N 3.32Å; T1523-R1527 VanDerWaalsContact O-N 3.1Å
1524	N	63.2	Low	56	Low	78 Å²	78	86.9 Å²	86.9	42%	0.417	46%	0.461	S	S	.	.	H	α-helix	trans	-77.8	-40.3	176.8	-73.4	-18.6	0	0	0	112	K1520 I1521 Y1522 R1527 L1528	K1520-N1524 WeakPolarHBondContact O-CB 3.35Å; K1520-N1524 VanDerWaalsContact O-CG 3.29Å; K1520-N1524 PolarHBondContact O-N 3.37Å; K1520-N1524 PolarHBondContact O-ND2 3.02Å; I1521-N1524 PolarHBondContact O-N 3.3Å; I1521-N1524 VanDerWaalsContact O-N 3.17Å; Y1522-N1524 VanDerWaalsContact C-N 3.3Å; Y1522-N1524 PolarHBondContact O-N 2.81Å; N1524-R1527 PolarHBondContact O-N 2.94Å; N1524-R1527 PolarHBondContact OD1-NH1 3.31Å; N1524-L1528 WeakPolarHBondContact O-CB 3.42Å; N1524-L1528 VanDerWaalsContact O-CG 3.28Å; N1524-L1528 WeakPolarHBondContact O-CG 3.5Å; N1524-L1528 PolarHBondContact O-N 3.11Å
1525	V	55.3	Low	55.8	Low	45 Å²	45	85.3 Å²	85.3	27%	0.273	46%	0.455	S	S	.	.	H	α-helix	trans	-65.6	-39.9	172.7	170	0	0	0	0	110.4	I1521 Y1522 R1527 L1528 L1529	I1521-V1525 HydrophobicContact CG2-CG2 4.12Å; I1521-V1525 WeakPolarHBondContact O-CB 3.36Å; I1521-V1525 VanDerWaalsContact O-CG2 3.3Å; I1521-V1525 WeakPolarHBondContact O-CG2 3.37Å; I1521-V1525 PolarHBondContact O-N 3.46Å; Y1522-V1525 PolarHBondContact O-N 3Å; V1525-R1527 VanDerWaalsContact C-N 3.32Å; V1525-R1527 PolarHBondContact O-N 2.77Å; V1525-L1528 PolarHBondContact O-N 3.26Å; V1525-L1529 HydrophobicContact CG1-CD1 3.63Å; V1525-L1529 HydrophobicContact CG1-CG 4.27Å; V1525-L1529 WeakPolarHBondContact O-CB 3.24Å; V1525-L1529 WeakPolarHBondContact O-CG 3.11Å; V1525-L1529 PolarHBondContact O-N 3.34Å
1526	Q	54.5	Low	55.2	Low	93 Å²	93	91.5 Å²	91.5	44%	0.435	48%	0.478	S	S	.	.	H	α-helix	trans	-59.1	-41.7	171.7	-172.9	170.9	6.5	0	0	112.1	Y1522 A1530 M1543	Y1522-Q1526 WeakPolarHBondContact O-CB 3.39Å; Y1522-Q1526 PolarHBondContact O-N 3.34Å; Q1526-A1530 VanDerWaalsContact O-CB 3.28Å; Q1526-A1530 WeakPolarHBondContact O-CB 3.46Å; Q1526-A1530 PolarHBondContact O-N 2.92Å; Q1526-A1530 VanDerWaalsContact O-N 3.14Å; Q1526-M1543 HydrophobicContact CB-CE 3.52Å; Q1526-M1543 HydrophobicContact CB-SD 3.84Å; Q1526-M1543 VanDerWaalsContact CD-CE 3.42Å; Q1526-M1543 HydrophobicContact CG-CE 3.44Å; Q1526-M1543 VanDerWaalsContact CG-CE 3.44Å; Q1526-M1543 HydrophobicContact CG-SD 4.34Å
1527	R	57.8	Low	54.9	Low	170 Å²	170	91.2 Å²	91.2	64%	0.642	48%	0.483	S	S	*	.	H	α-helix	trans	-68	-37.8	175	-74.7	165.6	-177.4	162.5	-2.4	112.7	T1523 N1524 V1525	T1523-R1527 WeakPolarHBondContact O-CD 3.37Å; T1523-R1527 WeakPolarHBondContact O-CG 3.42Å; T1523-R1527 PolarHBondContact O-N 3.32Å; T1523-R1527 VanDerWaalsContact O-N 3.1Å; N1524-R1527 PolarHBondContact O-N 2.94Å; N1524-R1527 PolarHBondContact OD1-NH1 3.31Å; V1525-R1527 VanDerWaalsContact C-N 3.32Å; V1525-R1527 PolarHBondContact O-N 2.77Å
1528	L	55	Low	54.3	Low	126 Å²	126	91.9 Å²	91.9	66%	0.66	48%	0.481	S	S	*	.	H	α-helix	trans	-74.9	-31.7	179.9	-72.9	165	0	0	0	113.2	N1524 V1525 T1531	N1524-L1528 WeakPolarHBondContact O-CB 3.42Å; N1524-L1528 VanDerWaalsContact O-CG 3.28Å; N1524-L1528 WeakPolarHBondContact O-CG 3.5Å; N1524-L1528 PolarHBondContact O-N 3.11Å; V1525-L1528 PolarHBondContact O-N 3.26Å; L1528-T1531 PolarHBondContact O-OG1 3.32Å
1529	L	51	Low	54	Low	50 Å²	50	91 Å²	91	26%	0.262	47%	0.474	S	S	.	.	H	α-helix	trans	-85.2	-14.9	175.7	-69	170.8	0	0	0	113	V1525 T1531	V1525-L1529 HydrophobicContact CG1-CD1 3.63Å; V1525-L1529 HydrophobicContact CG1-CG 4.27Å; V1525-L1529 WeakPolarHBondContact O-CB 3.24Å; V1525-L1529 WeakPolarHBondContact O-CG 3.11Å; V1525-L1529 PolarHBondContact O-N 3.34Å; L1529-T1531 PolarHBondContact O-N 2.92Å
1530	A	51.9	Low	53.8	Low	77 Å²	77	92 Å²	92	64%	0.636	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.1	176.3	0	0	0	0	0	113.8	Q1526	Q1526-A1530 VanDerWaalsContact O-CB 3.28Å; Q1526-A1530 WeakPolarHBondContact O-CB 3.46Å; Q1526-A1530 PolarHBondContact O-N 2.92Å; Q1526-A1530 VanDerWaalsContact O-N 3.14Å
1531	T	51.8	Low	53.4	Low	115 Å²	115	89.7 Å²	89.7	71%	0.706	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-9.7	-175.2	43.7	0	0	0	0	115.2	L1528 L1529	L1528-T1531 PolarHBondContact O-OG1 3.32Å; L1529-T1531 PolarHBondContact O-N 2.92Å
1532	E	47.3	Very low	53	Low	119 Å²	119	89 Å²	89	56%	0.556	47%	0.468	S	S	*	.			trans	-114.6	122.3	177.8	-69.8	-180	163.1	0	0	110.5	D1534 T1535	E1532-D1534 VanDerWaalsContact C-N 3.29Å; E1532-D1534 PolarHBondContact O-N 3.36Å; E1532-T1535 PolarHBondContact O-OG1 2.81Å
1533	S	44.5	Very low	53	Low	91 Å²	91	87.6 Å²	87.6	64%	0.636	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-65.9	-30.7	-172.2	50.4	0	0	0	0	113.9
1534	D	47.7	Very low	53.2	Low	146 Å²	146	90.5 Å²	90.5	78%	0.781	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-95.4	-6.2	-163.6	-62.7	-0.7	0	0	0	113	E1532	E1532-D1534 VanDerWaalsContact C-N 3.29Å; E1532-D1534 PolarHBondContact O-N 3.36Å
1535	T	50.4	Low	53.1	Low	38 Å²	38	88.6 Å²	88.6	23%	0.233	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-98.6	3.7	-177.7	56.7	0	0	0	0	114.1	E1532 S1537 R1538 G1539	E1532-T1535 PolarHBondContact O-OG1 2.81Å; T1535-S1537 PolarHBondContact O-N 3.36Å; T1535-R1538 PolarHBondContact O-N 3.26Å; T1535-G1539 PolarHBondContact O-N 3.44Å
1536	K	45.8	Very low	53.5	Low	147 Å²	147	88.1 Å²	88.1	64%	0.639	46%	0.46	S	S	*	.	H	α-helix	trans	-57.4	-33.1	-172.4	-79.2	-180	176.4	173	0	116.3	N1540	K1536-N1540 PolarHBondContact O-N 2.82Å; K1536-N1540 PolarHBondContact O-ND2 3.05Å
1537	S	52.6	Low	54	Low	84 Å²	84	90.9 Å²	90.9	59%	0.587	47%	0.466	S	S	*	.	H	α-helix	trans	-74	-54.2	176.9	53.6	0	0	0	0	111.6	T1535 G1539 N1540	T1535-S1537 PolarHBondContact O-N 3.36Å; S1537-G1539 VanDerWaalsContact C-N 3.26Å; S1537-G1539 PolarHBondContact O-N 2.62Å; S1537-N1540 PolarHBondContact O-N 3.26Å; S1537-N1540 VanDerWaalsContact O-N 3.15Å
1538	R	49.1	Very low	54.4	Low	126 Å²	126	83.9 Å²	83.9	48%	0.475	44%	0.442	S	S	.	.	H	α-helix	trans	-57.4	-38.1	175.6	-74.4	178.7	169.3	171.1	-3.3	112.1	N497 T1535 N1540 E1541 I1542	N497-R1538 PolarHBondContact ND2-NH2 3.47Å; T1535-R1538 PolarHBondContact O-N 3.26Å; R1538-N1540 PolarHBondContact O-N 3.12Å; R1538-E1541 PolarHBondContact O-N 2.96Å; R1538-I1542 WeakPolarHBondContact O-CG1 3.1Å; R1538-I1542 PolarHBondContact O-N 3.37Å
1539	G	52.8	Low	54.8	Low	7 Å²	7	83.3 Å²	83.3	7%	0.072	43%	0.434	C	S	.	.	H	α-helix	trans	-60.1	-42.6	176.4	0	0	0	0	0	112.9	T1535 S1537 E1541 I1542 M1543	T1535-G1539 PolarHBondContact O-N 3.44Å; S1537-G1539 VanDerWaalsContact C-N 3.26Å; S1537-G1539 PolarHBondContact O-N 2.62Å; G1539-E1541 PolarHBondContact O-N 3.21Å; G1539-I1542 PolarHBondContact O-N 3.02Å; G1539-M1543 WeakPolarHBondContact O-CB 3.26Å; G1539-M1543 WeakPolarHBondContact O-CG 3.33Å; G1539-M1543 PolarHBondContact O-N 3.08Å
1540	N	56.4	Low	55.4	Low	112 Å²	112	81.6 Å²	81.6	60%	0.599	43%	0.426	S	S	*	.	H	α-helix	trans	-65.7	-36.6	180	-78.1	-22.6	0	0	0	113.3	K1536 S1537 R1538 Q1544	K1536-N1540 PolarHBondContact O-N 2.82Å; K1536-N1540 PolarHBondContact O-ND2 3.05Å; S1537-N1540 PolarHBondContact O-N 3.26Å; S1537-N1540 VanDerWaalsContact O-N 3.15Å; R1538-N1540 PolarHBondContact O-N 3.12Å; N1540-Q1544 WeakPolarHBondContact O-CG 3.27Å; N1540-Q1544 PolarHBondContact O-N 3.41Å
1541	E	54.5	Low	55.9	Low	70 Å²	70	82 Å²	82	33%	0.327	42%	0.417	S	S	.	.	H	α-helix	trans	-68.4	-43.8	178.1	-68.8	-174.4	-145.7	0	0	112.1	N488 S491 R1538 G1539 Q1544 L1545	N488-E1541 PolarHBondContact ND2-O 3.07Å; S491-E1541 VanDerWaalsContact CB-OE2 3.31Å; S491-E1541 WeakPolarHBondContact CB-OE2 3.4Å; S491-E1541 PolarHBondContact OG-OE2 2.99Å; R1538-E1541 PolarHBondContact O-N 2.96Å; G1539-E1541 PolarHBondContact O-N 3.21Å; E1541-Q1544 PolarHBondContact O-N 2.8Å; E1541-L1545 PolarHBondContact O-N 2.9Å
1542	I	54.8	Low	56.5	Low	80 Å²	80	77.5 Å²	77.5	41%	0.41	39%	0.389	S	S	.	.	H	α-helix	trans	-65.5	-41.9	175.1	-64	170.1	0	0	0	110.4	R1538 G1539 L1545 V1546	R1538-I1542 WeakPolarHBondContact O-CG1 3.1Å; R1538-I1542 PolarHBondContact O-N 3.37Å; G1539-I1542 PolarHBondContact O-N 3.02Å; I1542-L1545 WeakPolarHBondContact O-CB 3.25Å; I1542-L1545 PolarHBondContact O-N 3.46Å; I1542-L1545 VanDerWaalsContact O-N 3.16Å; I1542-V1546 WeakPolarHBondContact O-CG2 3.49Å; I1542-V1546 PolarHBondContact O-N 3.31Å
1543	M	57.8	Low	57.1	Low	19 Å²	19	72.9 Å²	72.9	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-61.5	-43.3	176.3	-76.7	-79.4	-72.6	0	0	112.3	Y1522 Q1526 G1539 L1545 V1546 R1547	Y1522-M1543 HydrophobicContact CD2-CE 4.08Å; Y1522-M1543 HydrophobicContact CD2-SD 3.83Å; Y1522-M1543 HydrophobicContact CE1-CE 3.93Å; Y1522-M1543 HydrophobicContact CE2-CB 4.18Å; Y1522-M1543 HydrophobicContact CE2-CE 3.36Å; Y1522-M1543 WeakPolarHBondContact CE2-O 3.23Å; Y1522-M1543 HydrophobicContact CE2-SD 3.61Å; Y1522-M1543 WeakPolarHBondContact OH-CE 3.24Å; Q1526-M1543 HydrophobicContact CB-CE 3.52Å; Q1526-M1543 HydrophobicContact CB-SD 3.84Å; Q1526-M1543 VanDerWaalsContact CD-CE 3.42Å; Q1526-M1543 HydrophobicContact CG-CE 3.44Å; Q1526-M1543 VanDerWaalsContact CG-CE 3.44Å; Q1526-M1543 HydrophobicContact CG-SD 4.34Å; G1539-M1543 WeakPolarHBondContact O-CB 3.26Å; G1539-M1543 WeakPolarHBondContact O-CG 3.33Å; G1539-M1543 PolarHBondContact O-N 3.08Å; M1543-L1545 VanDerWaalsContact C-N 3.34Å; M1543-V1546 PolarHBondContact O-N 2.72Å; M1543-R1547 WeakPolarHBondContact O-CB 3.2Å; M1543-R1547 PolarHBondContact O-N 2.86Å
1544	Q	62.5	Low	57.7	Low	108 Å²	108	71.3 Å²	71.3	51%	0.505	36%	0.357	S	S	.	.	H	α-helix	trans	-61.8	-41.2	172	-80.9	-175.6	-8.6	0	0	112	N488 N1540 E1541 R1547 N1548	N488-Q1544 WeakPolarHBondContact ND2-CB 3.27Å; N488-Q1544 PolarHBondContact ND2-OE1 2.85Å; N488-Q1544 VanDerWaalsContact ND2-OE1 3.15Å; N1540-Q1544 WeakPolarHBondContact O-CG 3.27Å; N1540-Q1544 PolarHBondContact O-N 3.41Å; E1541-Q1544 PolarHBondContact O-N 2.8Å; Q1544-R1547 PolarHBondContact O-N 3.31Å; Q1544-N1548 VanDerWaalsContact O-CB 3.27Å; Q1544-N1548 WeakPolarHBondContact O-CB 3.49Å; Q1544-N1548 PolarHBondContact O-N 3.48Å; Q1544-N1548 PolarHBondContact O-ND2 2.96Å; Q1544-N1548 PolarHBondContact O-OD1 3.47Å
1545	L	61.9	Low	58.2	Low	38 Å²	38	67 Å²	67	20%	0.199	34%	0.335	C	S	.	.	H	α-helix	trans	-62.2	-45.1	178.4	-172.3	152.3	0	0	0	111.7	N488 I489 E1541 I1542 M1543 N1548 F1549	N488-L1545 HydrophobicContact CB-CD1 4.41Å; I489-L1545 HydrophobicContact CD1-CD1 4.39Å; I489-L1545 HydrophobicContact CG1-CD1 3.59Å; E1541-L1545 PolarHBondContact O-N 2.9Å; I1542-L1545 WeakPolarHBondContact O-CB 3.25Å; I1542-L1545 PolarHBondContact O-N 3.46Å; I1542-L1545 VanDerWaalsContact O-N 3.16Å; M1543-L1545 VanDerWaalsContact C-N 3.34Å; L1545-N1548 PolarHBondContact O-N 2.84Å; L1545-F1549 HydrophobicContact CD2-CD2 3.91Å; L1545-F1549 HydrophobicContact CD2-CE2 4.18Å; L1545-F1549 PolarHBondContact O-N 3.25Å
1546	V	62.7	Low	58.7	Low	34 Å²	34	70 Å²	70	21%	0.206	35%	0.349	C	S	.	.	H	α-helix	trans	-66.6	-41.1	176.2	177.5	0	0	0	0	111.5	Y1522 I1542 M1543 N1548 F1549 S1550	Y1522-V1546 HydrophobicContact CD2-CB 4.19Å; Y1522-V1546 HydrophobicContact CD2-CG1 3.98Å; Y1522-V1546 HydrophobicContact CG-CG1 4.41Å; I1542-V1546 WeakPolarHBondContact O-CG2 3.49Å; I1542-V1546 PolarHBondContact O-N 3.31Å; M1543-V1546 PolarHBondContact O-N 2.72Å; V1546-N1548 PolarHBondContact O-N 3.11Å; V1546-F1549 PolarHBondContact O-N 3.34Å; V1546-S1550 PolarHBondContact O-N 3.4Å
1547	R	65.5	Low	59.3	Low	151 Å²	151	65.4 Å²	65.4	57%	0.57	34%	0.336	S	S	*	.	H	α-helix	trans	-60.7	-44.7	175.2	-175.4	177.4	-179.8	-179.3	-0.4	111.5	Y1522 M1543 Q1544 S1550 L1551	Y1522-R1547 HydrophobicContact CE2-CB 4.08Å; M1543-R1547 WeakPolarHBondContact O-CB 3.2Å; M1543-R1547 PolarHBondContact O-N 2.86Å; Q1544-R1547 PolarHBondContact O-N 3.31Å; R1547-S1550 PolarHBondContact O-N 3.26Å; R1547-S1550 PolarHBondContact O-OG 3.03Å; R1547-L1551 PolarHBondContact O-N 3.42Å
1548	N	65.8	Low	59.6	Low	24 Å²	24	64.9 Å²	64.9	13%	0.128	33%	0.329	C	S	.	.	H	α-helix	trans	-61.9	-43.4	176.5	-72.7	-7.7	0	0	0	111.6	I481 A484 T485 Q1544 L1545 V1546 S1550 L1551 L1552	I481-N1548 HydrophobicContact CG2-CB 3.83Å; I481-N1548 VanDerWaalsContact CG2-O 3.22Å; I481-N1548 WeakPolarHBondContact CG2-O 3.36Å; A484-N1548 WeakPolarHBondContact CB-ND2 3.4Å; T485-N1548 HydrophobicContact CG2-CB 3.49Å; T485-N1548 VanDerWaalsContact CG2-CB 3.49Å; Q1544-N1548 VanDerWaalsContact O-CB 3.27Å; Q1544-N1548 WeakPolarHBondContact O-CB 3.49Å; Q1544-N1548 PolarHBondContact O-N 3.48Å; Q1544-N1548 PolarHBondContact O-ND2 2.96Å; Q1544-N1548 PolarHBondContact O-OD1 3.47Å; L1545-N1548 PolarHBondContact O-N 2.84Å; V1546-N1548 PolarHBondContact O-N 3.11Å; N1548-S1550 VanDerWaalsContact C-N 3.33Å; N1548-S1550 PolarHBondContact O-N 3.36Å; N1548-L1551 PolarHBondContact O-N 2.85Å; N1548-L1552 PolarHBondContact O-N 3.4Å
1549	F	64.4	Low	60.1	Low	113 Å²	113	61.5 Å²	61.5	50%	0.496	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-38.4	172.5	-101.2	-83.6	0	0	0	113.1	T485 L1545 V1546 L1551 L1552 T1553	T485-F1549 HydrophobicContact CG2-CD2 4.23Å; T485-F1549 HydrophobicContact CG2-CE2 4.41Å; L1545-F1549 HydrophobicContact CD2-CD2 3.91Å; L1545-F1549 HydrophobicContact CD2-CE2 4.18Å; L1545-F1549 PolarHBondContact O-N 3.25Å; V1546-F1549 PolarHBondContact O-N 3.34Å; F1549-L1551 VanDerWaalsContact C-N 3.29Å; F1549-L1551 PolarHBondContact O-N 3.45Å; F1549-L1552 WeakPolarHBondContact O-CB 3.32Å; F1549-L1552 PolarHBondContact O-N 3.19Å; F1549-T1553 PolarHBondContact O-N 3.33Å
1550	S	63.4	Low	60.5	Low	14 Å²	14	61.7 Å²	61.7	10%	0.098	33%	0.329	C	S	.	.	H	α-helix	trans	-68	-25	178.3	74.4	0	0	0	0	114.2	V1546 R1547 N1548 T1553 P1554	V1546-S1550 PolarHBondContact O-N 3.4Å; R1547-S1550 PolarHBondContact O-N 3.26Å; R1547-S1550 PolarHBondContact O-OG 3.03Å; N1548-S1550 VanDerWaalsContact C-N 3.33Å; N1548-S1550 PolarHBondContact O-N 3.36Å; S1550-T1553 PolarHBondContact O-OG1 3.5Å; S1550-T1553 VanDerWaalsContact O-OG1 3.13Å; S1550-P1554 VanDerWaalsContact O-CD 3.3Å; S1550-P1554 WeakPolarHBondContact O-CD 3.49Å
1551	L	62.6	Low	61.1	Low	85 Å²	85	58.8 Å²	58.8	45%	0.445	31%	0.313	S	S	.	.	H	α-helix	trans	-81	-26.5	174	-69.3	164.7	0	0	0	112.2	I481 R1547 N1548 F1549 P1554	I481-L1551 HydrophobicContact CD1-CB 3.64Å; I481-L1551 HydrophobicContact CD1-CD1 4.21Å; R1547-L1551 PolarHBondContact O-N 3.42Å; N1548-L1551 PolarHBondContact O-N 2.85Å; F1549-L1551 VanDerWaalsContact C-N 3.29Å; F1549-L1551 PolarHBondContact O-N 3.45Å; L1551-P1554 WeakPolarHBondContact O-CD 3.34Å
1552	L	63.3	Low	62.1	Low	22 Å²	22	55.5 Å²	55.5	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-70.7	-42.1	177.6	-113.8	155.8	0	0	0	112.2	F478 I481 L482 N1548 F1549 T1555	F478-L1552 HydrophobicContact CD2-CD2 3.66Å; F478-L1552 HydrophobicContact CE2-CD2 3.35Å; F478-L1552 HydrophobicContact CZ-CD2 4.29Å; I481-L1552 HydrophobicContact CG2-CD1 3.67Å; I481-L1552 HydrophobicContact CG2-CG 3.98Å; L482-L1552 HydrophobicContact CD2-CD1 4.49Å; L482-L1552 HydrophobicContact CG-CD1 4.43Å; N1548-L1552 PolarHBondContact O-N 3.4Å; F1549-L1552 WeakPolarHBondContact O-CB 3.32Å; F1549-L1552 PolarHBondContact O-N 3.19Å; L1552-T1555 PolarHBondContact O-N 3.15Å; L1552-T1555 PolarHBondContact O-OG1 3.01Å
1553	T	60.2	Low	63.1	Low	21 Å²	21	56.1 Å²	56.1	13%	0.129	30%	0.297	C	S	.	.	H	α-helix	trans	-58.5	-43.5	-173.9	42.4	0	0	0	0	116.5	Y1511 L1514 F1549 S1550 T1555 L1556	Y1511-T1553 WeakPolarHBondContact CD1-O 3.36Å; L1514-T1553 HydrophobicContact CD2-CG2 3.87Å; L1514-T1553 HydrophobicContact CG-CG2 4.49Å; F1549-T1553 PolarHBondContact O-N 3.33Å; S1550-T1553 PolarHBondContact O-OG1 3.5Å; S1550-T1553 VanDerWaalsContact O-OG1 3.13Å; T1553-T1555 VanDerWaalsContact C-N 3.31Å; T1553-T1555 PolarHBondContact O-N 3.49Å; T1553-L1556 PolarHBondContact O-N 3.22Å
1554	P	58.1	Low	64	Low	59 Å²	59	55.2 Å²	55.2	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-67.8	-27.5	179.5	24.9	-34.5	0	0	0	113.7	S1550 L1551 L1556 S1557	S1550-P1554 VanDerWaalsContact O-CD 3.3Å; S1550-P1554 WeakPolarHBondContact O-CD 3.49Å; L1551-P1554 WeakPolarHBondContact O-CD 3.34Å; P1554-L1556 PolarHBondContact O-N 3.19Å; P1554-S1557 PolarHBondContact O-N 3.08Å; P1554-S1557 PolarHBondContact O-OG 3.14Å
1555	T	58.6	Low	64.6	Low	54 Å²	54	50.4 Å²	50.4	33%	0.331	27%	0.27	S	S	.	.	H	α-helix	trans	-66.7	-17.4	-179.9	64	0	0	0	0	113.8	L1552 T1553	L1552-T1555 PolarHBondContact O-N 3.15Å; L1552-T1555 PolarHBondContact O-OG1 3.01Å; T1553-T1555 VanDerWaalsContact C-N 3.31Å; T1553-T1555 PolarHBondContact O-N 3.49Å
1556	L	59.8	Low	65	Low	101 Å²	101	49.2 Å²	49.2	53%	0.529	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-1.6	178.3	-63.7	169.9	0	0	0	113.6	Y1511 T1553 P1554	Y1511-L1556 HydrophobicContact CE1-CB 4.39Å; T1553-L1556 PolarHBondContact O-N 3.22Å; P1554-L1556 PolarHBondContact O-N 3.19Å
1557	S	59.5	Low	65.1	Low	52 Å²	52	48.2 Å²	48.2	36%	0.364	26%	0.258	S	S	.	.			trans	-88.8	126.2	-177.2	76.9	0	0	0	0	113	P1554	P1554-S1557 PolarHBondContact O-N 3.08Å; P1554-S1557 PolarHBondContact O-OG 3.14Å
1558	V	59.1	Low	64.6	Low	73 Å²	73	41.7 Å²	41.7	44%	0.442	24%	0.237	S	C	.	.			trans	-130.3	131.5	177.3	-174.6	0	0	0	0	108.6	G666 N1561	G666-V1558 VanDerWaalsContact N-CG1 3.28Å; V1558-N1561 VanDerWaalsContact CG1-OD1 3.32Å; V1558-N1561 WeakPolarHBondContact CG1-OD1 3.35Å
1559	A	57.8	Low	64	Low	55 Å²	55	43.3 Å²	43.3	46%	0.455	25%	0.25	S	S	.	.	S	Bend	trans	-90.1	-32.2	-172.3	0	0	0	0	0	113.8	K663 R664	K663-A1559 HydrophobicContact CB-CB 4.12Å; K663-A1559 HydrophobicContact CD-CB 4.3Å; K663-A1559 HydrophobicContact CG-CB 4.33Å; R664-A1559 PolarHBondContact O-N 3.13Å
1560	S	62.8	Low	63.5	Low	11 Å²	11	40.1 Å²	40.1	8%	0.077	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	149.4	-179.8	51.4	0	0	0	0	110	I665 G666	I665-S1560 CarbonylContact C-O 3.56Å; I665-S1560 WeakPolarHBondContact CA-O 3.36Å; G666-S1560 PolarHBondContact N-O 3.49Å
1561	N	68.7	Low	62.9	Low	50 Å²	50	41.3 Å²	41.3	27%	0.267	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.9	-178	-69	-20	0	0	0	110.9	G666 F668 G1499 A1500 V1558	G666-N1561 WeakPolarHBondContact O-CA 3.4Å; F668-N1561 HydrophobicContact CD2-CB 4.26Å; F668-N1561 HydrophobicContact CE2-CB 4.1Å; G1499-N1561 WeakPolarHBondContact CA-O 3.43Å; A1500-N1561 PolarHBondContact N-O 3.13Å; A1500-N1561 VanDerWaalsContact N-O 3.09Å; A1500-N1561 PolarHBondContact O-N 3.16Å; A1500-N1561 VanDerWaalsContact O-N 3.12Å; A1500-N1561 VanDerWaalsContact O-O 3.05Å; V1558-N1561 VanDerWaalsContact CG1-OD1 3.32Å; V1558-N1561 WeakPolarHBondContact CG1-OD1 3.35Å
1562	V	74	Confident	62.6	Low	1 Å²	1	38.6 Å²	38.6	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.7	177.3	177.2	0	0	0	0	108.9	I665 G666 F668 W1423 M1581 M1585	I665-V1562 HydrophobicContact CG2-CB 4.5Å; I665-V1562 HydrophobicContact CG2-CG2 3.78Å; G666-V1562 PolarHBondContact O-N 3.11Å; F668-V1562 PolarHBondContact N-O 3.26Å; W1423-V1562 HydrophobicContact CH2-CG2 3.9Å; W1423-V1562 HydrophobicContact CZ3-CG2 4.4Å; V1562-M1581 HydrophobicContact CG1-CE 3.64Å; V1562-M1581 HydrophobicContact CG1-CG 4.4Å; V1562-M1581 HydrophobicContact CG1-SD 4.08Å; V1562-M1585 HydrophobicContact CB-CE 4.4Å; V1562-M1585 HydrophobicContact CG2-CE 4.08Å
1563	K	75.9	Confident	62.6	Low	94 Å²	94	37.9 Å²	37.9	41%	0.409	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118	173.6	-64.8	-179.4	-176.3	176.6	0	109.8	F668 F1497 S1498	F668-K1563 HydrophobicContact CB-CG 4.21Å; F668-K1563 CarbonylContact O-C 3.54Å; F668-K1563 WeakPolarHBondContact O-CA 3.26Å; F1497-K1563 WeakPolarHBondContact CA-O 3.46Å; S1498-K1563 PolarHBondContact N-O 3.3Å; S1498-K1563 PolarHBondContact O-N 2.87Å
1564	I	77.3	Confident	63	Low	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	111.8	173.9	-58.4	175.5	0	0	0	107.9	F668 Q670 F1497 S1577 M1578 M1581	F668-I1564 PolarHBondContact O-N 2.84Å; Q670-I1564 PolarHBondContact N-O 3.31Å; F1497-I1564 HydrophobicContact CD1-CG1 4.2Å; F1497-I1564 HydrophobicContact CD1-CG2 4.37Å; F1497-I1564 HydrophobicContact CE1-CG1 4.31Å; F1497-I1564 HydrophobicContact CE1-CG2 4.02Å; I1564-S1577 VanDerWaalsContact CG2-CB 3.5Å; I1564-M1578 HydrophobicContact CD1-CG 3.92Å; I1564-M1581 HydrophobicContact CD1-CB 4.18Å; I1564-M1581 HydrophobicContact CD1-CG 4.26Å; I1564-M1581 HydrophobicContact CG1-CG 4.48Å
1565	W	74.7	Confident	63.4	Low	7 Å²	7	34.7 Å²	34.7	3%	0.027	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	132	175.5	-65.2	85.2	0	0	0	110.9	Q670 F672 F1408 L1482 G1495 G1496 S1498	Q670-W1565 HydrophobicContact CB-CD2 4.23Å; Q670-W1565 HydrophobicContact CB-CE3 4.21Å; Q670-W1565 HydrophobicContact CG-CD2 3.9Å; Q670-W1565 HydrophobicContact CG-CE3 3.51Å; Q670-W1565 HydrophobicContact CG-CH2 3.79Å; Q670-W1565 HydrophobicContact CG-CZ2 4.12Å; Q670-W1565 HydrophobicContact CG-CZ3 3.44Å; Q670-W1565 VanDerWaalsContact CG-CZ3 3.44Å; Q670-W1565 VanDerWaalsContact O-CA 3.27Å; Q670-W1565 WeakPolarHBondContact O-CA 3.35Å; F672-W1565 HydrophobicContact CD1-CB 4.21Å; F672-W1565 AromaticContact CD1-CE3 3.97Å; F672-W1565 HydrophobicContact CD1-CE3 3.97Å; F672-W1565 HydrophobicContact CE1-CB 3.73Å; F672-W1565 HydrophobicContact CE1-CE3 4.44Å; F672-W1565 HydrophobicContact CZ-CB 4.43Å; F1408-W1565 HydrophobicContact CE1-CB 3.89Å; F1408-W1565 HydrophobicContact CE1-CG 4.23Å; F1408-W1565 HydrophobicContact CZ-CB 3.72Å; F1408-W1565 AromaticContact CZ-CD1 3.58Å; F1408-W1565 HydrophobicContact CZ-CD2 4.14Å; F1408-W1565 AromaticContact CZ-CG 3.55Å; F1408-W1565 HydrophobicContact CZ-CG 3.55Å; L1482-W1565 HydrophobicContact CD1-CD2 4.35Å; L1482-W1565 HydrophobicContact CD1-CE3 4.01Å; L1482-W1565 HydrophobicContact CD1-CH2 4.4Å; L1482-W1565 HydrophobicContact CD1-CZ3 4.05Å; G1495-W1565 CarbonylContact C-O 3.58Å; G1495-W1565 WeakPolarHBondContact CA-O 3.48Å; G1496-W1565 PolarHBondContact N-O 2.73Å; G1496-W1565 WeakPolarHBondContact O-CA 3.44Å; G1496-W1565 WeakPolarHBondContact O-CB 3.28Å; G1496-W1565 PolarHBondContact O-N 3.02Å; S1498-W1565 PolarHBondContact OG-NE1 2.75Å
1566	Y	70.7	Confident	63.7	Low	12 Å²	12	34.1 Å²	34.1	5%	0.047	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.3	-179.7	70	-75.5	0	0	0	112.5	V669 Q670 P671 F672 G1568 L1574	V669-Y1566 HydrophobicContact CG1-CD1 3.91Å; V669-Y1566 HydrophobicContact CG1-CE1 3.3Å; Q670-Y1566 VanDerWaalsContact O-CD1 3.24Å; Q670-Y1566 WeakPolarHBondContact O-CD1 3.36Å; Q670-Y1566 PolarHBondContact O-N 2.9Å; Q670-Y1566 VanDerWaalsContact O-N 3.16Å; P671-Y1566 HydrophobicContact CB-CE1 4.02Å; P671-Y1566 HydrophobicContact CB-CE2 4.43Å; P671-Y1566 VanDerWaalsContact N-CE1 3.33Å; F672-Y1566 PolarHBondContact N-O 3.45Å; Y1566-G1568 PolarHBondContact O-N 2.92Å; Y1566-L1574 HydrophobicContact CD1-CD1 3.97Å; Y1566-L1574 HydrophobicContact CD2-CB 3.83Å; Y1566-L1574 HydrophobicContact CE1-CD1 4.24Å; Y1566-L1574 HydrophobicContact CE2-CB 4.16Å; Y1566-L1574 HydrophobicContact CG-CB 4.11Å; Y1566-L1574 HydrophobicContact CG-CD1 4.18Å
1567	P	63.9	Low	64.3	Low	14 Å²	14	29.5 Å²	29.5	9%	0.091	18%	0.183	C	C	.	.			trans	-73.1	105.1	170.1	30.4	-34.2	0	0	0	109.9	F672 W1493 T1494 S1569 S1573	F672-P1567 VanDerWaalsContact CD2-CA 3.49Å; F672-P1567 HydrophobicContact CD2-CB 3.79Å; F672-P1567 HydrophobicContact CE2-CB 4.05Å; F672-P1567 HydrophobicContact CE2-CG 4.37Å; W1493-P1567 WeakPolarHBondContact O-CG 3.43Å; T1494-P1567 WeakPolarHBondContact O-CD 3.4Å; P1567-S1569 PolarHBondContact O-N 2.95Å; P1567-S1573 PolarHBondContact O-OG 3.35Å
1568	G	56.6	Low	64.9	Low	13 Å²	13	27.2 Å²	27.2	13%	0.134	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	30.8	176	0	0	0	0	0	115.3	R674 Y1566	R674-G1568 PolarHBondContact NH2-O 3.37Å; Y1566-G1568 PolarHBondContact O-N 2.92Å
1569	S	52.7	Low	65.4	Low	59 Å²	59	24.1 Å²	24.1	41%	0.413	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-8.3	172.4	51.7	0	0	0	0	113.2	P1567	P1567-S1569 PolarHBondContact O-N 2.95Å
1570	S	52.9	Low	66	Low	46 Å²	46	21.9 Å²	21.9	32%	0.322	13%	0.129	S	C	.	.			trans	-148.1	140.4	169	71.7	0	0	0	0	111.9	S1572 S1573	S1570-S1572 PolarHBondContact O-N 3.43Å; S1570-S1572 PolarHBondContact OG-OG 3.41Å; S1570-S1573 PolarHBondContact O-N 3.45Å; S1570-S1573 PolarHBondContact O-OG 3.42Å; S1570-S1573 PolarHBondContact OG-N 3.35Å
1571	C	51.8	Low	66.5	Low	39 Å²	39	21.6 Å²	21.6	26%	0.264	13%	0.126	S	C	.	.	H	α-helix	trans	-63.2	-26.6	175.6	-54.1	0	0	0	0	112	S1573	C1571-S1573 VanDerWaalsContact C-N 3.29Å; C1571-S1573 PolarHBondContact O-N 3.2Å
1572	S	56.4	Low	66.6	Low	28 Å²	28	19.3 Å²	19.3	20%	0.196	11%	0.114	C	C	.	.	H	α-helix	trans	-65.2	-27.7	175.9	83	0	0	0	0	114	S1570 S1575 K1576	S1570-S1572 PolarHBondContact O-N 3.43Å; S1570-S1572 PolarHBondContact OG-OG 3.41Å; S1572-S1575 WeakPolarHBondContact O-CB 3.34Å; S1572-S1575 PolarHBondContact O-N 2.72Å; S1572-K1576 WeakPolarHBondContact O-CG 3.46Å; S1572-K1576 PolarHBondContact O-N 2.85Å
1573	S	62.5	Low	66.4	Low	7 Å²	7	19.5 Å²	19.5	5%	0.049	12%	0.115	C	C	.	.	H	α-helix	trans	-66.6	-49.1	-173.6	65.6	0	0	0	0	112.2	P1567 S1570 C1571 S1575 K1576 S1577	P1567-S1573 PolarHBondContact O-OG 3.35Å; S1570-S1573 PolarHBondContact O-N 3.45Å; S1570-S1573 PolarHBondContact O-OG 3.42Å; S1570-S1573 PolarHBondContact OG-N 3.35Å; C1571-S1573 VanDerWaalsContact C-N 3.29Å; C1571-S1573 PolarHBondContact O-N 3.2Å; S1573-S1575 VanDerWaalsContact C-N 3.28Å; S1573-S1575 PolarHBondContact O-N 2.83Å; S1573-K1576 PolarHBondContact O-N 3.19Å; S1573-K1576 VanDerWaalsContact O-N 3.11Å; S1573-S1577 PolarHBondContact O-N 2.8Å; S1573-S1577 PolarHBondContact O-OG 3.14Å
1574	L	69.1	Low	66	Low	5 Å²	5	15.2 Å²	15.2	3%	0.026	10%	0.097	C	C	.	.	H	α-helix	trans	-56.9	-44.2	174.7	177	56.1	0	0	0	111.1	N640 A644 V669 Y1566 K1576 S1577 M1578	N640-L1574 HydrophobicContact CB-CD2 4.41Å; A644-L1574 HydrophobicContact CB-CD2 4.34Å; V669-L1574 HydrophobicContact CB-CD1 4.33Å; V669-L1574 HydrophobicContact CG1-CD1 3.43Å; V669-L1574 VanDerWaalsContact CG1-CD1 3.43Å; V669-L1574 HydrophobicContact CG1-CD2 4.01Å; V669-L1574 HydrophobicContact CG1-CG 4.38Å; V669-L1574 HydrophobicContact CG2-CD1 3.91Å; Y1566-L1574 HydrophobicContact CD1-CD1 3.97Å; Y1566-L1574 HydrophobicContact CD2-CB 3.83Å; Y1566-L1574 HydrophobicContact CE1-CD1 4.24Å; Y1566-L1574 HydrophobicContact CE2-CB 4.16Å; Y1566-L1574 HydrophobicContact CG-CB 4.11Å; Y1566-L1574 HydrophobicContact CG-CD1 4.18Å; L1574-K1576 VanDerWaalsContact C-N 3.33Å; L1574-K1576 PolarHBondContact O-N 3.43Å; L1574-S1577 PolarHBondContact O-N 2.92Å; L1574-M1578 HydrophobicContact CD1-CG 4.06Å; L1574-M1578 HydrophobicContact CD1-SD 4.04Å; L1574-M1578 HydrophobicContact CG-SD 4.25Å; L1574-M1578 WeakPolarHBondContact O-CB 3.43Å; L1574-M1578 WeakPolarHBondContact O-CG 3.43Å; L1574-M1578 PolarHBondContact O-N 3.37Å
1575	S	67	Low	65.6	Low	7 Å²	7	15.3 Å²	15.3	5%	0.049	10%	0.098	C	C	.	.	H	α-helix	trans	-58.6	-42.7	176.6	-170.3	0	0	0	0	112.2	Y643 R647 S1572 S1573 S1579	Y643-S1575 PolarHBondContact OH-OG 3.16Å; R647-S1575 VanDerWaalsContact NH1-CA 3.33Å; R647-S1575 PolarHBondContact NH1-O 2.95Å; R647-S1575 VanDerWaalsContact NH1-O 3.09Å; R647-S1575 PolarHBondContact NH1-OG 2.84Å; R647-S1575 PolarHBondContact NH2-O 2.7Å; S1572-S1575 WeakPolarHBondContact O-CB 3.34Å; S1572-S1575 PolarHBondContact O-N 2.72Å; S1573-S1575 VanDerWaalsContact C-N 3.28Å; S1573-S1575 PolarHBondContact O-N 2.83Å; S1575-S1579 PolarHBondContact O-N 3.04Å; S1575-S1579 VanDerWaalsContact O-N 3.14Å
1576	K	65	Low	65.2	Low	43 Å²	43	15.9 Å²	15.9	19%	0.187	10%	0.101	C	C	.	.	H	α-helix	trans	-69.7	-47.1	176.8	-72.1	167.9	178.7	171.4	0	111.8	S1572 S1573 L1574 M1578 S1579 I1580	S1572-K1576 WeakPolarHBondContact O-CG 3.46Å; S1572-K1576 PolarHBondContact O-N 2.85Å; S1573-K1576 PolarHBondContact O-N 3.19Å; S1573-K1576 VanDerWaalsContact O-N 3.11Å; L1574-K1576 VanDerWaalsContact C-N 3.33Å; L1574-K1576 PolarHBondContact O-N 3.43Å; K1576-M1578 PolarHBondContact O-N 3.15Å; K1576-S1579 WeakPolarHBondContact O-CB 3.48Å; K1576-S1579 PolarHBondContact O-N 3.2Å; K1576-S1579 VanDerWaalsContact O-N 3.11Å; K1576-I1580 WeakPolarHBondContact O-CG1 3.39Å; K1576-I1580 PolarHBondContact O-N 3.41Å
1577	S	71.5	Confident	64.9	Low	4 Å²	4	17.8 Å²	17.8	3%	0.028	11%	0.109	C	C	.	.	H	α-helix	trans	-62	-41.1	179.3	-50.6	0	0	0	0	112.5	F1497 I1564 S1573 L1574 M1581	F1497-S1577 WeakPolarHBondContact CE1-O 3.35Å; I1564-S1577 VanDerWaalsContact CG2-CB 3.5Å; S1573-S1577 PolarHBondContact O-N 2.8Å; S1573-S1577 PolarHBondContact O-OG 3.14Å; L1574-S1577 PolarHBondContact O-N 2.92Å; S1577-M1581 PolarHBondContact O-N 3.24Å; S1577-M1581 VanDerWaalsContact O-N 3.11Å
1578	M	72.2	Confident	64.6	Low	3 Å²	3	19.8 Å²	19.8	2%	0.015	12%	0.121	C	C	.	.	H	α-helix	trans	-64.1	-38.3	172.5	-75.4	-179.2	118.6	0	0	112.2	A644 D648 V669 I1564 L1574 K1576 M1581 N1582	A644-M1578 HydrophobicContact CB-CE 4.3Å; A644-M1578 HydrophobicContact CB-SD 4.33Å; D648-M1578 HydrophobicContact CB-CE 4.45Å; V669-M1578 HydrophobicContact CG2-CE 3.94Å; I1564-M1578 HydrophobicContact CD1-CG 3.92Å; L1574-M1578 HydrophobicContact CD1-CG 4.06Å; L1574-M1578 HydrophobicContact CD1-SD 4.04Å; L1574-M1578 HydrophobicContact CG-SD 4.25Å; L1574-M1578 WeakPolarHBondContact O-CB 3.43Å; L1574-M1578 WeakPolarHBondContact O-CG 3.43Å; L1574-M1578 PolarHBondContact O-N 3.37Å; K1576-M1578 PolarHBondContact O-N 3.15Å; M1578-M1581 PolarHBondContact O-N 3.48Å; M1578-N1582 WeakPolarHBondContact O-CB 3.47Å; M1578-N1582 VanDerWaalsContact O-CG 3.3Å; M1578-N1582 PolarHBondContact O-N 3.26Å; M1578-N1582 PolarHBondContact O-ND2 3.11Å
1579	S	70	Confident	64.4	Low	9 Å²	9	22.6 Å²	22.6	6%	0.063	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-45.1	178.5	178.1	0	0	0	0	111.1	R647 S1575 K1576 M1581 N1583	R647-S1579 VanDerWaalsContact NH2-CB 3.34Å; S1575-S1579 PolarHBondContact O-N 3.04Å; S1575-S1579 VanDerWaalsContact O-N 3.14Å; K1576-S1579 WeakPolarHBondContact O-CB 3.48Å; K1576-S1579 PolarHBondContact O-N 3.2Å; K1576-S1579 VanDerWaalsContact O-N 3.11Å; S1579-M1581 VanDerWaalsContact C-N 3.34Å; S1579-M1581 PolarHBondContact O-N 3.26Å; S1579-N1583 VanDerWaalsContact O-CB 3.25Å; S1579-N1583 WeakPolarHBondContact O-CB 3.46Å; S1579-N1583 PolarHBondContact O-N 3.13Å; S1579-N1583 PolarHBondContact O-ND2 3.42Å; S1579-N1583 PolarHBondContact OG-ND2 3.48Å
1580	I	70	Confident	64.4	Low	7 Å²	7	24.9 Å²	24.9	4%	0.036	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-44.5	178.1	-67.2	164	0	0	0	110.5	P1397 F1398 I1407 L1427 F1497 K1576 A1584	P1397-I1580 HydrophobicContact CB-CG1 4.34Å; F1398-I1580 HydrophobicContact CE1-CD1 4.08Å; F1398-I1580 HydrophobicContact CE2-CD1 4.39Å; F1398-I1580 HydrophobicContact CZ-CD1 3.67Å; F1398-I1580 HydrophobicContact CZ-CG1 4.22Å; I1407-I1580 HydrophobicContact CD1-CD1 4.04Å; L1427-I1580 HydrophobicContact CD2-CG2 3.92Å; F1497-I1580 HydrophobicContact CE2-CG2 3.97Å; F1497-I1580 HydrophobicContact CZ-CB 4.11Å; F1497-I1580 HydrophobicContact CZ-CG2 3.82Å; K1576-I1580 WeakPolarHBondContact O-CG1 3.39Å; K1576-I1580 PolarHBondContact O-N 3.41Å; I1580-A1584 VanDerWaalsContact O-CB 3.23Å; I1580-A1584 WeakPolarHBondContact O-CB 3.07Å; I1580-A1584 PolarHBondContact O-N 3.42Å
1581	M	72.9	Confident	64.1	Low	5 Å²	5	25.6 Å²	25.6	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-69.6	-48.4	178.6	-178.2	54.1	68.7	0	0	112.6	W1423 F1497 V1562 I1564 S1577 M1578 S1579 N1583 A1584 M1585	W1423-M1581 HydrophobicContact CE3-SD 4.45Å; W1423-M1581 HydrophobicContact CZ3-CE 4.43Å; W1423-M1581 HydrophobicContact CZ3-SD 4.34Å; F1497-M1581 HydrophobicContact CB-CE 3.76Å; F1497-M1581 HydrophobicContact CD1-CB 4.29Å; F1497-M1581 HydrophobicContact CD1-CE 3.23Å; F1497-M1581 HydrophobicContact CD2-CE 4.3Å; F1497-M1581 HydrophobicContact CE1-CB 3.75Å; F1497-M1581 HydrophobicContact CE1-CE 3.84Å; F1497-M1581 HydrophobicContact CG-CE 3.48Å; F1497-M1581 VanDerWaalsContact CG-CE 3.48Å; F1497-M1581 HydrophobicContact CZ-CB 4.39Å; V1562-M1581 HydrophobicContact CG1-CE 3.64Å; V1562-M1581 HydrophobicContact CG1-CG 4.4Å; V1562-M1581 HydrophobicContact CG1-SD 4.08Å; I1564-M1581 HydrophobicContact CD1-CB 4.18Å; I1564-M1581 HydrophobicContact CD1-CG 4.26Å; I1564-M1581 HydrophobicContact CG1-CG 4.48Å; S1577-M1581 PolarHBondContact O-N 3.24Å; S1577-M1581 VanDerWaalsContact O-N 3.11Å; M1578-M1581 PolarHBondContact O-N 3.48Å; S1579-M1581 VanDerWaalsContact C-N 3.34Å; S1579-M1581 PolarHBondContact O-N 3.26Å; M1581-N1583 VanDerWaalsContact C-N 3.35Å; M1581-N1583 PolarHBondContact O-N 2.79Å; M1581-A1584 CarbonylContact O-C 3.56Å; M1581-A1584 PolarHBondContact O-N 3.06Å; M1581-M1585 HydrophobicContact CG-CE 3.89Å; M1581-M1585 HydrophobicContact CG-CG 4.47Å; M1581-M1585 HydrophobicContact CG-SD 4.44Å; M1581-M1585 WeakPolarHBondContact O-CG 3.44Å; M1581-M1585 PolarHBondContact O-N 2.75Å; M1581-M1585 HydrophobicContact SD-CE 3.75Å; M1581-M1585 HydrophobicContact SD-CG 4.11Å
1582	N	71.9	Confident	63.8	Low	3 Å²	3	32.3 Å²	32.3	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-66.4	-36.7	-176.9	-68.6	-20.1	0	0	0	111.6	D651 R667 M1578 M1585 L1586	D651-N1582 HydrophobicContact CB-CB 4.44Å; D651-N1582 WeakPolarHBondContact CB-ND2 3.25Å; D651-N1582 VanDerWaalsContact CG-ND2 3.3Å; D651-N1582 PolarHBondContact OD2-ND2 3.09Å; R667-N1582 WeakPolarHBondContact CD-OD1 3.2Å; R667-N1582 PolarHBondContact NH1-ND2 2.84Å; R667-N1582 PolarHBondContact NH1-OD1 3.39Å; M1578-N1582 WeakPolarHBondContact O-CB 3.47Å; M1578-N1582 VanDerWaalsContact O-CG 3.3Å; M1578-N1582 PolarHBondContact O-N 3.26Å; M1578-N1582 PolarHBondContact O-ND2 3.11Å; N1582-M1585 WeakPolarHBondContact O-CB 3.47Å; N1582-M1585 PolarHBondContact O-N 3.21Å; N1582-L1586 WeakPolarHBondContact O-CG 3.38Å; N1582-L1586 PolarHBondContact O-N 3.39Å
1583	N	69.1	Low	63.2	Low	5 Å²	5	37.5 Å²	37.5	3%	0.027	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-40.6	170.6	-79.8	-56.9	0	0	0	113.2	Y1426 S1579 M1581 M1585 L1586 Y1587 V1598	Y1426-N1583 HydrophobicContact CE1-CB 3.91Å; Y1426-N1583 WeakPolarHBondContact OH-CB 3.48Å; S1579-N1583 VanDerWaalsContact O-CB 3.25Å; S1579-N1583 WeakPolarHBondContact O-CB 3.46Å; S1579-N1583 PolarHBondContact O-N 3.13Å; S1579-N1583 PolarHBondContact O-ND2 3.42Å; S1579-N1583 PolarHBondContact OG-ND2 3.48Å; M1581-N1583 VanDerWaalsContact C-N 3.35Å; M1581-N1583 PolarHBondContact O-N 2.79Å; N1583-M1585 VanDerWaalsContact C-N 3.27Å; N1583-M1585 PolarHBondContact O-N 3.16Å; N1583-L1586 PolarHBondContact O-N 3.44Å; N1583-Y1587 PolarHBondContact O-N 3.02Å; N1583-V1598 PolarHBondContact ND2-O 2.84Å; N1583-V1598 PolarHBondContact OD1-N 2.95Å; N1583-V1598 PolarHBondContact OD1-O 3.26Å
1584	A	68	Low	62.5	Low	4 Å²	4	41.6 Å²	41.6	3%	0.033	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-35.6	173.1	0	0	0	0	0	111.9	W1423 Y1426 I1580 M1581	W1423-A1584 HydrophobicContact CB-CB 4.17Å; W1423-A1584 HydrophobicContact CG-CB 4.26Å; Y1426-A1584 HydrophobicContact CD1-CB 3.82Å; Y1426-A1584 HydrophobicContact CE1-CB 4.42Å; I1580-A1584 VanDerWaalsContact O-CB 3.23Å; I1580-A1584 WeakPolarHBondContact O-CB 3.07Å; I1580-A1584 PolarHBondContact O-N 3.42Å; M1581-A1584 CarbonylContact O-C 3.56Å; M1581-A1584 PolarHBondContact O-N 3.06Å
1585	M	69	Low	61.6	Low	2 Å²	2	44.4 Å²	44.4	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-46.1	172.1	-73.1	-173.8	176.5	0	0	111.4	M655 R660 I665 R667 W1423 V1562 M1581 N1582 N1583 Y1587	M655-M1585 HydrophobicContact SD-CB 3.94Å; M655-M1585 HydrophobicContact SD-SD 4.37Å; R660-M1585 PolarHBondContact NH1-O 2.97Å; R660-M1585 PolarHBondContact NH2-O 2.97Å; I665-M1585 HydrophobicContact CB-CE 4.42Å; I665-M1585 HydrophobicContact CD1-CE 4.33Å; I665-M1585 HydrophobicContact CG2-CE 3.81Å; R667-M1585 HydrophobicContact CG-CE 4.17Å; W1423-M1585 HydrophobicContact CH2-CE 4.45Å; W1423-M1585 HydrophobicContact CZ2-CE 4.35Å; W1423-M1585 HydrophobicContact CZ2-CG 4.24Å; V1562-M1585 HydrophobicContact CB-CE 4.4Å; V1562-M1585 HydrophobicContact CG2-CE 4.08Å; M1581-M1585 HydrophobicContact CG-CE 3.89Å; M1581-M1585 HydrophobicContact CG-CG 4.47Å; M1581-M1585 HydrophobicContact CG-SD 4.44Å; M1581-M1585 WeakPolarHBondContact O-CG 3.44Å; M1581-M1585 PolarHBondContact O-N 2.75Å; M1581-M1585 HydrophobicContact SD-CE 3.75Å; M1581-M1585 HydrophobicContact SD-CG 4.11Å; N1582-M1585 WeakPolarHBondContact O-CB 3.47Å; N1582-M1585 PolarHBondContact O-N 3.21Å; N1583-M1585 VanDerWaalsContact C-N 3.27Å; N1583-M1585 PolarHBondContact O-N 3.16Å; M1585-Y1587 PolarHBondContact O-N 3.11Å
1586	L	65.8	Low	61	Low	18 Å²	18	46.6 Å²	46.6	9%	0.094	27%	0.269	C	S	.	.	H	α-helix	trans	-61.6	-25.7	-179.6	-79.6	157.8	0	0	0	114.5	M655 H658 N1582 N1583 T1588 V1598	M655-L1586 HydrophobicContact CB-CD2 4.42Å; M655-L1586 HydrophobicContact CG-CD2 3.68Å; M655-L1586 HydrophobicContact CG-CG 3.89Å; H658-L1586 HydrophobicContact CB-CD2 4.41Å; N1582-L1586 WeakPolarHBondContact O-CG 3.38Å; N1582-L1586 PolarHBondContact O-N 3.39Å; N1583-L1586 PolarHBondContact O-N 3.44Å; L1586-T1588 PolarHBondContact O-N 3.45Å; L1586-V1598 HydrophobicContact CD1-CB 4.15Å; L1586-V1598 HydrophobicContact CD1-CG2 3.38Å
1587	Y	64.6	Low	60.4	Low	52 Å²	52	46.7 Å²	46.7	20%	0.204	27%	0.273	C	S	.	.			trans	-62.9	118.5	-177.4	-172.9	-110.1	0	0	0	113.3	K1425 Y1426 Q1429 N1583 M1585	K1425-Y1587 HydrophobicContact CB-CE1 3.99Å; Y1426-Y1587 AromaticContact CD2-CD2 3.62Å; Y1426-Y1587 HydrophobicContact CD2-CD2 3.62Å; Y1426-Y1587 HydrophobicContact CD2-CE2 4.35Å; Y1426-Y1587 AromaticContact CD2-CG 3.75Å; Y1426-Y1587 HydrophobicContact CD2-CG 3.75Å; Y1426-Y1587 HydrophobicContact CG-CD2 4.37Å; Y1426-Y1587 HydrophobicContact CG-CG 4.07Å; Q1429-Y1587 PolarHBondContact OE1-OH 3.21Å; Q1429-Y1587 VanDerWaalsContact OE1-OH 3.04Å; N1583-Y1587 PolarHBondContact O-N 3.02Å; M1585-Y1587 PolarHBondContact O-N 3.11Å
1588	T	57.7	Low	59.6	Low	57 Å²	57	46.7 Å²	46.7	35%	0.35	27%	0.273	S	S	.	.			trans	-118.4	129.5	175.2	48.7	0	0	0	0	110.7	L1586 S1590	L1586-T1588 PolarHBondContact O-N 3.45Å; T1588-S1590 VanDerWaalsContact C-N 3.25Å; T1588-S1590 PolarHBondContact O-N 2.86Å
1589	P	53.1	Low	58.8	Low	72 Å²	72	49.3 Å²	49.3	47%	0.468	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	7.3	-171.1	35.2	-40	0	0	0	114.7
1590	S	52.5	Low	58	Low	107 Å²	107	49.3 Å²	49.3	75%	0.748	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	4.1	-164.7	46.8	0	0	0	0	115.6	T1588	T1588-S1590 VanDerWaalsContact C-N 3.25Å; T1588-S1590 PolarHBondContact O-N 2.86Å
1591	S	46.4	Very low	57	Low	61 Å²	61	53.9 Å²	53.9	43%	0.427	30%	0.302	S	S	.	.	S	Bend	trans	-145.4	148.5	173.8	66	0	0	0	0	112	Q1593	S1591-Q1593 PolarHBondContact O-N 3.43Å
1592	N	45.1	Very low	55.8	Low	180 Å²	180	53.9 Å²	53.9	96%	0.963	30%	0.302	S	S	*	.	S	Bend	trans	-71.8	19.4	176.3	-88.6	-16.6	0	0	0	113.6	S1594	N1592-S1594 PolarHBondContact O-N 3.42Å
1593	Q	43	Very low	54.3	Low	137 Å²	137	58 Å²	58	64%	0.64	32%	0.321	S	S	*	.			trans	-92.7	102.1	-178.4	-71.4	179.8	-24.6	0	0	110.2	S1591 T1595	S1591-Q1593 PolarHBondContact O-N 3.43Å; Q1593-T1595 PolarHBondContact O-N 3.11Å
1594	S	48	Very low	53.2	Low	93 Å²	93	60.7 Å²	60.7	65%	0.65	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	29.5	-175.5	59.3	0	0	0	0	114.3	N1592	N1592-S1594 PolarHBondContact O-N 3.42Å
1595	T	51.7	Low	51.8	Low	64 Å²	64	62.7 Å²	62.7	39%	0.393	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	-2.1	-155.5	52.5	0	0	0	0	116.2	S608 Q1593 V1597	S608-T1595 CarbonylContact C-O 3.43Å; S608-T1595 WeakPolarHBondContact CB-O 3.5Å; S608-T1595 VanDerWaalsContact O-O 3.1Å; S608-T1595 PolarHBondContact OG-O 2.78Å; Q1593-T1595 PolarHBondContact O-N 3.11Å; T1595-V1597 PolarHBondContact O-N 3.04Å
1596	N	53.1	Low	50.4	Low	52 Å²	52	64.2 Å²	64.2	28%	0.278	37%	0.367	S	S	.	.			trans	-81.8	98.4	176.5	-70.4	12.3	0	0	0	110.5	S608	S608-N1596 VanDerWaalsContact CB-OD1 3.27Å; S608-N1596 WeakPolarHBondContact CB-OD1 3.29Å; S608-N1596 VanDerWaalsContact O-CA 3.3Å; S608-N1596 WeakPolarHBondContact O-CA 3.24Å
1597	V	53.2	Low	48.9	Very low	45 Å²	45	69.9 Å²	69.9	27%	0.273	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	140.2	-179.7	-179.6	0	0	0	0	108.7	S608 L609 W610 T1595	S608-V1597 PolarHBondContact O-N 3.25Å; S608-V1597 VanDerWaalsContact O-N 3.12Å; L609-V1597 WeakPolarHBondContact CA-O 3.37Å; L609-V1597 HydrophobicContact CD1-CB 4.15Å; L609-V1597 HydrophobicContact CD1-CG1 4.41Å; L609-V1597 WeakPolarHBondContact CD1-O 3.01Å; W610-V1597 PolarHBondContact N-O 2.81Å; T1595-V1597 PolarHBondContact O-N 3.04Å
1598	V	54.2	Low	47.2	Very low	4 Å²	4	72.4 Å²	72.4	2%	0.024	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.1	169.2	177.1	0	0	0	0	107.3	W610 Y612 I654 N1583 L1586 I1600	W610-V1598 HydrophobicContact CB-CG2 4.24Å; Y612-V1598 HydrophobicContact CD1-CG1 4.35Å; Y612-V1598 HydrophobicContact CE1-CG1 3.67Å; I654-V1598 HydrophobicContact CG2-CG2 3.92Å; N1583-V1598 PolarHBondContact ND2-O 2.84Å; N1583-V1598 PolarHBondContact OD1-N 2.95Å; N1583-V1598 PolarHBondContact OD1-O 3.26Å; L1586-V1598 HydrophobicContact CD1-CB 4.15Å; L1586-V1598 HydrophobicContact CD1-CG2 3.38Å; V1598-I1600 HydrophobicContact CG1-CD1 4.21Å; V1598-I1600 HydrophobicContact CG1-CG1 3.93Å
1599	E	54.7	Low	45.7	Very low	59 Å²	59	74 Å²	74	28%	0.276	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	120.2	-179.7	-167.3	156.3	-135.3	0	0	109.2	L609 W610 E611	L609-E1599 HydrophobicContact CD1-CB 4.11Å; W610-E1599 PolarHBondContact O-N 3.25Å; E611-E1599 WeakPolarHBondContact CA-O 3.31Å; E611-E1599 HydrophobicContact CG-CB 4.42Å
1600	I	53.8	Low	44.4	Very low	9 Å²	9	75.9 Å²	75.9	5%	0.046	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122	-164	-62.3	168.9	0	0	0	109.2	Y612 V1598	Y612-I1600 HydrophobicContact CE1-CD1 4.42Å; Y612-I1600 HydrophobicContact CE1-CG1 4.02Å; Y612-I1600 HydrophobicContact CE2-CG1 4.42Å; Y612-I1600 HydrophobicContact CE2-CG2 4.22Å; Y612-I1600 WeakPolarHBondContact OH-CD1 3.41Å; V1598-I1600 HydrophobicContact CG1-CD1 4.21Å; V1598-I1600 HydrophobicContact CG1-CG1 3.93Å
1601	R	49.2	Very low	43.1	Very low	103 Å²	103	75.9 Å²	75.9	39%	0.389	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	85.6	175.8	-72.5	-179.9	179	-114.2	-14.4	109.8	E611 Y612 T613 H1603	E611-R1601 IonicContact OE2-CZ 2.76Å; E611-R1601 IonicContact OE2-NE 2.68Å; E611-R1601 PolarHBondContact OE2-NE 3.42Å; E611-R1601 IonicContact OE2-NH2 3.13Å; Y612-R1601 PolarHBondContact O-N 3.43Å; Y612-R1601 VanDerWaalsContact O-N 3.12Å; T613-R1601 VanDerWaalsContact CA-O 3.23Å; T613-R1601 WeakPolarHBondContact CA-O 3.29Å; T613-R1601 WeakPolarHBondContact CB-O 3.31Å; T613-R1601 HydrophobicContact CG2-CB 4.01Å; T613-R1601 WeakPolarHBondContact CG2-O 3.21Å; R1601-H1603 PolarHBondContact O-N 3.33Å
1602	S	47	Very low	42	Very low	5 Å²	5	77.8 Å²	77.8	4%	0.035	41%	0.413	C	S	.	.			trans	-78.2	99.3	174.5	56.9	0	0	0	0	111	Y643 M1395	Y643-S1602 WeakPolarHBondContact OH-CB 3.3Å; M1395-S1602 WeakPolarHBondContact CE-OG 3.18Å; M1395-S1602 PolarHBondContact SD-OG 3.03Å
1603	H	42.1	Very low	41.1	Very low	89 Å²	89	74.1 Å²	74.1	41%	0.412	39%	0.389	S	S	.	.			trans	-82.4	114.1	165	-79.6	-86	0	0	0	109.4	N615 R1601 G1605	N615-H1603 PolarHBondContact OD1-O 3.14Å; R1601-H1603 PolarHBondContact O-N 3.33Å; H1603-G1605 VanDerWaalsContact C-N 3.34Å; H1603-G1605 PolarHBondContact O-N 3.45Å
1604	L	44.3	Very low	40.1	Very low	61 Å²	61	70 Å²	70	32%	0.319	37%	0.368	S	S	.	.			trans	-85.9	82.3	161.2	-78.8	86.1	0	0	0	107.4	L621 M1395 S1606	L621-L1604 HydrophobicContact CD1-CD2 3.88Å; L621-L1604 HydrophobicContact CD1-CG 4.16Å; M1395-L1604 HydrophobicContact CE-CD1 4.43Å; L1604-S1606 PolarHBondContact O-N 3.46Å; L1604-S1606 VanDerWaalsContact O-N 3.09Å
1605	G	39.1	Very low	39	Very low	46 Å²	46	66.8 Å²	66.8	47%	0.474	34%	0.343	S	S	.	.			trans	-69.1	102.9	174.4	0	0	0	0	0	110.3	H1603	H1603-G1605 VanDerWaalsContact C-N 3.34Å; H1603-G1605 PolarHBondContact O-N 3.45Å
1606	S	38.9	Very low	37.8	Very low	34 Å²	34	68.9 Å²	68.9	24%	0.238	34%	0.344	C	S	.	.			trans	-76.2	133.9	178.5	90.2	0	0	0	0	110.7	D1390 L1604	D1390-S1606 PolarHBondContact OD1-OG 2.84Å; L1604-S1606 PolarHBondContact O-N 3.46Å; L1604-S1606 VanDerWaalsContact O-N 3.09Å
1607	L	35.2	Very low	36.5	Very low	138 Å²	138	71.2 Å²	71.2	72%	0.723	35%	0.349	S	S	*	.			trans	-117.7	53.8	-176.7	-107.2	164.5	0	0	0	109.9	I585 D618	I585-L1607 HydrophobicContact CD1-CD1 4.43Å; D618-L1607 PolarHBondContact OD1-N 2.71Å; D618-L1607 PolarHBondContact OD2-N 3.06Å; D618-L1607 VanDerWaalsContact OD2-N 3.14Å
1608	K	30	Very low	35.2	Very low	104 Å²	104	70.6 Å²	70.6	45%	0.452	34%	0.344	S	S	.	.			trans	-131.9	105.2	-173.6	-83.4	167	-171.8	154.6	0	114.6	D618 D622	D618-K1608 PolarHBondContact O-NZ 2.88Å; D618-K1608 WeakPolarHBondContact OD2-CD 3.36Å; D618-K1608 WeakPolarHBondContact OD2-CE 3.35Å; D618-K1608 VanDerWaalsContact OD2-CG 3.27Å; D618-K1608 WeakPolarHBondContact OD2-CG 3.06Å; D618-K1608 IonicContact OD2-NZ 2.87Å; D618-K1608 PolarHBondContact OD2-NZ 3.05Å; D622-K1608 IonicContact OD1-NZ 3.86Å
1609	T	25.8	Very low	34	Very low	92 Å²	92	74.3 Å²	74.3	56%	0.564	37%	0.367	S	S	*	.			trans	-74.5	116	168.7	42.8	0	0	0	0	113	D1716	T1609-D1716 WeakPolarHBondContact CB-OD1 3.14Å; T1609-D1716 HydrophobicContact CG2-CB 4.46Å
1610	F	25.6	Very low	32.7	Very low	111 Å²	111	77.9 Å²	77.9	49%	0.487	38%	0.384	S	S	.	.				37.6	151.4	124.4	-94.2	-122.8	0	0	0	121.5	D1716	F1610-D1716 WeakPolarHBondContact CB-OD1 3.5Å
1611	Q	25.3	Very low	31.4	Very low	106 Å²	106	81 Å²	81	50%	0.495	40%	0.4	S	S	.	.			cis	-168.4	-179.4	-22.3	-124.1	-159.3	23.1	0	0	110.9	P1712	Q1611-P1712 HydrophobicContact CB-CG 4.43Å
1612	L	23.8	Very low	30.6	Very low	102 Å²	102	79.5 Å²	79.5	53%	0.534	40%	0.397	S	S	.	.			trans	-105.5	152.5	-172.5	-142.5	83.7	0	0	0	114.7
1613	H	25.1	Very low	29.8	Very low	102 Å²	102	87.1 Å²	87.1	47%	0.472	43%	0.43	S	S	.	.			trans	85.7	101.9	145.6	-95.8	47.7	0	0	0	124.2
1614	R	22.8	Very low	29.5	Very low	52 Å²	52	93.5 Å²	93.5	20%	0.196	45%	0.452	C	S	.	.				65.6	117.4	105.3	-90.5	172.3	151.8	143.7	18.4	124.3	G1669 A1670 F1672 G1673	R1614-G1669 VanDerWaalsContact CZ-O 3.24Å; R1614-G1669 PolarHBondContact NE-O 3Å; R1614-G1669 PolarHBondContact NH2-O 3.27Å; R1614-G1669 VanDerWaalsContact NH2-O 3.09Å; R1614-A1670 VanDerWaalsContact CZ-CA 3.5Å; R1614-A1670 PolarHBondContact NH2-O 3.16Å; R1614-F1672 HydrophobicContact CG-CD1 3.97Å; R1614-G1673 VanDerWaalsContact NE-CA 3.29Å; R1614-G1673 PolarHBondContact NH1-O 2.91Å
1615	M	25.1	Very low	29	Very low	25 Å²	25	94.7 Å²	94.7	12%	0.123	46%	0.462	C	S	.	.				88.6	138.8	115.8	-89.3	-84	-179.6	0	0	124.3	Q1668 G1669 F1672 L1702 A1705	M1615-Q1668 WeakPolarHBondContact CE-O 3.23Å; M1615-G1669 VanDerWaalsContact SD-CA 3.55Å; M1615-F1672 HydrophobicContact CE-CB 3.27Å; M1615-F1672 HydrophobicContact CE-CD1 4.32Å; M1615-F1672 HydrophobicContact CE-CG 4Å; M1615-F1672 HydrophobicContact CG-CB 4.24Å; M1615-F1672 HydrophobicContact CG-CD1 4.11Å; M1615-L1702 HydrophobicContact CE-CD1 3.38Å; M1615-L1702 HydrophobicContact CE-CD2 4.2Å; M1615-L1702 HydrophobicContact CE-CG 3.71Å; M1615-L1702 HydrophobicContact SD-CD1 4.35Å; M1615-A1705 VanDerWaalsContact N-CB 3.31Å
1616	Y	25.7	Very low	29.1	Very low	108 Å²	108	101.2 Å²	101.2	42%	0.424	48%	0.48	S	S	.	.				174.9	152.4	128.2	-107.3	-61.8	0	0	0	119.7	M1665 Y1701	Y1616-M1665 HydrophobicContact CD1-CG 4.13Å; Y1616-M1665 HydrophobicContact CD1-SD 3.94Å; Y1616-M1665 HydrophobicContact CE1-CG 4.4Å; Y1616-M1665 HydrophobicContact CE1-SD 4.04Å; Y1616-Y1701 CarbonylContact C-O 3.56Å
1617	R	26.4	Very low	29.2	Very low	101 Å²	101	101.4 Å²	101.4	38%	0.381	49%	0.487	S	S	.	.			trans	103.3	90.9	130.5	-87.5	158.4	-167.6	-105.4	1.4	125.7	M1665 Y1701	R1617-M1665 HydrophobicContact CB-CE 4.07Å; R1617-M1665 HydrophobicContact CB-SD 4.23Å; R1617-M1665 HydrophobicContact CG-CE 3.7Å; R1617-M1665 HydrophobicContact CG-SD 3.57Å; R1617-M1665 VanDerWaalsContact CG-SD 3.57Å; R1617-Y1701 VanDerWaalsContact C-CG 3.5Å; R1617-Y1701 WeakPolarHBondContact O-CB 3.43Å; R1617-Y1701 WeakPolarHBondContact O-CD1 3.17Å; R1617-Y1701 WeakPolarHBondContact O-CE1 3.35Å
1618	L	25.3	Very low	29.6	Very low	32 Å²	32	97.9 Å²	97.9	17%	0.168	47%	0.469	C	S	.	.			trans	-45.9	160.4	162.3	-59.3	141.1	0	0	0	119.3	I1661 I1664 M1665	L1618-I1661 HydrophobicContact CB-CG2 4.4Å; L1618-I1661 HydrophobicContact CD1-CB 4.27Å; L1618-I1661 HydrophobicContact CD1-CG2 3.58Å; L1618-I1661 WeakPolarHBondContact CD1-O 3.19Å; L1618-I1664 HydrophobicContact CD1-CB 4.33Å; L1618-I1664 HydrophobicContact CD2-CG2 4.15Å; L1618-M1665 HydrophobicContact CB-CE 3.73Å; L1618-M1665 HydrophobicContact CB-CG 4.3Å; L1618-M1665 HydrophobicContact CD1-CB 3.5Å; L1618-M1665 VanDerWaalsContact CD1-CB 3.5Å; L1618-M1665 HydrophobicContact CD1-CE 4.13Å; L1618-M1665 HydrophobicContact CD1-CG 3.56Å; L1618-M1665 HydrophobicContact CD1-SD 4.47Å; L1618-M1665 HydrophobicContact CG-CB 4.29Å; L1618-M1665 HydrophobicContact CG-CE 4.35Å; L1618-M1665 HydrophobicContact CG-CG 3.91Å; L1618-M1665 VanDerWaalsContact N-CE 3.35Å
1619	V	29.6	Very low	30.3	Very low	81 Å²	81	95.6 Å²	95.6	49%	0.491	47%	0.466	S	S	.	.			trans	-129.3	124.4	150	176.9	0	0	0	0	111.2	Y1701	V1619-Y1701 VanDerWaalsContact CB-OH 3.28Å; V1619-Y1701 WeakPolarHBondContact CB-OH 3.48Å; V1619-Y1701 HydrophobicContact CG2-CE1 4.09Å; V1619-Y1701 WeakPolarHBondContact CG2-OH 3.24Å
1620	E	26.4	Very low	31.2	Very low	135 Å²	135	94.1 Å²	94.1	63%	0.631	45%	0.454	S	S	*	.			trans	-157.4	20.1	167.2	-131	-166.7	164.8	0	0	118.8	I1661	E1620-I1661 HydrophobicContact CB-CD1 3.9Å
1621	L	27.2	Very low	32.1	Very low	75 Å²	75	96.6 Å²	96.6	39%	0.393	46%	0.46	S	S	.	.			trans	-114.2	19.2	-161.8	-92.7	163	0	0	0	120.1	K1657 I1661	L1621-K1657 VanDerWaalsContact CD1-C 3.48Å; L1621-K1657 WeakPolarHBondContact CD2-O 3.34Å; L1621-I1661 HydrophobicContact CD1-CB 4.35Å; L1621-I1661 HydrophobicContact CD1-CD1 3.73Å; L1621-I1661 HydrophobicContact CD1-CG2 4.12Å; L1621-I1661 HydrophobicContact CD2-CD1 4.28Å; L1621-I1661 HydrophobicContact CG-CD1 3.6Å
1622	E	31.9	Very low	33.3	Very low	70 Å²	70	95.5 Å²	95.5	33%	0.327	45%	0.452	S	S	.	.			trans	-104.4	10	-178.6	-77.3	-169.2	-160.8	0	0	116.8	R1350 Y1624 V1640 K1655	R1350-E1622 IonicContact CZ-OE1 3.16Å; R1350-E1622 IonicContact CZ-OE2 3.87Å; R1350-E1622 IonicContact NH1-OE1 3.45Å; R1350-E1622 IonicContact NH1-OE2 3.35Å; R1350-E1622 IonicContact NH2-OE1 2.74Å; R1350-E1622 IonicContact NH2-OE2 2.63Å; R1350-E1622 PolarHBondContact NH2-OE2 3.28Å; E1622-Y1624 VanDerWaalsContact C-N 3.34Å; E1622-Y1624 PolarHBondContact O-N 2.88Å; E1622-V1640 WeakPolarHBondContact OE2-CG1 3.4Å; E1622-K1655 WeakPolarHBondContact OE1-CE 3.49Å; E1622-K1655 IonicContact OE1-NZ 2.65Å; E1622-K1655 PolarHBondContact OE1-NZ 3.36Å
1623	K	31	Very low	34.5	Very low	165 Å²	165	92.2 Å²	92.2	72%	0.717	44%	0.44	S	S	*	.			trans	-76.6	2.8	-175.5	-83.8	177.3	179.4	163.8	0	117.4
1624	Y	35.3	Very low	35.6	Very low	223 Å²	223	89.6 Å²	89.6	88%	0.875	44%	0.436	S	S	*	.			trans	-111.8	31.7	-171	-91.9	-76.4	0	0	0	116.8	E1622	E1622-Y1624 VanDerWaalsContact C-N 3.34Å; E1622-Y1624 PolarHBondContact O-N 2.88Å
1625	T	34.2	Very low	37.1	Very low	87 Å²	87	88.5 Å²	88.5	53%	0.534	44%	0.435	S	S	.	.			trans	-122.4	85.8	172.2	53.3	0	0	0	0	112.9	G1627	T1625-G1627 PolarHBondContact O-N 3.31Å
1626	E	39.8	Very low	38.5	Very low	182 Å²	182	89.5 Å²	89.5	85%	0.85	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-66.3	-3.4	-170.6	-61.4	-169	132.8	0	0	116.2	S1629	E1626-S1629 PolarHBondContact O-OG 2.83Å
1627	G	41	Very low	39.7	Very low	38 Å²	38	84.6 Å²	84.6	39%	0.392	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-81.9	-18.2	-172.5	0	0	0	0	0	117.1	T1625	T1625-G1627 PolarHBondContact O-N 3.31Å
1628	I	44.1	Very low	41.1	Very low	65 Å²	65	83 Å²	83	33%	0.333	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-101.2	8.9	-168.8	-53	175.4	0	0	0	112.3	L1630 F1636	I1628-L1630 PolarHBondContact O-N 2.97Å; I1628-F1636 HydrophobicContact CB-CE2 4.49Å; I1628-F1636 HydrophobicContact CD1-CE2 3.72Å; I1628-F1636 HydrophobicContact CD1-CZ 4.25Å; I1628-F1636 HydrophobicContact CG2-CD2 3.82Å; I1628-F1636 HydrophobicContact CG2-CE2 3.95Å
1629	S	44.6	Very low	42.5	Very low	56 Å²	56	81.5 Å²	81.5	39%	0.392	41%	0.414	S	S	.	.			trans	-66.3	101.6	-177.4	48	0	0	0	0	113.6	E1626 R1847	E1626-S1629 PolarHBondContact O-OG 2.83Å; S1629-R1847 PolarHBondContact O-NH2 3.02Å; S1629-R1847 PolarHBondContact OG-NE 3.12Å; S1629-R1847 VanDerWaalsContact OG-NE 3.17Å; S1629-R1847 PolarHBondContact OG-NH2 3.43Å
1630	L	44.2	Very low	43.6	Very low	61 Å²	61	79 Å²	79	32%	0.319	40%	0.398	S	S	.	.	S	Bend		167.1	-42.5	121.4	-93.5	157.2	0	0	0	114.2	I1628 Q1761 R1847	I1628-L1630 PolarHBondContact O-N 2.97Å; L1630-Q1761 VanDerWaalsContact CD2-NE2 3.32Å; L1630-R1847 HydrophobicContact CD1-CG 3.48Å; L1630-R1847 VanDerWaalsContact CD1-CG 3.48Å; L1630-R1847 HydrophobicContact CG-CG 4.44Å
1631	R	44.5	Very low	44.8	Very low	163 Å²	163	73.6 Å²	73.6	62%	0.615	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-28.8	-154.3	-69.3	-174	178.6	170.7	2.6	116.3	F1873	R1631-F1873 PolarHBondContact NH2-O 3.04Å; R1631-F1873 VanDerWaalsContact NH2-O 3.13Å
1632	Y	52	Low	46.1	Very low	83 Å²	83	73.8 Å²	73.8	33%	0.325	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.1	70.5	177	-60.2	-85	0	0	0	111.2	A1634 V1635 F1636	Y1632-A1634 PolarHBondContact O-N 3.09Å; Y1632-V1635 HydrophobicContact CD1-CG2 3.81Å; Y1632-V1635 HydrophobicContact CG-CB 4.33Å; Y1632-V1635 HydrophobicContact CG-CG2 4.04Å; Y1632-V1635 PolarHBondContact O-N 2.79Å; Y1632-F1636 VanDerWaalsContact O-CB 3.31Å; Y1632-F1636 WeakPolarHBondContact O-CB 3.49Å; Y1632-F1636 PolarHBondContact O-N 2.85Å
1633	A	48.8	Very low	46.8	Very low	33 Å²	33	71.7 Å²	71.7	27%	0.273	37%	0.369	S	S	.	.	H	α-helix	trans	-57.8	-36.1	174	0	0	0	0	0	111.8	A1637	A1633-A1637 VanDerWaalsContact O-CB 3.29Å; A1633-A1637 WeakPolarHBondContact O-CB 3.33Å; A1633-A1637 PolarHBondContact O-N 3.04Å
1634	A	48.6	Very low	47.7	Very low	47 Å²	47	66.3 Å²	66.3	39%	0.388	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-52.9	173.2	0	0	0	0	0	112.5	Y1632 F1636 A1637 V1638	Y1632-A1634 PolarHBondContact O-N 3.09Å; A1634-F1636 VanDerWaalsContact C-N 3.31Å; A1634-F1636 PolarHBondContact O-N 3.25Å; A1634-A1637 PolarHBondContact O-N 2.94Å; A1634-V1638 WeakPolarHBondContact O-CB 3.42Å; A1634-V1638 VanDerWaalsContact O-CG2 3.31Å; A1634-V1638 WeakPolarHBondContact O-CG2 3.27Å; A1634-V1638 PolarHBondContact O-N 3.09Å
1635	V	54	Low	48.3	Very low	29 Å²	29	60.8 Å²	60.8	18%	0.176	34%	0.338	C	S	.	.	H	α-helix	trans	-64.4	-37	177.8	-174.8	0	0	0	0	110.9	P1339 I1343 Y1632 V1638 V1639	P1339-V1635 HydrophobicContact CB-CG2 4.48Å; I1343-V1635 HydrophobicContact CD1-CG1 3.9Å; I1343-V1635 HydrophobicContact CG1-CG1 3.5Å; Y1632-V1635 HydrophobicContact CD1-CG2 3.81Å; Y1632-V1635 HydrophobicContact CG-CB 4.33Å; Y1632-V1635 HydrophobicContact CG-CG2 4.04Å; Y1632-V1635 PolarHBondContact O-N 2.79Å; V1635-V1638 PolarHBondContact O-N 3.41Å; V1635-V1639 HydrophobicContact CG1-CG2 4.02Å; V1635-V1639 VanDerWaalsContact O-CB 3.3Å; V1635-V1639 WeakPolarHBondContact O-CB 3.34Å; V1635-V1639 WeakPolarHBondContact O-CG2 3.34Å; V1635-V1639 PolarHBondContact O-N 3.09Å
1636	F	53.6	Low	48.6	Very low	45 Å²	45	58.9 Å²	58.9	20%	0.197	33%	0.33	C	S	.	.	H	α-helix	trans	-64.1	-44	174.3	-173	-96.7	0	0	0	111.5	I1346 I1628 Y1632 A1634 V1639 V1640	I1346-F1636 HydrophobicContact CD1-CD2 4.38Å; I1628-F1636 HydrophobicContact CB-CE2 4.49Å; I1628-F1636 HydrophobicContact CD1-CE2 3.72Å; I1628-F1636 HydrophobicContact CD1-CZ 4.25Å; I1628-F1636 HydrophobicContact CG2-CD2 3.82Å; I1628-F1636 HydrophobicContact CG2-CE2 3.95Å; Y1632-F1636 VanDerWaalsContact O-CB 3.31Å; Y1632-F1636 WeakPolarHBondContact O-CB 3.49Å; Y1632-F1636 PolarHBondContact O-N 2.85Å; A1634-F1636 VanDerWaalsContact C-N 3.31Å; A1634-F1636 PolarHBondContact O-N 3.25Å; F1636-V1639 PolarHBondContact O-N 2.86Å; F1636-V1640 HydrophobicContact CD1-CG2 3.8Å; F1636-V1640 HydrophobicContact CE1-CG2 3.54Å; F1636-V1640 HydrophobicContact CG-CG2 4.4Å; F1636-V1640 HydrophobicContact CZ-CG2 3.93Å; F1636-V1640 WeakPolarHBondContact O-CB 3.5Å; F1636-V1640 WeakPolarHBondContact O-CG2 3.41Å; F1636-V1640 PolarHBondContact O-N 2.77Å
1637	A	50.9	Low	48.6	Very low	6 Å²	6	52.5 Å²	52.5	5%	0.05	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-46.4	173.9	0	0	0	0	0	111.6	A1633 A1634 V1639 V1640 S1641 A1756	A1633-A1637 VanDerWaalsContact O-CB 3.29Å; A1633-A1637 WeakPolarHBondContact O-CB 3.33Å; A1633-A1637 PolarHBondContact O-N 3.04Å; A1634-A1637 PolarHBondContact O-N 2.94Å; A1637-V1639 PolarHBondContact O-N 3.23Å; A1637-V1640 WeakPolarHBondContact O-CB 3.26Å; A1637-V1640 PolarHBondContact O-N 3.05Å; A1637-S1641 WeakPolarHBondContact O-CB 3.24Å; A1637-S1641 PolarHBondContact O-N 3.01Å; A1637-S1641 PolarHBondContact O-OG 2.04Å; A1637-A1756 HydrophobicContact CB-CB 4Å
1638	V	56.3	Low	48.6	Very low	67 Å²	67	52.7 Å²	52.7	41%	0.406	31%	0.308	S	S	.	.	H	α-helix	trans	-61.7	-39.8	176.1	169.4	0	0	0	0	111.6	A1634 V1635 S1641 I1642	A1634-V1638 WeakPolarHBondContact O-CB 3.42Å; A1634-V1638 VanDerWaalsContact O-CG2 3.31Å; A1634-V1638 WeakPolarHBondContact O-CG2 3.27Å; A1634-V1638 PolarHBondContact O-N 3.09Å; V1635-V1638 PolarHBondContact O-N 3.41Å; V1638-S1641 PolarHBondContact O-N 2.98Å; V1638-I1642 HydrophobicContact CG1-CD1 3.55Å; V1638-I1642 HydrophobicContact CG1-CG1 4.25Å; V1638-I1642 VanDerWaalsContact O-CB 3.31Å; V1638-I1642 WeakPolarHBondContact O-CB 3.34Å; V1638-I1642 WeakPolarHBondContact O-CG1 3.32Å; V1638-I1642 PolarHBondContact O-N 3.48Å
1639	V	55.5	Low	48.2	Very low	1 Å²	1	55.7 Å²	55.7	1%	0.006	33%	0.329	C	S	.	.	H	α-helix	trans	-73.5	-34.8	175.6	173.4	0	0	0	0	112.2	I1343 I1346 V1347 V1635 F1636 A1637 S1641 S1643	I1343-V1639 HydrophobicContact CB-CG2 3.95Å; I1343-V1639 HydrophobicContact CD1-CG2 4.42Å; I1343-V1639 HydrophobicContact CG1-CG2 3.52Å; I1343-V1639 HydrophobicContact CG2-CG2 3.78Å; I1346-V1639 HydrophobicContact CB-CG1 4.04Å; I1346-V1639 HydrophobicContact CG2-CG1 3.57Å; V1347-V1639 HydrophobicContact CG2-CG1 4.09Å; V1635-V1639 HydrophobicContact CG1-CG2 4.02Å; V1635-V1639 VanDerWaalsContact O-CB 3.3Å; V1635-V1639 WeakPolarHBondContact O-CB 3.34Å; V1635-V1639 WeakPolarHBondContact O-CG2 3.34Å; V1635-V1639 PolarHBondContact O-N 3.09Å; F1636-V1639 PolarHBondContact O-N 2.86Å; A1637-V1639 PolarHBondContact O-N 3.23Å; V1639-S1641 VanDerWaalsContact C-N 3.34Å; V1639-S1643 WeakPolarHBondContact O-CB 3.44Å; V1639-S1643 PolarHBondContact O-N 3.21Å; V1639-S1643 PolarHBondContact O-OG 3.5Å
1640	V	52.3	Low	47.5	Very low	27 Å²	27	56.4 Å²	56.4	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-58.5	-52.3	170.3	169.6	0	0	0	0	108.2	E1622 F1636 A1637 S1643 S1644	E1622-V1640 WeakPolarHBondContact OE2-CG1 3.4Å; F1636-V1640 HydrophobicContact CD1-CG2 3.8Å; F1636-V1640 HydrophobicContact CE1-CG2 3.54Å; F1636-V1640 HydrophobicContact CG-CG2 4.4Å; F1636-V1640 HydrophobicContact CZ-CG2 3.93Å; F1636-V1640 WeakPolarHBondContact O-CB 3.5Å; F1636-V1640 WeakPolarHBondContact O-CG2 3.41Å; F1636-V1640 PolarHBondContact O-N 2.77Å; A1637-V1640 WeakPolarHBondContact O-CB 3.26Å; A1637-V1640 PolarHBondContact O-N 3.05Å; V1640-S1643 PolarHBondContact O-N 3.37Å; V1640-S1643 PolarHBondContact O-OG 3.31Å; V1640-S1644 WeakPolarHBondContact O-CB 3.25Å; V1640-S1644 PolarHBondContact O-N 3.39Å; V1640-S1644 PolarHBondContact O-OG 3.42Å
1641	S	51.5	Low	46.8	Very low	22 Å²	22	55.4 Å²	55.4	15%	0.154	34%	0.336	C	S	.	.	H	α-helix	trans	-60.1	-52.6	178	-63.8	0	0	0	0	112.7	A1637 V1638 V1639 S1643 S1644 L1645 V1752	A1637-S1641 WeakPolarHBondContact O-CB 3.24Å; A1637-S1641 PolarHBondContact O-N 3.01Å; A1637-S1641 PolarHBondContact O-OG 2.04Å; V1638-S1641 PolarHBondContact O-N 2.98Å; V1639-S1641 VanDerWaalsContact C-N 3.34Å; S1641-S1643 PolarHBondContact O-N 3.15Å; S1641-S1644 WeakPolarHBondContact CA-OG 3.44Å; S1641-S1644 CarbonylContact O-C 3.6Å; S1641-S1644 PolarHBondContact O-N 3.26Å; S1641-S1644 VanDerWaalsContact O-N 3.14Å; S1641-S1644 PolarHBondContact O-OG 3.04Å; S1641-L1645 WeakPolarHBondContact O-CB 3.29Å; S1641-L1645 WeakPolarHBondContact O-CD1 3.15Å; S1641-L1645 VanDerWaalsContact O-CG 3.3Å; S1641-L1645 WeakPolarHBondContact O-CG 3.41Å; S1641-L1645 PolarHBondContact O-N 2.85Å; S1641-V1752 VanDerWaalsContact OG-CG1 3.26Å; S1641-V1752 WeakPolarHBondContact OG-CG1 3.4Å; S1641-V1752 WeakPolarHBondContact OG-CG2 3.24Å
1642	I	53.5	Low	46	Very low	80 Å²	80	57.3 Å²	57.3	41%	0.41	34%	0.344	S	S	.	.	H	α-helix	trans	-62	-42.7	178.5	-69.4	170.7	0	0	0	110.9	V1638 S1644 L1645 A1646	V1638-I1642 HydrophobicContact CG1-CD1 3.55Å; V1638-I1642 HydrophobicContact CG1-CG1 4.25Å; V1638-I1642 VanDerWaalsContact O-CB 3.31Å; V1638-I1642 WeakPolarHBondContact O-CB 3.34Å; V1638-I1642 WeakPolarHBondContact O-CG1 3.32Å; V1638-I1642 PolarHBondContact O-N 3.48Å; I1642-S1644 VanDerWaalsContact C-N 3.3Å; I1642-S1644 PolarHBondContact O-N 3.04Å; I1642-L1645 PolarHBondContact O-N 3.34Å; I1642-L1645 VanDerWaalsContact O-N 3.12Å; I1642-A1646 VanDerWaalsContact O-CB 3.3Å; I1642-A1646 WeakPolarHBondContact O-CB 3.41Å; I1642-A1646 PolarHBondContact O-N 3.5Å
1643	S	47.8	Very low	44.9	Very low	26 Å²	26	54.6 Å²	54.6	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-71.4	-24.3	176.7	64.1	0	0	0	0	113.2	R1350 V1639 V1640 S1641 G1647	R1350-S1643 WeakPolarHBondContact CD-OG 3.3Å; R1350-S1643 PolarHBondContact NH1-OG 3.03Å; V1639-S1643 WeakPolarHBondContact O-CB 3.44Å; V1639-S1643 PolarHBondContact O-N 3.21Å; V1639-S1643 PolarHBondContact O-OG 3.5Å; V1640-S1643 PolarHBondContact O-N 3.37Å; V1640-S1643 PolarHBondContact O-OG 3.31Å; S1641-S1643 PolarHBondContact O-N 3.15Å; S1643-G1647 PolarHBondContact O-N 3.22Å
1644	S	49.7	Very low	44	Very low	51 Å²	51	55.4 Å²	55.4	36%	0.357	34%	0.34	S	S	.	.	H	α-helix	trans	-84.2	-7.9	167.9	58.8	0	0	0	0	114.7	V1640 S1641 I1642 P1648	V1640-S1644 WeakPolarHBondContact O-CB 3.25Å; V1640-S1644 PolarHBondContact O-N 3.39Å; V1640-S1644 PolarHBondContact O-OG 3.42Å; S1641-S1644 WeakPolarHBondContact CA-OG 3.44Å; S1641-S1644 CarbonylContact O-C 3.6Å; S1641-S1644 PolarHBondContact O-N 3.26Å; S1641-S1644 VanDerWaalsContact O-N 3.14Å; S1641-S1644 PolarHBondContact O-OG 3.04Å; I1642-S1644 VanDerWaalsContact C-N 3.3Å; I1642-S1644 PolarHBondContact O-N 3.04Å; S1644-P1648 VanDerWaalsContact O-CD 3.24Å; S1644-P1648 WeakPolarHBondContact O-CD 3.11Å; S1644-P1648 WeakPolarHBondContact O-CG 3.42Å
1645	L	47.3	Very low	43.3	Very low	108 Å²	108	58.2 Å²	58.2	57%	0.565	34%	0.343	S	S	*	.	H	α-helix	trans	-101.3	-43.3	174.9	-77.7	161.4	0	0	0	111.5	S1641 I1642 V1649	S1641-L1645 WeakPolarHBondContact O-CB 3.29Å; S1641-L1645 WeakPolarHBondContact O-CD1 3.15Å; S1641-L1645 VanDerWaalsContact O-CG 3.3Å; S1641-L1645 WeakPolarHBondContact O-CG 3.41Å; S1641-L1645 PolarHBondContact O-N 2.85Å; I1642-L1645 PolarHBondContact O-N 3.34Å; I1642-L1645 VanDerWaalsContact O-N 3.12Å; L1645-V1649 WeakPolarHBondContact O-CG2 3.28Å
1646	A	40.8	Very low	42.2	Very low	46 Å²	46	60.3 Å²	60.3	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-82.5	-21.7	-177.6	0	0	0	0	0	114.3	I1642	I1642-A1646 VanDerWaalsContact O-CB 3.3Å; I1642-A1646 WeakPolarHBondContact O-CB 3.41Å; I1642-A1646 PolarHBondContact O-N 3.5Å
1647	G	39.7	Very low	40.9	Very low	48 Å²	48	65.2 Å²	65.2	50%	0.495	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-46.2	175.9	0	0	0	0	0	115.3	S1643	S1643-G1647 PolarHBondContact O-N 3.22Å
1648	P	41.4	Very low	39.8	Very low	43 Å²	43	67.4 Å²	67.4	28%	0.279	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.5	-170.6	32.3	-32.6	0	0	0	116.4	S1644 A1650 S1651	S1644-P1648 VanDerWaalsContact O-CD 3.24Å; S1644-P1648 WeakPolarHBondContact O-CD 3.11Å; S1644-P1648 WeakPolarHBondContact O-CG 3.42Å; P1648-A1650 PolarHBondContact O-N 3.13Å; P1648-A1650 VanDerWaalsContact O-N 3.15Å; P1648-S1651 CarbonylContact O-C 3.59Å; P1648-S1651 VanDerWaalsContact O-C 3.23Å; P1648-S1651 PolarHBondContact O-N 2.93Å
1649	V	35.2	Very low	38.4	Very low	128 Å²	128	68 Å²	68	78%	0.776	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.2	178.7	168.5	0	0	0	0	113.3	L1645	L1645-V1649 WeakPolarHBondContact O-CG2 3.28Å
1650	A	30.2	Very low	37	Very low	70 Å²	70	70 Å²	70	58%	0.579	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	8	171	0	0	0	0	0	114.1	F1309 P1648	F1309-A1650 HydrophobicContact CE1-CB 3.56Å; F1309-A1650 HydrophobicContact CZ-CB 3.72Å; P1648-A1650 PolarHBondContact O-N 3.13Å; P1648-A1650 VanDerWaalsContact O-N 3.15Å
1651	S	29.2	Very low	36	Very low	41 Å²	41	69.9 Å²	69.9	29%	0.287	42%	0.418	S	S	.	.	S	Bend	trans	-162.8	84.5	-172.1	168.8	0	0	0	0	110.1	P1648	P1648-S1651 CarbonylContact O-C 3.59Å; P1648-S1651 VanDerWaalsContact O-C 3.23Å; P1648-S1651 PolarHBondContact O-N 2.93Å
1652	W	27.7	Very low	35.2	Very low	203 Å²	203	73.4 Å²	73.4	77%	0.769	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	143.4	179.7	-92.7	37.9	0	0	0	113.5
1653	A	29.5	Very low	34.2	Very low	25 Å²	25	77.1 Å²	77.1	21%	0.207	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	25	154.8	0	0	0	0	0	122.8	M1364 P1368	M1364-A1653 CarbonylContact O-C 3.57Å; P1368-A1653 HydrophobicContact CB-CB 3.52Å; P1368-A1653 HydrophobicContact CG-CB 3.91Å
1654	V	29.6	Very low	33.7	Very low	51 Å²	51	79.7 Å²	79.7	31%	0.309	45%	0.451	S	S	.	.			trans	-88.7	103.9	177	179.4	0	0	0	0	115.6	M1364 V1365	M1364-V1654 HydrophobicContact CB-CB 4.03Å; M1364-V1654 HydrophobicContact CB-CG1 3.69Å; M1364-V1654 HydrophobicContact CB-CG2 3.84Å; M1364-V1654 HydrophobicContact CG-CG1 3.96Å; M1364-V1654 WeakPolarHBondContact O-CG2 3.37Å; M1364-V1654 HydrophobicContact SD-CG1 3.57Å; M1364-V1654 VanDerWaalsContact SD-CG1 3.57Å; V1365-V1654 HydrophobicContact CG2-CG2 3.9Å
1655	K	33.2	Very low	33.2	Very low	106 Å²	106	78.6 Å²	78.6	46%	0.461	44%	0.441	S	S	.	.			trans	-175.5	132.5	141.4	-111.6	167.9	-179.8	175.9	0	114	E1622	E1622-K1655 WeakPolarHBondContact OE1-CE 3.49Å; E1622-K1655 IonicContact OE1-NZ 2.65Å; E1622-K1655 PolarHBondContact OE1-NZ 3.36Å
1656	E	32.1	Very low	33	Very low	73 Å²	73	77.7 Å²	77.7	34%	0.341	44%	0.436	S	S	.	.			trans	-146.5	135.9	-178	-178.9	176.5	-108.3	0	0	111.6	M1364 K1662	M1364-E1656 HydrophobicContact CE-CB 4.17Å; E1656-K1662 WeakPolarHBondContact OE1-CE 3.17Å; E1656-K1662 IonicContact OE1-NZ 2.73Å; E1656-K1662 PolarHBondContact OE1-NZ 2.75Å
1657	K	26.3	Very low	32.9	Very low	148 Å²	148	77.5 Å²	77.5	64%	0.643	43%	0.431	S	S	*	.			trans	167.1	48.1	146.2	-95.2	177	178.5	173.6	0	117.1	L1621	L1621-K1657 VanDerWaalsContact CD1-C 3.48Å; L1621-K1657 WeakPolarHBondContact CD2-O 3.34Å
1658	S	27.9	Very low	33.2	Very low	51 Å²	51	78.9 Å²	78.9	36%	0.357	43%	0.425	S	S	.	.			trans	-157.7	136.9	145	73.6	0	0	0	0	110	G1660 I1661	S1658-G1660 VanDerWaalsContact C-N 3.28Å; S1658-G1660 PolarHBondContact O-N 2.89Å; S1658-I1661 PolarHBondContact O-N 3.18Å; S1658-I1661 WeakPolarHBondContact OG-CB 3.35Å; S1658-I1661 WeakPolarHBondContact OG-CD1 3.34Å; S1658-I1661 WeakPolarHBondContact OG-CG1 3.42Å
1659	A	26.8	Very low	33.4	Very low	79 Å²	79	77.2 Å²	77.2	65%	0.653	42%	0.416	S	S	*	.	H	α-helix	trans	-65.1	-32.5	-176.8	0	0	0	0	0	112.4	I1661 K1662 Y1663	A1659-I1661 VanDerWaalsContact C-N 3.31Å; A1659-I1661 PolarHBondContact O-N 2.87Å; A1659-K1662 PolarHBondContact O-N 3.21Å; A1659-Y1663 PolarHBondContact O-N 3.02Å
1660	G	26.2	Very low	33.8	Very low	44 Å²	44	73.7 Å²	73.7	45%	0.454	40%	0.4	S	S	.	.	H	α-helix	trans	-64.8	-30.4	177	0	0	0	0	0	114.1	S1658 Y1663 I1664	S1658-G1660 VanDerWaalsContact C-N 3.28Å; S1658-G1660 PolarHBondContact O-N 2.89Å; G1660-Y1663 PolarHBondContact O-N 2.82Å; G1660-I1664 WeakPolarHBondContact O-CG1 3.47Å; G1660-I1664 PolarHBondContact O-N 3.21Å
1661	I	30.3	Very low	34.6	Very low	25 Å²	25	74.9 Å²	74.9	13%	0.128	40%	0.4	C	S	.	.	H	α-helix	trans	-71.4	-45.7	177.6	-82.1	173.3	0	0	0	110.3	L1618 E1620 L1621 S1658 A1659 Y1663 I1664 M1665	L1618-I1661 HydrophobicContact CB-CG2 4.4Å; L1618-I1661 HydrophobicContact CD1-CB 4.27Å; L1618-I1661 HydrophobicContact CD1-CG2 3.58Å; L1618-I1661 WeakPolarHBondContact CD1-O 3.19Å; E1620-I1661 HydrophobicContact CB-CD1 3.9Å; L1621-I1661 HydrophobicContact CD1-CB 4.35Å; L1621-I1661 HydrophobicContact CD1-CD1 3.73Å; L1621-I1661 HydrophobicContact CD1-CG2 4.12Å; L1621-I1661 HydrophobicContact CD2-CD1 4.28Å; L1621-I1661 HydrophobicContact CG-CD1 3.6Å; S1658-I1661 PolarHBondContact O-N 3.18Å; S1658-I1661 WeakPolarHBondContact OG-CB 3.35Å; S1658-I1661 WeakPolarHBondContact OG-CD1 3.34Å; S1658-I1661 WeakPolarHBondContact OG-CG1 3.42Å; A1659-I1661 VanDerWaalsContact C-N 3.31Å; A1659-I1661 PolarHBondContact O-N 2.87Å; I1661-Y1663 VanDerWaalsContact C-N 3.26Å; I1661-Y1663 PolarHBondContact O-N 2.84Å; I1661-I1664 PolarHBondContact O-N 2.64Å; I1661-I1664 VanDerWaalsContact O-N 3.16Å; I1661-M1665 PolarHBondContact O-N 2.76Å
1662	K	34.4	Very low	35.4	Very low	95 Å²	95	73.6 Å²	73.6	41%	0.413	39%	0.389	S	S	.	.	H	α-helix	trans	-55.9	-41.5	172.7	-70.8	-171	-175.1	178.1	0	111.9	E1656 A1659 M1665 I1666	E1656-K1662 WeakPolarHBondContact OE1-CE 3.17Å; E1656-K1662 IonicContact OE1-NZ 2.73Å; E1656-K1662 PolarHBondContact OE1-NZ 2.75Å; A1659-K1662 PolarHBondContact O-N 3.21Å; K1662-M1665 VanDerWaalsContact O-CB 3.27Å; K1662-M1665 WeakPolarHBondContact O-CB 3.42Å; K1662-M1665 PolarHBondContact O-N 2.88Å; K1662-I1666 WeakPolarHBondContact O-CD1 3.33Å; K1662-I1666 VanDerWaalsContact O-CG1 3.29Å; K1662-I1666 WeakPolarHBondContact O-CG1 3.27Å; K1662-I1666 PolarHBondContact O-N 3.16Å
1663	Y	33.5	Very low	36.2	Very low	159 Å²	159	64 Å²	64	62%	0.624	35%	0.354	S	S	*	.	H	α-helix	trans	-59.9	-49.1	174.6	-100	-90.3	0	0	0	112.8	A1659 G1660 I1661 M1665 I1666 C1667	A1659-Y1663 PolarHBondContact O-N 3.02Å; G1660-Y1663 PolarHBondContact O-N 2.82Å; I1661-Y1663 VanDerWaalsContact C-N 3.26Å; I1661-Y1663 PolarHBondContact O-N 2.84Å; Y1663-M1665 VanDerWaalsContact C-N 3.26Å; Y1663-M1665 PolarHBondContact O-N 3.36Å; Y1663-I1666 CarbonylContact O-C 3.58Å; Y1663-I1666 PolarHBondContact O-N 2.99Å; Y1663-I1666 VanDerWaalsContact O-N 3.13Å; Y1663-C1667 WeakPolarHBondContact O-CB 3.42Å; Y1663-C1667 PolarHBondContact O-N 3.29Å; Y1663-C1667 PolarHBondContact O-SG 3.32Å
1664	I	37.3	Very low	36.7	Very low	79 Å²	79	66.4 Å²	66.4	41%	0.405	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-37.5	178	-65.6	163.7	0	0	0	111.1	L1618 G1660 I1661 I1666 C1667 Q1668	L1618-I1664 HydrophobicContact CD1-CB 4.33Å; L1618-I1664 HydrophobicContact CD2-CG2 4.15Å; G1660-I1664 WeakPolarHBondContact O-CG1 3.47Å; G1660-I1664 PolarHBondContact O-N 3.21Å; I1661-I1664 PolarHBondContact O-N 2.64Å; I1661-I1664 VanDerWaalsContact O-N 3.16Å; I1664-I1666 VanDerWaalsContact C-N 3.31Å; I1664-I1666 PolarHBondContact O-N 3.16Å; I1664-C1667 PolarHBondContact O-N 2.73Å; I1664-Q1668 HydrophobicContact CG2-CG 4.28Å; I1664-Q1668 WeakPolarHBondContact O-CB 3.3Å; I1664-Q1668 WeakPolarHBondContact O-CG 3.47Å; I1664-Q1668 PolarHBondContact O-N 3.17Å
1665	M	38.8	Very low	37.3	Very low	28 Å²	28	67.7 Å²	67.7	14%	0.138	37%	0.368	C	S	.	.	H	α-helix	trans	-59.4	-44.6	176.1	-134.2	-176.3	-120.5	0	0	111	Y1616 R1617 L1618 I1661 K1662 Y1663 G1669	Y1616-M1665 HydrophobicContact CD1-CG 4.13Å; Y1616-M1665 HydrophobicContact CD1-SD 3.94Å; Y1616-M1665 HydrophobicContact CE1-CG 4.4Å; Y1616-M1665 HydrophobicContact CE1-SD 4.04Å; R1617-M1665 HydrophobicContact CB-CE 4.07Å; R1617-M1665 HydrophobicContact CB-SD 4.23Å; R1617-M1665 HydrophobicContact CG-CE 3.7Å; R1617-M1665 HydrophobicContact CG-SD 3.57Å; R1617-M1665 VanDerWaalsContact CG-SD 3.57Å; L1618-M1665 HydrophobicContact CB-CE 3.73Å; L1618-M1665 HydrophobicContact CB-CG 4.3Å; L1618-M1665 HydrophobicContact CD1-CB 3.5Å; L1618-M1665 VanDerWaalsContact CD1-CB 3.5Å; L1618-M1665 HydrophobicContact CD1-CE 4.13Å; L1618-M1665 HydrophobicContact CD1-CG 3.56Å; L1618-M1665 HydrophobicContact CD1-SD 4.47Å; L1618-M1665 HydrophobicContact CG-CB 4.29Å; L1618-M1665 HydrophobicContact CG-CE 4.35Å; L1618-M1665 HydrophobicContact CG-CG 3.91Å; L1618-M1665 VanDerWaalsContact N-CE 3.35Å; I1661-M1665 PolarHBondContact O-N 2.76Å; K1662-M1665 VanDerWaalsContact O-CB 3.27Å; K1662-M1665 WeakPolarHBondContact O-CB 3.42Å; K1662-M1665 PolarHBondContact O-N 2.88Å; Y1663-M1665 VanDerWaalsContact C-N 3.26Å; Y1663-M1665 PolarHBondContact O-N 3.36Å; M1665-G1669 WeakPolarHBondContact O-CA 3.14Å; M1665-G1669 PolarHBondContact O-N 2.91Å
1666	I	42.9	Very low	37.9	Very low	90 Å²	90	65 Å²	65	46%	0.462	36%	0.36	S	S	.	.	H	α-helix	trans	-80.7	-25.1	-177.7	-65.6	165.1	0	0	0	111.3	K1662 Y1663 I1664 G1669 A1670	K1662-I1666 WeakPolarHBondContact O-CD1 3.33Å; K1662-I1666 VanDerWaalsContact O-CG1 3.29Å; K1662-I1666 WeakPolarHBondContact O-CG1 3.27Å; K1662-I1666 PolarHBondContact O-N 3.16Å; Y1663-I1666 CarbonylContact O-C 3.58Å; Y1663-I1666 PolarHBondContact O-N 2.99Å; Y1663-I1666 VanDerWaalsContact O-N 3.13Å; I1664-I1666 VanDerWaalsContact C-N 3.31Å; I1664-I1666 PolarHBondContact O-N 3.16Å; I1666-G1669 CarbonylContact O-C 3.53Å; I1666-G1669 VanDerWaalsContact O-CA 3.32Å; I1666-G1669 WeakPolarHBondContact O-CA 3.37Å; I1666-A1670 WeakPolarHBondContact O-CB 3.45Å; I1666-A1670 PolarHBondContact O-N 2.93Å
1667	C	39.5	Very low	38.1	Very low	41 Å²	41	68.8 Å²	68.8	28%	0.277	38%	0.375	S	S	.	.	H	α-helix	trans	-82.1	-38.4	173.7	-67.6	0	0	0	0	112.6	Y1663 I1664 G1669 A1670 T1671	Y1663-C1667 WeakPolarHBondContact O-CB 3.42Å; Y1663-C1667 PolarHBondContact O-N 3.29Å; Y1663-C1667 PolarHBondContact O-SG 3.32Å; I1664-C1667 PolarHBondContact O-N 2.73Å; C1667-G1669 VanDerWaalsContact C-N 3.25Å; C1667-A1670 CarbonylContact O-C 3.59Å; C1667-A1670 PolarHBondContact O-N 2.89Å; C1667-T1671 WeakPolarHBondContact O-CG2 3.32Å; C1667-T1671 PolarHBondContact O-N 2.95Å; C1667-T1671 PolarHBondContact O-OG1 2.92Å
1668	Q	45.1	Very low	38.8	Very low	77 Å²	77	67.2 Å²	67.2	36%	0.36	37%	0.374	S	S	.	.	H	α-helix	trans	-59.1	-47	164	-73.7	177.6	-37.7	0	0	108.5	M1615 I1664 A1670 T1671 F1672	M1615-Q1668 WeakPolarHBondContact CE-O 3.23Å; I1664-Q1668 HydrophobicContact CG2-CG 4.28Å; I1664-Q1668 WeakPolarHBondContact O-CB 3.3Å; I1664-Q1668 WeakPolarHBondContact O-CG 3.47Å; I1664-Q1668 PolarHBondContact O-N 3.17Å; Q1668-A1670 PolarHBondContact O-N 2.85Å; Q1668-T1671 WeakPolarHBondContact CA-OG1 3.43Å; Q1668-T1671 PolarHBondContact O-N 3.45Å; Q1668-T1671 PolarHBondContact O-OG1 3.33Å; Q1668-F1672 PolarHBondContact O-N 2.8Å
1669	G	45	Very low	39.3	Very low	9 Å²	9	66.8 Å²	66.8	9%	0.093	37%	0.369	C	S	.	.	H	α-helix	trans	-30.5	-77.6	158.4	0	0	0	0	0	112.9	R1614 M1615 M1665 I1666 C1667 T1671 F1672	R1614-G1669 VanDerWaalsContact CZ-O 3.24Å; R1614-G1669 PolarHBondContact NE-O 3Å; R1614-G1669 PolarHBondContact NH2-O 3.27Å; R1614-G1669 VanDerWaalsContact NH2-O 3.09Å; M1615-G1669 VanDerWaalsContact SD-CA 3.55Å; M1665-G1669 WeakPolarHBondContact O-CA 3.14Å; M1665-G1669 PolarHBondContact O-N 2.91Å; I1666-G1669 CarbonylContact O-C 3.53Å; I1666-G1669 VanDerWaalsContact O-CA 3.32Å; I1666-G1669 WeakPolarHBondContact O-CA 3.37Å; C1667-G1669 VanDerWaalsContact C-N 3.25Å; G1669-T1671 PolarHBondContact O-N 3.2Å; G1669-T1671 VanDerWaalsContact O-N 3.12Å; G1669-F1672 PolarHBondContact O-N 3.17Å
1670	A	44.4	Very low	39.8	Very low	54 Å²	54	66.7 Å²	66.7	45%	0.446	36%	0.363	S	S	.	.	H	α-helix	trans	-68.1	3.4	-176.7	0	0	0	0	0	115.6	R1614 I1666 C1667 Q1668 V1674	R1614-A1670 VanDerWaalsContact CZ-CA 3.5Å; R1614-A1670 PolarHBondContact NH2-O 3.16Å; I1666-A1670 WeakPolarHBondContact O-CB 3.45Å; I1666-A1670 PolarHBondContact O-N 2.93Å; C1667-A1670 CarbonylContact O-C 3.59Å; C1667-A1670 PolarHBondContact O-N 2.89Å; Q1668-A1670 PolarHBondContact O-N 2.85Å; A1670-V1674 VanDerWaalsContact O-CG2 3.29Å; A1670-V1674 WeakPolarHBondContact O-CG2 3.31Å
1671	T	46.6	Very low	40.5	Very low	95 Å²	95	70.2 Å²	70.2	58%	0.583	38%	0.378	S	S	*	.	H	α-helix	trans	-100.5	-37.5	165.7	39.8	0	0	0	0	112.7	C1667 Q1668 G1669 V1674 F1675	C1667-T1671 WeakPolarHBondContact O-CG2 3.32Å; C1667-T1671 PolarHBondContact O-N 2.95Å; C1667-T1671 PolarHBondContact O-OG1 2.92Å; Q1668-T1671 WeakPolarHBondContact CA-OG1 3.43Å; Q1668-T1671 PolarHBondContact O-N 3.45Å; Q1668-T1671 PolarHBondContact O-OG1 3.33Å; G1669-T1671 PolarHBondContact O-N 3.2Å; G1669-T1671 VanDerWaalsContact O-N 3.12Å; T1671-V1674 PolarHBondContact O-N 3.29Å; T1671-F1675 PolarHBondContact O-N 3.45Å
1672	F	47.3	Very low	41.1	Very low	13 Å²	13	75.8 Å²	75.8	6%	0.057	41%	0.408	C	S	.	.	H	α-helix	trans	-58.4	-70.8	-178.7	179.1	-122	0	0	0	114	R1614 M1615 Q1668 G1669 V1674 F1675 V1676 F1692 L1702 A1705 L1706 L1709	R1614-F1672 HydrophobicContact CG-CD1 3.97Å; M1615-F1672 HydrophobicContact CE-CB 3.27Å; M1615-F1672 HydrophobicContact CE-CD1 4.32Å; M1615-F1672 HydrophobicContact CE-CG 4Å; M1615-F1672 HydrophobicContact CG-CB 4.24Å; M1615-F1672 HydrophobicContact CG-CD1 4.11Å; Q1668-F1672 PolarHBondContact O-N 2.8Å; G1669-F1672 PolarHBondContact O-N 3.17Å; F1672-V1674 PolarHBondContact O-N 2.89Å; F1672-F1675 CarbonylContact O-C 3.35Å; F1672-F1675 VanDerWaalsContact O-CA 3.32Å; F1672-F1675 WeakPolarHBondContact O-CA 3.48Å; F1672-F1675 WeakPolarHBondContact O-CB 3.2Å; F1672-F1675 PolarHBondContact O-N 3.38Å; F1672-V1676 HydrophobicContact CD1-CG2 4.16Å; F1672-V1676 HydrophobicContact CD2-CG2 4.09Å; F1672-V1676 HydrophobicContact CE1-CG2 3.93Å; F1672-V1676 HydrophobicContact CE2-CG2 3.86Å; F1672-V1676 HydrophobicContact CG-CG2 4.24Å; F1672-V1676 HydrophobicContact CZ-CG2 3.78Å; F1672-V1676 PolarHBondContact O-N 3.23Å; F1672-F1692 HydrophobicContact CD2-CE1 4.42Å; F1672-F1692 HydrophobicContact CD2-CZ 4.05Å; F1672-F1692 HydrophobicContact CE2-CE1 4.15Å; F1672-F1692 HydrophobicContact CE2-CZ 4.21Å; F1672-L1702 HydrophobicContact CB-CD2 4.29Å; F1672-L1702 HydrophobicContact CD1-CD2 4.4Å; F1672-L1702 HydrophobicContact CD2-CD2 3.38Å; F1672-L1702 HydrophobicContact CE2-CD2 3.69Å; F1672-L1702 HydrophobicContact CG-CD2 3.79Å; F1672-L1702 HydrophobicContact CZ-CD2 4.31Å; F1672-A1705 HydrophobicContact CD1-CB 4.49Å; F1672-A1705 HydrophobicContact CE1-CB 4.1Å; F1672-L1706 HydrophobicContact CZ-CD2 4.45Å; F1672-L1709 HydrophobicContact CE1-CD1 3.95Å; F1672-L1709 HydrophobicContact CZ-CD1 3.85Å
1673	G	42.6	Very low	41.3	Very low	3 Å²	3	76.5 Å²	76.5	3%	0.031	42%	0.42	C	S	.	.	H	α-helix	trans	-76.5	29.7	173.9	0	0	0	0	0	117.4	R1614	R1614-G1673 VanDerWaalsContact NE-CA 3.29Å; R1614-G1673 PolarHBondContact NH1-O 2.91Å
1674	V	41.6	Very low	41.7	Very low	75 Å²	75	71.9 Å²	71.9	46%	0.455	41%	0.408	S	S	.	.	H	α-helix	trans	-95.5	-51.8	153.6	163.7	0	0	0	0	103.7	A1670 T1671 F1672 V1676 K1677 D1678	A1670-V1674 VanDerWaalsContact O-CG2 3.29Å; A1670-V1674 WeakPolarHBondContact O-CG2 3.31Å; T1671-V1674 PolarHBondContact O-N 3.29Å; F1672-V1674 PolarHBondContact O-N 2.89Å; V1674-V1676 VanDerWaalsContact C-N 3.33Å; V1674-V1676 PolarHBondContact O-N 3.22Å; V1674-K1677 CarbonylContact O-C 3.48Å; V1674-K1677 WeakPolarHBondContact O-CA 3.31Å; V1674-K1677 VanDerWaalsContact O-CB 3.31Å; V1674-K1677 WeakPolarHBondContact O-CB 3.42Å; V1674-K1677 PolarHBondContact O-N 2.69Å; V1674-D1678 VanDerWaalsContact O-CG 3.25Å; V1674-D1678 PolarHBondContact O-N 3.24Å
1675	F	40.7	Very low	42.3	Very low	78 Å²	78	69.4 Å²	69.4	34%	0.342	40%	0.397	S	S	.	.	H	α-helix	trans	-52.7	-41.9	165.2	-160.9	-97.6	0	0	0	113.7	T1671 F1672 K1677 D1678 T1679 F1692	T1671-F1675 PolarHBondContact O-N 3.45Å; F1672-F1675 CarbonylContact O-C 3.35Å; F1672-F1675 VanDerWaalsContact O-CA 3.32Å; F1672-F1675 WeakPolarHBondContact O-CA 3.48Å; F1672-F1675 WeakPolarHBondContact O-CB 3.2Å; F1672-F1675 PolarHBondContact O-N 3.38Å; F1675-K1677 VanDerWaalsContact C-N 3.28Å; F1675-K1677 PolarHBondContact O-N 3.42Å; F1675-D1678 CarbonylContact O-C 3.57Å; F1675-D1678 PolarHBondContact O-N 3.33Å; F1675-D1678 VanDerWaalsContact O-N 3.15Å; F1675-T1679 HydrophobicContact CD1-CG2 3.82Å; F1675-T1679 HydrophobicContact CE1-CG2 3.57Å; F1675-T1679 HydrophobicContact CG-CG2 4.43Å; F1675-T1679 HydrophobicContact CZ-CG2 3.98Å; F1675-T1679 WeakPolarHBondContact O-CG2 3.19Å; F1675-T1679 PolarHBondContact O-N 3.1Å; F1675-T1679 PolarHBondContact O-OG1 2.86Å; F1675-T1679 VanDerWaalsContact O-OG1 3.06Å; F1675-F1692 HydrophobicContact CD1-CD2 4.07Å; F1675-F1692 AromaticContact CD1-CE2 3.51Å; F1675-F1692 HydrophobicContact CD1-CE2 3.51Å; F1675-F1692 AromaticContact CD1-CZ 3.93Å; F1675-F1692 HydrophobicContact CD1-CZ 3.93Å; F1675-F1692 AromaticContact CE1-CD2 3.59Å; F1675-F1692 HydrophobicContact CE1-CD2 3.59Å; F1675-F1692 AromaticContact CE1-CE2 3.55Å; F1675-F1692 HydrophobicContact CE1-CE2 3.55Å; F1675-F1692 HydrophobicContact CE1-CG 4.25Å; F1675-F1692 HydrophobicContact CE1-CZ 4.2Å; F1675-F1692 HydrophobicContact CG-CE2 4.07Å; F1675-F1692 AromaticContact CZ-CD2 3.94Å; F1675-F1692 HydrophobicContact CZ-CD2 3.94Å; F1675-F1692 HydrophobicContact CZ-CE2 4.15Å
1676	V	46	Very low	43	Very low	50 Å²	50	75.6 Å²	75.6	30%	0.303	42%	0.419	S	S	.	.	H	α-helix	trans	-69.2	-22.9	173.4	-169.2	0	0	0	0	112.8	F1672 V1674 T1679	F1672-V1676 HydrophobicContact CD1-CG2 4.16Å; F1672-V1676 HydrophobicContact CD2-CG2 4.09Å; F1672-V1676 HydrophobicContact CE1-CG2 3.93Å; F1672-V1676 HydrophobicContact CE2-CG2 3.86Å; F1672-V1676 HydrophobicContact CG-CG2 4.24Å; F1672-V1676 HydrophobicContact CZ-CG2 3.78Å; F1672-V1676 PolarHBondContact O-N 3.23Å; V1674-V1676 VanDerWaalsContact C-N 3.33Å; V1674-V1676 PolarHBondContact O-N 3.22Å; V1676-T1679 WeakPolarHBondContact CA-OG1 3.16Å
1677	K	37.9	Very low	43.3	Very low	151 Å²	151	74.7 Å²	74.7	66%	0.657	41%	0.412	S	S	*	.	H	α-helix	trans	-77.5	-27.8	172.3	-159.1	-174.5	179	-166.5	0	111.1	V1674 F1675	V1674-K1677 CarbonylContact O-C 3.48Å; V1674-K1677 WeakPolarHBondContact O-CA 3.31Å; V1674-K1677 VanDerWaalsContact O-CB 3.31Å; V1674-K1677 WeakPolarHBondContact O-CB 3.42Å; V1674-K1677 PolarHBondContact O-N 2.69Å; F1675-K1677 VanDerWaalsContact C-N 3.28Å; F1675-K1677 PolarHBondContact O-N 3.42Å
1678	D	39.3	Very low	43.8	Very low	115 Å²	115	75.1 Å²	75.1	62%	0.615	41%	0.414	S	S	*	.	H	α-helix	trans	-90.5	-13.8	177.9	-52.6	-31.9	0	0	0	113.4	V1674 F1675	V1674-D1678 VanDerWaalsContact O-CG 3.25Å; V1674-D1678 PolarHBondContact O-N 3.24Å; F1675-D1678 CarbonylContact O-C 3.57Å; F1675-D1678 PolarHBondContact O-N 3.33Å; F1675-D1678 VanDerWaalsContact O-N 3.15Å
1679	T	39.9	Very low	44.1	Very low	42 Å²	42	74.9 Å²	74.9	26%	0.258	42%	0.415	S	S	.	.			trans	-103.7	71	176.2	60.3	0	0	0	0	111.7	F1675 V1676 V1684	F1675-T1679 HydrophobicContact CD1-CG2 3.82Å; F1675-T1679 HydrophobicContact CE1-CG2 3.57Å; F1675-T1679 HydrophobicContact CG-CG2 4.43Å; F1675-T1679 HydrophobicContact CZ-CG2 3.98Å; F1675-T1679 WeakPolarHBondContact O-CG2 3.19Å; F1675-T1679 PolarHBondContact O-N 3.1Å; F1675-T1679 PolarHBondContact O-OG1 2.86Å; F1675-T1679 VanDerWaalsContact O-OG1 3.06Å; V1676-T1679 WeakPolarHBondContact CA-OG1 3.16Å; T1679-V1684 HydrophobicContact CG2-CG2 4.42Å
1680	C	35.8	Very low	44.6	Very low	78 Å²	78	76.6 Å²	76.6	53%	0.527	43%	0.428	S	S	.	.			trans	-61.1	144.6	152.9	-69.9	0	0	0	0	109.5	D1682	C1680-D1682 PolarHBondContact O-N 3.32Å; C1680-D1682 VanDerWaalsContact O-N 3.16Å
1681	P	42.5	Very low	45.1	Very low	117 Å²	117	80.1 Å²	80.1	76%	0.76	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.9	-170.8	24.6	-33.5	0	0	0	114.9
1682	D	41.4	Very low	45.4	Very low	143 Å²	143	77.5 Å²	77.5	77%	0.765	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.3	-163.2	-47.4	-52.8	0	0	0	115.4	C1680	C1680-D1682 PolarHBondContact O-N 3.32Å; C1680-D1682 VanDerWaalsContact O-N 3.16Å
1683	V	40.4	Very low	45.9	Very low	110 Å²	110	80.1 Å²	80.1	67%	0.667	43%	0.43	S	S	*	.	S	Bend	trans	-132.5	9.5	-166	-155.6	0	0	0	0	114.5
1684	V	41.6	Very low	46.7	Very low	61 Å²	61	83.3 Å²	83.3	37%	0.37	45%	0.452	S	S	.	.			trans	-118.7	123.5	179.1	-174	0	0	0	0	111.2	T1679 P1688	T1679-V1684 HydrophobicContact CG2-CG2 4.42Å; V1684-P1688 HydrophobicContact CG1-CB 3.99Å; V1684-P1688 HydrophobicContact CG1-CG 4.16Å
1685	P	49.5	Very low	47.5	Very low	27 Å²	27	82.6 Å²	82.6	18%	0.175	45%	0.45	C	S	.	.			trans	-61.4	155	176.3	24.6	-34.6	0	0	0	111.7	E253 Y254 K1687 P1688	E253-P1685 HydrophobicContact CB-CB 4.43Å; E253-P1685 VanDerWaalsContact OE2-CD 3.25Å; E253-P1685 WeakPolarHBondContact OE2-CD 3.3Å; E253-P1685 WeakPolarHBondContact OE2-CG 3.2Å; Y254-P1685 HydrophobicContact CE2-CB 4.37Å; P1685-K1687 PolarHBondContact O-N 3.08Å; P1685-P1688 HydrophobicContact CG-CG 4.09Å; P1685-P1688 VanDerWaalsContact O-CD 3.29Å; P1685-P1688 WeakPolarHBondContact O-CD 3.32Å
1686	W	52.3	Low	48.4	Very low	158 Å²	158	80.9 Å²	80.9	60%	0.598	44%	0.443	S	S	*	.	H	α-helix	trans	-57.6	-17	173.7	-118.8	128	0	0	0	113.1	Y254 L1689 A1690 I1693	Y254-W1686 HydrophobicContact CE2-CB 4.15Å; W1686-L1689 HydrophobicContact CD2-CD2 4.48Å; W1686-L1689 HydrophobicContact CE3-CB 3.87Å; W1686-L1689 HydrophobicContact CE3-CD2 3.89Å; W1686-L1689 HydrophobicContact CE3-CG 4.09Å; W1686-L1689 HydrophobicContact CH2-CD2 3.95Å; W1686-L1689 HydrophobicContact CZ3-CB 4.06Å; W1686-L1689 HydrophobicContact CZ3-CD2 3.61Å; W1686-L1689 HydrophobicContact CZ3-CG 3.78Å; W1686-A1690 HydrophobicContact CE3-CB 3.95Å; W1686-A1690 HydrophobicContact CZ3-CB 4.31Å; W1686-A1690 WeakPolarHBondContact O-CB 3.37Å; W1686-A1690 PolarHBondContact O-N 3.39Å; W1686-I1693 HydrophobicContact CH2-CD1 4.26Å; W1686-I1693 HydrophobicContact CZ3-CD1 3.98Å
1687	K	49.6	Very low	48.9	Very low	71 Å²	71	83 Å²	83	31%	0.309	45%	0.451	S	S	.	.	H	α-helix	trans	-63.9	-60.7	-179.2	-93.7	168.8	-179	173.9	0	113.9	Y254 S257 P1685 L1689 A1690 Q1691	Y254-K1687 HydrophobicContact CE2-CG 4.35Å; S257-K1687 PolarHBondContact OG-NZ 2.97Å; P1685-K1687 PolarHBondContact O-N 3.08Å; K1687-L1689 VanDerWaalsContact C-N 3.3Å; K1687-L1689 PolarHBondContact O-N 2.71Å; K1687-A1690 PolarHBondContact O-N 3.11Å; K1687-Q1691 VanDerWaalsContact O-CB 3.27Å; K1687-Q1691 WeakPolarHBondContact O-CB 3.21Å; K1687-Q1691 VanDerWaalsContact O-CG 3.27Å; K1687-Q1691 WeakPolarHBondContact O-CG 3.46Å; K1687-Q1691 PolarHBondContact O-N 3.01Å
1688	P	49.9	Very low	49.7	Very low	50 Å²	50	79.9 Å²	79.9	33%	0.325	45%	0.446	S	S	.	.	H	α-helix	trans	-51	-44.3	170.6	-30.2	35.4	0	0	0	113.4	V1684 P1685 Q1691 F1692	V1684-P1688 HydrophobicContact CG1-CB 3.99Å; V1684-P1688 HydrophobicContact CG1-CG 4.16Å; P1685-P1688 HydrophobicContact CG-CG 4.09Å; P1685-P1688 VanDerWaalsContact O-CD 3.29Å; P1685-P1688 WeakPolarHBondContact O-CD 3.32Å; P1688-Q1691 PolarHBondContact O-N 3.23Å; P1688-F1692 WeakPolarHBondContact O-CA 3.35Å; P1688-F1692 WeakPolarHBondContact O-CB 3.2Å; P1688-F1692 PolarHBondContact O-N 3.4Å
1689	L	51.1	Low	50.5	Low	73 Å²	73	77.7 Å²	77.7	38%	0.382	43%	0.433	S	S	.	.	H	α-helix	trans	-67	-41.9	-179.1	-168.7	68.8	0	0	0	112.2	W1686 K1687 F1692 I1693	W1686-L1689 HydrophobicContact CD2-CD2 4.48Å; W1686-L1689 HydrophobicContact CE3-CB 3.87Å; W1686-L1689 HydrophobicContact CE3-CD2 3.89Å; W1686-L1689 HydrophobicContact CE3-CG 4.09Å; W1686-L1689 HydrophobicContact CH2-CD2 3.95Å; W1686-L1689 HydrophobicContact CZ3-CB 4.06Å; W1686-L1689 HydrophobicContact CZ3-CD2 3.61Å; W1686-L1689 HydrophobicContact CZ3-CG 3.78Å; K1687-L1689 VanDerWaalsContact C-N 3.3Å; K1687-L1689 PolarHBondContact O-N 2.71Å; L1689-F1692 WeakPolarHBondContact O-CB 3.38Å; L1689-F1692 PolarHBondContact O-N 2.63Å; L1689-I1693 HydrophobicContact CG-CD1 4.38Å; L1689-I1693 WeakPolarHBondContact O-CB 3.41Å; L1689-I1693 VanDerWaalsContact O-CG1 3.3Å; L1689-I1693 WeakPolarHBondContact O-CG1 3.25Å; L1689-I1693 PolarHBondContact O-N 3.23Å
1690	A	57.1	Low	51.2	Low	45 Å²	45	77.6 Å²	77.6	37%	0.372	43%	0.429	S	S	.	.	H	α-helix	trans	-70.3	-39.2	175.7	0	0	0	0	0	112.3	W1686 K1687 F1692 I1693 S1694	W1686-A1690 HydrophobicContact CE3-CB 3.95Å; W1686-A1690 HydrophobicContact CZ3-CB 4.31Å; W1686-A1690 WeakPolarHBondContact O-CB 3.37Å; W1686-A1690 PolarHBondContact O-N 3.39Å; K1687-A1690 PolarHBondContact O-N 3.11Å; A1690-F1692 VanDerWaalsContact C-N 3.35Å; A1690-I1693 PolarHBondContact O-N 3.21Å; A1690-S1694 WeakPolarHBondContact O-CB 3.47Å; A1690-S1694 PolarHBondContact O-N 2.87Å
1691	Q	55	Low	51.9	Low	127 Å²	127	77.2 Å²	77.2	59%	0.593	42%	0.417	S	S	*	.	H	α-helix	trans	-63.5	-42.2	172.8	-75.7	-179.9	-2.7	0	0	110.9	K1687 P1688 S1694 S1695	K1687-Q1691 VanDerWaalsContact O-CB 3.27Å; K1687-Q1691 WeakPolarHBondContact O-CB 3.21Å; K1687-Q1691 VanDerWaalsContact O-CG 3.27Å; K1687-Q1691 WeakPolarHBondContact O-CG 3.46Å; K1687-Q1691 PolarHBondContact O-N 3.01Å; P1688-Q1691 PolarHBondContact O-N 3.23Å; Q1691-S1694 PolarHBondContact O-N 3.26Å; Q1691-S1694 PolarHBondContact O-OG 3.38Å; Q1691-S1695 WeakPolarHBondContact O-CB 3.16Å; Q1691-S1695 PolarHBondContact O-N 3.5Å; Q1691-S1695 PolarHBondContact O-OG 3.38Å
1692	F	53.1	Low	52.2	Low	40 Å²	40	72.1 Å²	72.1	18%	0.175	38%	0.383	C	S	.	.	H	α-helix	trans	-57.5	-61.7	172.7	-171.8	-85.9	0	0	0	109	F1672 F1675 P1688 L1689 A1690 S1694 S1695 F1696	F1672-F1692 HydrophobicContact CD2-CE1 4.42Å; F1672-F1692 HydrophobicContact CD2-CZ 4.05Å; F1672-F1692 HydrophobicContact CE2-CE1 4.15Å; F1672-F1692 HydrophobicContact CE2-CZ 4.21Å; F1675-F1692 HydrophobicContact CD1-CD2 4.07Å; F1675-F1692 AromaticContact CD1-CE2 3.51Å; F1675-F1692 HydrophobicContact CD1-CE2 3.51Å; F1675-F1692 AromaticContact CD1-CZ 3.93Å; F1675-F1692 HydrophobicContact CD1-CZ 3.93Å; F1675-F1692 AromaticContact CE1-CD2 3.59Å; F1675-F1692 HydrophobicContact CE1-CD2 3.59Å; F1675-F1692 AromaticContact CE1-CE2 3.55Å; F1675-F1692 HydrophobicContact CE1-CE2 3.55Å; F1675-F1692 HydrophobicContact CE1-CG 4.25Å; F1675-F1692 HydrophobicContact CE1-CZ 4.2Å; F1675-F1692 HydrophobicContact CG-CE2 4.07Å; F1675-F1692 AromaticContact CZ-CD2 3.94Å; F1675-F1692 HydrophobicContact CZ-CD2 3.94Å; F1675-F1692 HydrophobicContact CZ-CE2 4.15Å; P1688-F1692 WeakPolarHBondContact O-CA 3.35Å; P1688-F1692 WeakPolarHBondContact O-CB 3.2Å; P1688-F1692 PolarHBondContact O-N 3.4Å; L1689-F1692 WeakPolarHBondContact O-CB 3.38Å; L1689-F1692 PolarHBondContact O-N 2.63Å; A1690-F1692 VanDerWaalsContact C-N 3.35Å; F1692-S1694 PolarHBondContact O-N 2.97Å; F1692-S1694 VanDerWaalsContact O-N 3.14Å; F1692-S1695 CarbonylContact O-C 3.59Å; F1692-S1695 WeakPolarHBondContact O-CA 3.18Å; F1692-S1695 WeakPolarHBondContact O-CB 3.43Å; F1692-S1695 PolarHBondContact O-N 3.06Å; F1692-S1695 PolarHBondContact O-OG 3.36Å; F1692-F1696 AromaticContact CD1-CD2 3.39Å; F1692-F1696 HydrophobicContact CD1-CD2 3.39Å; F1692-F1696 AromaticContact CD1-CE2 3.72Å; F1692-F1696 HydrophobicContact CD1-CE2 3.72Å; F1692-F1696 HydrophobicContact CD1-CG 4.29Å; F1692-F1696 HydrophobicContact CD2-CD2 4.02Å; F1692-F1696 AromaticContact CD2-CE2 3.56Å; F1692-F1696 HydrophobicContact CD2-CE2 3.56Å; F1692-F1696 AromaticContact CE1-CD2 3.39Å; F1692-F1696 HydrophobicContact CE1-CD2 3.39Å; F1692-F1696 AromaticContact CE1-CE2 3.43Å; F1692-F1696 HydrophobicContact CE1-CE2 3.43Å; F1692-F1696 VanDerWaalsContact CE1-CE2 3.43Å; F1692-F1696 HydrophobicContact CE1-CG 4.11Å; F1692-F1696 HydrophobicContact CE1-CZ 4.12Å; F1692-F1696 HydrophobicContact CE2-CD2 4.03Å; F1692-F1696 AromaticContact CE2-CE2 3.28Å; F1692-F1696 HydrophobicContact CE2-CE2 3.28Å; F1692-F1696 AromaticContact CE2-CZ 3.94Å; F1692-F1696 HydrophobicContact CE2-CZ 3.94Å; F1692-F1696 AromaticContact CG-CD2 3.71Å; F1692-F1696 HydrophobicContact CG-CD2 3.71Å; F1692-F1696 AromaticContact CG-CE2 3.78Å; F1692-F1696 HydrophobicContact CG-CE2 3.78Å; F1692-F1696 AromaticContact CZ-CD2 3.72Å; F1692-F1696 HydrophobicContact CZ-CD2 3.72Å; F1692-F1696 AromaticContact CZ-CE2 3.2Å; F1692-F1696 HydrophobicContact CZ-CE2 3.2Å; F1692-F1696 AromaticContact CZ-CZ 3.66Å; F1692-F1696 HydrophobicContact CZ-CZ 3.66Å; F1692-F1696 VanDerWaalsContact O-CD2 3.24Å; F1692-F1696 WeakPolarHBondContact O-CD2 3.28Å; F1692-F1696 PolarHBondContact O-N 3.07Å
1693	I	56.6	Low	52.6	Low	68 Å²	68	66.1 Å²	66.1	35%	0.349	35%	0.35	S	S	.	.	H	α-helix	trans	-49.1	-46.3	176.8	-69	170.4	0	0	0	111.1	W1686 L1689 A1690 S1695 F1696 I1697	W1686-I1693 HydrophobicContact CH2-CD1 4.26Å; W1686-I1693 HydrophobicContact CZ3-CD1 3.98Å; L1689-I1693 HydrophobicContact CG-CD1 4.38Å; L1689-I1693 WeakPolarHBondContact O-CB 3.41Å; L1689-I1693 VanDerWaalsContact O-CG1 3.3Å; L1689-I1693 WeakPolarHBondContact O-CG1 3.25Å; L1689-I1693 PolarHBondContact O-N 3.23Å; A1690-I1693 PolarHBondContact O-N 3.21Å; I1693-S1695 VanDerWaalsContact C-N 3.33Å; I1693-S1695 PolarHBondContact O-N 3.43Å; I1693-F1696 CarbonylContact O-C 3.41Å; I1693-F1696 PolarHBondContact O-N 3.41Å; I1693-I1697 WeakPolarHBondContact O-CG1 3.45Å; I1693-I1697 PolarHBondContact O-N 3.24Å
1694	S	59.6	Low	52.9	Low	71 Å²	71	66.5 Å²	66.5	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-37	177.3	82.5	0	0	0	0	113.8	A1690 Q1691 F1692 F1696	A1690-S1694 WeakPolarHBondContact O-CB 3.47Å; A1690-S1694 PolarHBondContact O-N 2.87Å; Q1691-S1694 PolarHBondContact O-N 3.26Å; Q1691-S1694 PolarHBondContact O-OG 3.38Å; F1692-S1694 PolarHBondContact O-N 2.97Å; F1692-S1694 VanDerWaalsContact O-N 3.14Å; S1694-F1696 VanDerWaalsContact C-N 3.32Å
1695	S	59.2	Low	53.2	Low	60 Å²	60	63.6 Å²	63.6	42%	0.42	33%	0.331	S	S	.	.	H	α-helix	trans	-77.5	-15.9	175.1	77.6	0	0	0	0	113.8	Q1691 F1692 I1693 P1698 Q1699	Q1691-S1695 WeakPolarHBondContact O-CB 3.16Å; Q1691-S1695 PolarHBondContact O-N 3.5Å; Q1691-S1695 PolarHBondContact O-OG 3.38Å; F1692-S1695 CarbonylContact O-C 3.59Å; F1692-S1695 WeakPolarHBondContact O-CA 3.18Å; F1692-S1695 WeakPolarHBondContact O-CB 3.43Å; F1692-S1695 PolarHBondContact O-N 3.06Å; F1692-S1695 PolarHBondContact O-OG 3.36Å; I1693-S1695 VanDerWaalsContact C-N 3.33Å; I1693-S1695 PolarHBondContact O-N 3.43Å; S1695-P1698 WeakPolarHBondContact O-CD 3.35Å; S1695-Q1699 PolarHBondContact O-NE2 2.85Å
1696	F	59.4	Low	53.2	Low	42 Å²	42	65.8 Å²	65.8	18%	0.184	34%	0.341	C	S	.	.	H	α-helix	trans	-99.1	-16.2	178.2	-82.8	-82.6	0	0	0	114.1	F1692 I1693 S1694 P1698 Q1699 L1702	F1692-F1696 AromaticContact CD1-CD2 3.39Å; F1692-F1696 HydrophobicContact CD1-CD2 3.39Å; F1692-F1696 AromaticContact CD1-CE2 3.72Å; F1692-F1696 HydrophobicContact CD1-CE2 3.72Å; F1692-F1696 HydrophobicContact CD1-CG 4.29Å; F1692-F1696 HydrophobicContact CD2-CD2 4.02Å; F1692-F1696 AromaticContact CD2-CE2 3.56Å; F1692-F1696 HydrophobicContact CD2-CE2 3.56Å; F1692-F1696 AromaticContact CE1-CD2 3.39Å; F1692-F1696 HydrophobicContact CE1-CD2 3.39Å; F1692-F1696 AromaticContact CE1-CE2 3.43Å; F1692-F1696 HydrophobicContact CE1-CE2 3.43Å; F1692-F1696 VanDerWaalsContact CE1-CE2 3.43Å; F1692-F1696 HydrophobicContact CE1-CG 4.11Å; F1692-F1696 HydrophobicContact CE1-CZ 4.12Å; F1692-F1696 HydrophobicContact CE2-CD2 4.03Å; F1692-F1696 AromaticContact CE2-CE2 3.28Å; F1692-F1696 HydrophobicContact CE2-CE2 3.28Å; F1692-F1696 AromaticContact CE2-CZ 3.94Å; F1692-F1696 HydrophobicContact CE2-CZ 3.94Å; F1692-F1696 AromaticContact CG-CD2 3.71Å; F1692-F1696 HydrophobicContact CG-CD2 3.71Å; F1692-F1696 AromaticContact CG-CE2 3.78Å; F1692-F1696 HydrophobicContact CG-CE2 3.78Å; F1692-F1696 AromaticContact CZ-CD2 3.72Å; F1692-F1696 HydrophobicContact CZ-CD2 3.72Å; F1692-F1696 AromaticContact CZ-CE2 3.2Å; F1692-F1696 HydrophobicContact CZ-CE2 3.2Å; F1692-F1696 AromaticContact CZ-CZ 3.66Å; F1692-F1696 HydrophobicContact CZ-CZ 3.66Å; F1692-F1696 VanDerWaalsContact O-CD2 3.24Å; F1692-F1696 WeakPolarHBondContact O-CD2 3.28Å; F1692-F1696 PolarHBondContact O-N 3.07Å; I1693-F1696 CarbonylContact O-C 3.41Å; I1693-F1696 PolarHBondContact O-N 3.41Å; S1694-F1696 VanDerWaalsContact C-N 3.32Å; F1696-P1698 VanDerWaalsContact O-N 3.16Å; F1696-Q1699 HydrophobicContact CD1-CB 4.05Å; F1696-Q1699 VanDerWaalsContact CD1-CD 3.42Å; F1696-Q1699 HydrophobicContact CD1-CG 4.15Å; F1696-Q1699 VanDerWaalsContact CE1-CD 3.46Å; F1696-Q1699 VanDerWaalsContact CE1-NE2 3.34Å; F1696-Q1699 VanDerWaalsContact CE1-OE1 3.23Å; F1696-Q1699 WeakPolarHBondContact O-CA 3.3Å; F1696-Q1699 WeakPolarHBondContact O-CB 3.25Å; F1696-Q1699 PolarHBondContact O-N 2.82Å; F1696-L1702 HydrophobicContact CD1-CB 4.22Å; F1696-L1702 HydrophobicContact CD1-CD1 4.14Å; F1696-L1702 HydrophobicContact CD1-CD2 3.61Å; F1696-L1702 HydrophobicContact CD1-CG 4.19Å; F1696-L1702 HydrophobicContact CE1-CD1 3.79Å; F1696-L1702 HydrophobicContact CE1-CD2 3.49Å; F1696-L1702 VanDerWaalsContact CE1-CD2 3.49Å; F1696-L1702 HydrophobicContact CE1-CG 4.15Å; F1696-L1702 HydrophobicContact CZ-CD2 4.34Å
1697	I	54.9	Low	52.8	Low	94 Å²	94	61.3 Å²	61.3	48%	0.482	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-37.9	169.4	-72.6	167.5	0	0	0	113.2	I1693 Q1699	I1693-I1697 WeakPolarHBondContact O-CG1 3.45Å; I1693-I1697 PolarHBondContact O-N 3.24Å; I1697-Q1699 VanDerWaalsContact C-N 3.3Å; I1697-Q1699 PolarHBondContact O-N 3.2Å
1698	P	56.2	Low	52.7	Low	85 Å²	85	61.1 Å²	61.1	55%	0.552	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.1	175.1	-16.1	32	0	0	0	115.6	S1695 F1696 F1700	S1695-P1698 WeakPolarHBondContact O-CD 3.35Å; F1696-P1698 VanDerWaalsContact O-N 3.16Å; P1698-F1700 WeakPolarHBondContact O-CE2 3.49Å
1699	Q	55	Low	52.7	Low	70 Å²	70	60.8 Å²	60.8	33%	0.327	34%	0.338	S	S	.	.			trans	-105.3	76.3	-168.6	-60.4	-169.8	46.7	0	0	112.3	S1695 F1696 I1697 Y1701 L1702	S1695-Q1699 PolarHBondContact O-NE2 2.85Å; F1696-Q1699 HydrophobicContact CD1-CB 4.05Å; F1696-Q1699 VanDerWaalsContact CD1-CD 3.42Å; F1696-Q1699 HydrophobicContact CD1-CG 4.15Å; F1696-Q1699 VanDerWaalsContact CE1-CD 3.46Å; F1696-Q1699 VanDerWaalsContact CE1-NE2 3.34Å; F1696-Q1699 VanDerWaalsContact CE1-OE1 3.23Å; F1696-Q1699 WeakPolarHBondContact O-CA 3.3Å; F1696-Q1699 WeakPolarHBondContact O-CB 3.25Å; F1696-Q1699 PolarHBondContact O-N 2.82Å; I1697-Q1699 VanDerWaalsContact C-N 3.3Å; I1697-Q1699 PolarHBondContact O-N 3.2Å; Q1699-Y1701 PolarHBondContact O-N 3.33Å; Q1699-L1702 PolarHBondContact O-N 3.3Å; Q1699-L1702 VanDerWaalsContact O-N 3.11Å
1700	F	55	Low	52.2	Low	39 Å²	39	60.1 Å²	60.1	17%	0.171	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-25	-173.7	-53.1	-63.5	0	0	0	116.8	P1698 V1744 G1747 A1748 F1751	P1698-F1700 WeakPolarHBondContact O-CE2 3.49Å; F1700-V1744 HydrophobicContact CD1-CG1 4.35Å; F1700-G1747 WeakPolarHBondContact CE1-O 3.38Å; F1700-G1747 VanDerWaalsContact CZ-O 3.31Å; F1700-G1747 WeakPolarHBondContact CZ-O 3.2Å; F1700-A1748 HydrophobicContact CD1-CB 3.95Å; F1700-A1748 HydrophobicContact CE1-CB 4.35Å; F1700-A1748 VanDerWaalsContact CE1-N 3.29Å; F1700-F1751 HydrophobicContact CD2-CB 4.2Å; F1700-F1751 HydrophobicContact CD2-CD1 4.01Å; F1700-F1751 HydrophobicContact CD2-CD2 4.48Å; F1700-F1751 AromaticContact CD2-CG 3.99Å; F1700-F1751 HydrophobicContact CD2-CG 3.99Å; F1700-F1751 HydrophobicContact CE2-CB 3.44Å; F1700-F1751 VanDerWaalsContact CE2-CB 3.44Å; F1700-F1751 AromaticContact CE2-CD1 3.95Å; F1700-F1751 HydrophobicContact CE2-CD1 3.95Å; F1700-F1751 AromaticContact CE2-CD2 3.73Å; F1700-F1751 HydrophobicContact CE2-CD2 3.73Å; F1700-F1751 HydrophobicContact CE2-CE2 4.45Å; F1700-F1751 AromaticContact CE2-CG 3.44Å; F1700-F1751 HydrophobicContact CE2-CG 3.44Å; F1700-F1751 VanDerWaalsContact CE2-CG 3.44Å; F1700-F1751 HydrophobicContact CZ-CB 3.66Å; F1700-F1751 HydrophobicContact CZ-CG 4.19Å
1701	Y	50.1	Low	51.6	Low	70 Å²	70	60.1 Å²	60.1	28%	0.275	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-13.6	-172.7	-51.1	-52.6	0	0	0	114.6	Y1616 R1617 V1619 Q1699	Y1616-Y1701 CarbonylContact C-O 3.56Å; R1617-Y1701 VanDerWaalsContact C-CG 3.5Å; R1617-Y1701 WeakPolarHBondContact O-CB 3.43Å; R1617-Y1701 WeakPolarHBondContact O-CD1 3.17Å; R1617-Y1701 WeakPolarHBondContact O-CE1 3.35Å; V1619-Y1701 VanDerWaalsContact CB-OH 3.28Å; V1619-Y1701 WeakPolarHBondContact CB-OH 3.48Å; V1619-Y1701 HydrophobicContact CG2-CE1 4.09Å; V1619-Y1701 WeakPolarHBondContact CG2-OH 3.24Å; Q1699-Y1701 PolarHBondContact O-N 3.33Å
1702	L	49.6	Very low	51	Low	11 Å²	11	55.2 Å²	55.2	6%	0.058	32%	0.318	C	S	.	.	S	Bend	trans	-77.7	-13.8	169.1	-109.7	91.9	0	0	0	112.4	M1615 F1672 F1696 Q1699 A1705 L1706	M1615-L1702 HydrophobicContact CE-CD1 3.38Å; M1615-L1702 HydrophobicContact CE-CD2 4.2Å; M1615-L1702 HydrophobicContact CE-CG 3.71Å; M1615-L1702 HydrophobicContact SD-CD1 4.35Å; F1672-L1702 HydrophobicContact CB-CD2 4.29Å; F1672-L1702 HydrophobicContact CD1-CD2 4.4Å; F1672-L1702 HydrophobicContact CD2-CD2 3.38Å; F1672-L1702 HydrophobicContact CE2-CD2 3.69Å; F1672-L1702 HydrophobicContact CG-CD2 3.79Å; F1672-L1702 HydrophobicContact CZ-CD2 4.31Å; F1696-L1702 HydrophobicContact CD1-CB 4.22Å; F1696-L1702 HydrophobicContact CD1-CD1 4.14Å; F1696-L1702 HydrophobicContact CD1-CD2 3.61Å; F1696-L1702 HydrophobicContact CD1-CG 4.19Å; F1696-L1702 HydrophobicContact CE1-CD1 3.79Å; F1696-L1702 HydrophobicContact CE1-CD2 3.49Å; F1696-L1702 VanDerWaalsContact CE1-CD2 3.49Å; F1696-L1702 HydrophobicContact CE1-CG 4.15Å; F1696-L1702 HydrophobicContact CZ-CD2 4.34Å; Q1699-L1702 PolarHBondContact O-N 3.3Å; Q1699-L1702 VanDerWaalsContact O-N 3.11Å; L1702-A1705 WeakPolarHBondContact O-CA 3.49Å; L1702-A1705 WeakPolarHBondContact O-CB 3.41Å; L1702-A1705 PolarHBondContact O-N 2.84Å; L1702-L1706 PolarHBondContact O-N 2.9Å
1703	F	50.2	Low	50.3	Low	17 Å²	17	56.7 Å²	56.7	8%	0.075	33%	0.332	C	S	.	.	H	α-helix	trans	-72.2	-34.4	-172.8	-159.9	-101.2	0	0	0	113.4	A1705 L1706 V1707 I1740 F1741 V1744	F1703-A1705 PolarHBondContact O-N 3.46Å; F1703-L1706 HydrophobicContact CD2-CB 4.21Å; F1703-L1706 HydrophobicContact CD2-CD1 3.99Å; F1703-L1706 HydrophobicContact CE2-CB 4.39Å; F1703-L1706 HydrophobicContact CE2-CD1 4.48Å; F1703-L1706 CarbonylContact O-C 3.43Å; F1703-L1706 PolarHBondContact O-N 3.44Å; F1703-L1706 VanDerWaalsContact O-N 3.09Å; F1703-V1707 HydrophobicContact CD1-CG2 3.61Å; F1703-V1707 HydrophobicContact CE1-CG2 3.22Å; F1703-V1707 HydrophobicContact CG-CG2 4.5Å; F1703-V1707 HydrophobicContact CZ-CG2 3.87Å; F1703-V1707 WeakPolarHBondContact O-CG2 3.43Å; F1703-V1707 PolarHBondContact O-N 3.15Å; F1703-I1740 HydrophobicContact CD2-CG2 4.27Å; F1703-I1740 HydrophobicContact CE2-CB 4.3Å; F1703-I1740 HydrophobicContact CE2-CG2 3.48Å; F1703-I1740 VanDerWaalsContact CE2-CG2 3.48Å; F1703-I1740 HydrophobicContact CZ-CB 4.5Å; F1703-I1740 HydrophobicContact CZ-CG2 4.1Å; F1703-F1741 HydrophobicContact CD1-CD2 4.07Å; F1703-F1741 HydrophobicContact CE1-CB 3.7Å; F1703-F1741 AromaticContact CE1-CD2 3.63Å; F1703-F1741 HydrophobicContact CE1-CD2 3.63Å; F1703-F1741 HydrophobicContact CE1-CG 4.14Å; F1703-F1741 HydrophobicContact CZ-CB 3.96Å; F1703-V1744 HydrophobicContact CB-CG1 3.92Å; F1703-V1744 HydrophobicContact CD1-CG1 4.33Å; F1703-V1744 HydrophobicContact CD2-CG2 3.89Å; F1703-V1744 HydrophobicContact CE2-CG2 4.35Å; F1703-V1744 HydrophobicContact CG-CB 4.34Å; F1703-V1744 HydrophobicContact CG-CG1 4.01Å; F1703-V1744 HydrophobicContact CG-CG2 4.1Å
1704	D	46.6	Very low	49.4	Very low	117 Å²	117	60.2 Å²	60.2	63%	0.626	35%	0.345	S	S	*	.	H	α-helix	trans	-61.1	-28.3	169.5	-82.8	-7.7	0	0	0	111.6	A1708	D1704-A1708 WeakPolarHBondContact O-CB 3.33Å; D1704-A1708 PolarHBondContact O-N 2.79Å
1705	A	48.1	Very low	48.3	Very low	1 Å²	1	58.5 Å²	58.5	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-70	-44.5	172.1	0	0	0	0	0	111.9	M1615 F1672 L1702 F1703 V1707 A1708 L1709	M1615-A1705 VanDerWaalsContact N-CB 3.31Å; F1672-A1705 HydrophobicContact CD1-CB 4.49Å; F1672-A1705 HydrophobicContact CE1-CB 4.1Å; L1702-A1705 WeakPolarHBondContact O-CA 3.49Å; L1702-A1705 WeakPolarHBondContact O-CB 3.41Å; L1702-A1705 PolarHBondContact O-N 2.84Å; F1703-A1705 PolarHBondContact O-N 3.46Å; A1705-V1707 VanDerWaalsContact C-N 3.3Å; A1705-V1707 PolarHBondContact O-N 3.42Å; A1705-A1708 PolarHBondContact O-N 3.11Å; A1705-L1709 WeakPolarHBondContact O-CB 3.27Å; A1705-L1709 VanDerWaalsContact O-CG 3.29Å; A1705-L1709 WeakPolarHBondContact O-CG 3.27Å; A1705-L1709 PolarHBondContact O-N 2.87Å
1706	L	48.5	Very low	47.4	Very low	73 Å²	73	57.2 Å²	57.2	38%	0.382	33%	0.327	S	S	.	.	H	α-helix	trans	-65.9	-31.9	175.8	-72.5	162.5	0	0	0	112.1	F1672 L1702 F1703 L1709	F1672-L1706 HydrophobicContact CZ-CD2 4.45Å; L1702-L1706 PolarHBondContact O-N 2.9Å; F1703-L1706 HydrophobicContact CD2-CB 4.21Å; F1703-L1706 HydrophobicContact CD2-CD1 3.99Å; F1703-L1706 HydrophobicContact CE2-CB 4.39Å; F1703-L1706 HydrophobicContact CE2-CD1 4.48Å; F1703-L1706 CarbonylContact O-C 3.43Å; F1703-L1706 PolarHBondContact O-N 3.44Å; F1703-L1706 VanDerWaalsContact O-N 3.09Å; L1706-L1709 HydrophobicContact CD2-CD1 4.43Å
1707	V	45	Very low	46.3	Very low	64 Å²	64	57.7 Å²	57.7	39%	0.388	33%	0.331	S	S	.	.	H	α-helix	trans	-78.9	-37.1	174.8	176.1	0	0	0	0	111.6	F1703 A1705 L1709 N1710	F1703-V1707 HydrophobicContact CD1-CG2 3.61Å; F1703-V1707 HydrophobicContact CE1-CG2 3.22Å; F1703-V1707 HydrophobicContact CG-CG2 4.5Å; F1703-V1707 HydrophobicContact CZ-CG2 3.87Å; F1703-V1707 WeakPolarHBondContact O-CG2 3.43Å; F1703-V1707 PolarHBondContact O-N 3.15Å; A1705-V1707 VanDerWaalsContact C-N 3.3Å; A1705-V1707 PolarHBondContact O-N 3.42Å; V1707-L1709 VanDerWaalsContact C-N 3.27Å; V1707-L1709 PolarHBondContact O-N 3.27Å; V1707-N1710 WeakPolarHBondContact CA-ND2 3.17Å; V1707-N1710 VanDerWaalsContact O-CB 3.24Å; V1707-N1710 WeakPolarHBondContact O-CB 3.36Å; V1707-N1710 PolarHBondContact O-N 3.35Å; V1707-N1710 PolarHBondContact O-ND2 2.77Å
1708	A	47.2	Very low	45.4	Very low	67 Å²	67	59.7 Å²	59.7	55%	0.554	34%	0.337	S	S	*	.	H	α-helix	trans	-67.9	-25.8	173	0	0	0	0	0	112.8	D1704 A1705 N1710 G1711	D1704-A1708 WeakPolarHBondContact O-CB 3.33Å; D1704-A1708 PolarHBondContact O-N 2.79Å; A1705-A1708 PolarHBondContact O-N 3.11Å; A1708-N1710 PolarHBondContact O-N 3.38Å; A1708-G1711 PolarHBondContact O-N 2.77Å
1709	L	48.4	Very low	44.6	Very low	42 Å²	42	58.3 Å²	58.3	22%	0.22	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-12.9	168.1	-78.4	164.8	0	0	0	113.4	F1672 A1705 L1706 V1707 G1711 P1712 C1713	F1672-L1709 HydrophobicContact CE1-CD1 3.95Å; F1672-L1709 HydrophobicContact CZ-CD1 3.85Å; A1705-L1709 WeakPolarHBondContact O-CB 3.27Å; A1705-L1709 VanDerWaalsContact O-CG 3.29Å; A1705-L1709 WeakPolarHBondContact O-CG 3.27Å; A1705-L1709 PolarHBondContact O-N 2.87Å; L1706-L1709 HydrophobicContact CD2-CD1 4.43Å; V1707-L1709 VanDerWaalsContact C-N 3.27Å; V1707-L1709 PolarHBondContact O-N 3.27Å; L1709-G1711 PolarHBondContact O-N 3.34Å; L1709-P1712 WeakPolarHBondContact O-CD 3.41Å; L1709-C1713 PolarHBondContact O-N 2.84Å; L1709-C1713 PolarHBondContact O-SG 2.95Å; L1709-C1713 VanDerWaalsContact O-SG 3.38Å
1710	N	41.7	Very low	44	Very low	60 Å²	60	59.9 Å²	59.9	32%	0.321	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-1.5	163	-62.1	-69.3	0	0	0	113.2	V1707 A1708 K1714	V1707-N1710 WeakPolarHBondContact CA-ND2 3.17Å; V1707-N1710 VanDerWaalsContact O-CB 3.24Å; V1707-N1710 WeakPolarHBondContact O-CB 3.36Å; V1707-N1710 PolarHBondContact O-N 3.35Å; V1707-N1710 PolarHBondContact O-ND2 2.77Å; A1708-N1710 PolarHBondContact O-N 3.38Å; N1710-K1714 WeakPolarHBondContact O-CB 3.45Å; N1710-K1714 VanDerWaalsContact O-CG 3.23Å; N1710-K1714 WeakPolarHBondContact O-CG 3.34Å; N1710-K1714 PolarHBondContact O-N 2.83Å; N1710-K1714 VanDerWaalsContact O-N 3.08Å
1711	G	43.7	Very low	43.4	Very low	44 Å²	44	63.1 Å²	63.1	45%	0.454	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-64.8	168.7	0	0	0	0	0	110.5	A1708 L1709 C1713 K1714 G1715	A1708-G1711 PolarHBondContact O-N 2.77Å; L1709-G1711 PolarHBondContact O-N 3.34Å; G1711-C1713 PolarHBondContact O-N 2.88Å; G1711-K1714 PolarHBondContact O-N 2.97Å; G1711-G1715 PolarHBondContact O-N 3.35Å
1712	P	43.8	Very low	42.9	Very low	24 Å²	24	68.6 Å²	68.6	16%	0.156	39%	0.388	C	S	.	.	H	α-helix	trans	-48.7	-55.7	167.4	-27.6	33.3	0	0	0	112.2	Q1611 L1709 K1714 G1715 D1716	Q1611-P1712 HydrophobicContact CB-CG 4.43Å; L1709-P1712 WeakPolarHBondContact O-CD 3.41Å; P1712-K1714 PolarHBondContact O-N 2.95Å; P1712-G1715 CarbonylContact O-C 3.49Å; P1712-G1715 WeakPolarHBondContact O-CA 3.29Å; P1712-G1715 PolarHBondContact O-N 3.31Å; P1712-D1716 PolarHBondContact O-N 2.77Å
1713	C	38.5	Very low	42.5	Very low	72 Å²	72	73.6 Å²	73.6	49%	0.486	42%	0.415	S	S	.	.	H	α-helix	trans	-67.9	2.4	179.2	-47.9	0	0	0	0	115.1	L1709 G1711 L1717	L1709-C1713 PolarHBondContact O-N 2.84Å; L1709-C1713 PolarHBondContact O-SG 2.95Å; L1709-C1713 VanDerWaalsContact O-SG 3.38Å; G1711-C1713 PolarHBondContact O-N 2.88Å; C1713-L1717 WeakPolarHBondContact O-CB 3.44Å
1714	K	36.4	Very low	41.9	Very low	141 Å²	141	80.6 Å²	80.6	61%	0.613	45%	0.453	S	S	*	.	H	α-helix	trans	-103	-27.1	162.7	-89.6	-173.1	172.9	-169.4	0	112.9	N1710 G1711 P1712 F1718	N1710-K1714 WeakPolarHBondContact O-CB 3.45Å; N1710-K1714 VanDerWaalsContact O-CG 3.23Å; N1710-K1714 WeakPolarHBondContact O-CG 3.34Å; N1710-K1714 PolarHBondContact O-N 2.83Å; N1710-K1714 VanDerWaalsContact O-N 3.08Å; G1711-K1714 PolarHBondContact O-N 2.97Å; P1712-K1714 PolarHBondContact O-N 2.95Å; K1714-F1718 VanDerWaalsContact O-CB 3.23Å; K1714-F1718 WeakPolarHBondContact O-CB 3.38Å; K1714-F1718 WeakPolarHBondContact O-CD2 3.45Å; K1714-F1718 PolarHBondContact O-N 2.93Å
1715	G	37.2	Very low	41.7	Very low	36 Å²	36	85.2 Å²	85.2	37%	0.371	46%	0.461	S	S	.	.	H	α-helix	trans	-69.5	-52.1	170.3	0	0	0	0	0	110.2	G1711 P1712 L1717 F1718 A1719	G1711-G1715 PolarHBondContact O-N 3.35Å; P1712-G1715 CarbonylContact O-C 3.49Å; P1712-G1715 WeakPolarHBondContact O-CA 3.29Å; P1712-G1715 PolarHBondContact O-N 3.31Å; G1715-L1717 PolarHBondContact O-N 3.37Å; G1715-F1718 CarbonylContact O-C 3.53Å; G1715-F1718 WeakPolarHBondContact O-CA 3.42Å; G1715-F1718 WeakPolarHBondContact O-CB 3.32Å; G1715-F1718 PolarHBondContact O-N 3.38Å; G1715-A1719 PolarHBondContact O-N 2.81Å
1716	D	39.7	Very low	41.1	Very low	32 Å²	32	90.5 Å²	90.5	17%	0.171	50%	0.497	C	S	.	.	H	α-helix	trans	-59.2	-47.8	176	-48	-33.2	0	0	0	110.1	T1609 F1610 P1712 F1718 A1719 D1720	T1609-D1716 WeakPolarHBondContact CB-OD1 3.14Å; T1609-D1716 HydrophobicContact CG2-CB 4.46Å; F1610-D1716 WeakPolarHBondContact CB-OD1 3.5Å; P1712-D1716 PolarHBondContact O-N 2.77Å; D1716-F1718 VanDerWaalsContact C-N 3.26Å; D1716-F1718 PolarHBondContact O-N 2.75Å; D1716-A1719 WeakPolarHBondContact O-CA 3.48Å; D1716-A1719 WeakPolarHBondContact O-CB 3.45Å; D1716-A1719 PolarHBondContact O-N 2.99Å; D1716-D1720 PolarHBondContact O-N 2.83Å
1717	L	37.1	Very low	40.5	Very low	52 Å²	52	96 Å²	96	27%	0.272	52%	0.518	S	S	.	.	H	α-helix	trans	-67.9	-20.9	175	-164.3	80.9	0	0	0	113.3	C1713 G1715 L1721 F1730	C1713-L1717 WeakPolarHBondContact O-CB 3.44Å; G1715-L1717 PolarHBondContact O-N 3.37Å; L1717-L1721 HydrophobicContact CG-CD1 4.44Å; L1717-L1721 WeakPolarHBondContact O-CB 3.25Å; L1717-L1721 VanDerWaalsContact O-CD1 3.28Å; L1717-L1721 WeakPolarHBondContact O-CD1 3.42Å; L1717-L1721 WeakPolarHBondContact O-CG 3.47Å; L1717-L1721 PolarHBondContact O-N 3.45Å; L1717-F1730 HydrophobicContact CD1-CE1 4.29Å; L1717-F1730 HydrophobicContact CD1-CZ 4.29Å
1718	F	36.3	Very low	40.3	Very low	136 Å²	136	101 Å²	101	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-78.4	-30.3	170.8	-113.5	-87.8	0	0	0	111.7	K1714 G1715 D1716 F1722	K1714-F1718 VanDerWaalsContact O-CB 3.23Å; K1714-F1718 WeakPolarHBondContact O-CB 3.38Å; K1714-F1718 WeakPolarHBondContact O-CD2 3.45Å; K1714-F1718 PolarHBondContact O-N 2.93Å; G1715-F1718 CarbonylContact O-C 3.53Å; G1715-F1718 WeakPolarHBondContact O-CA 3.42Å; G1715-F1718 WeakPolarHBondContact O-CB 3.32Å; G1715-F1718 PolarHBondContact O-N 3.38Å; D1716-F1718 VanDerWaalsContact C-N 3.26Å; D1716-F1718 PolarHBondContact O-N 2.75Å; F1718-F1722 WeakPolarHBondContact O-CD2 3.35Å
1719	A	38.9	Very low	40	Very low	57 Å²	57	106 Å²	106	47%	0.471	55%	0.554	S	S	.	*	H	α-helix	trans	-69	-48.1	169.7	0	0	0	0	0	110.2	G1715 D1716 L1721 F1722	G1715-A1719 PolarHBondContact O-N 2.81Å; D1716-A1719 WeakPolarHBondContact O-CA 3.48Å; D1716-A1719 WeakPolarHBondContact O-CB 3.45Å; D1716-A1719 PolarHBondContact O-N 2.99Å; A1719-L1721 VanDerWaalsContact C-N 3.29Å; A1719-L1721 PolarHBondContact O-N 3.12Å; A1719-F1722 PolarHBondContact O-N 2.96Å
1720	D	42.6	Very low	39.6	Very low	103 Å²	103	109 Å²	109	55%	0.551	57%	0.565	S	S	*	*	H	α-helix	trans	-65.9	-26.9	176.6	-63.6	-22.4	0	0	0	113.2	D1716 F1722 D1723	D1716-D1720 PolarHBondContact O-N 2.83Å; D1720-F1722 PolarHBondContact O-N 3.31Å; D1720-D1723 PolarHBondContact O-N 2.97Å
1721	L	41.7	Very low	39.6	Very low	107 Å²	107	108.2 Å²	108.2	56%	0.56	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-9	178.2	-96.7	163.9	0	0	0	114	L1717 A1719	L1717-L1721 HydrophobicContact CG-CD1 4.44Å; L1717-L1721 WeakPolarHBondContact O-CB 3.25Å; L1717-L1721 VanDerWaalsContact O-CD1 3.28Å; L1717-L1721 WeakPolarHBondContact O-CD1 3.42Å; L1717-L1721 WeakPolarHBondContact O-CG 3.47Å; L1717-L1721 PolarHBondContact O-N 3.45Å; A1719-L1721 VanDerWaalsContact C-N 3.29Å; A1719-L1721 PolarHBondContact O-N 3.12Å
1722	F	40.5	Very low	39.8	Very low	185 Å²	185	108.2 Å²	108.2	81%	0.811	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	1.3	171.2	-82.5	-83.2	0	0	0	113.5	F1718 A1719 D1720	F1718-F1722 WeakPolarHBondContact O-CD2 3.35Å; A1719-F1722 PolarHBondContact O-N 2.96Å; D1720-F1722 PolarHBondContact O-N 3.31Å
1723	D	41.2	Very low	40	Very low	116 Å²	116	111.4 Å²	111.4	62%	0.62	59%	0.587	S	S	*	*	S	Bend	trans	-117.8	122.2	176.8	-150.5	-14.1	0	0	0	112.1	D1720 R1725	D1720-D1723 PolarHBondContact O-N 2.97Å; D1723-R1725 VanDerWaalsContact C-N 3.3Å; D1723-R1725 PolarHBondContact O-N 2.85Å
1724	D	37.2	Very low	40.6	Very low	163 Å²	163	115 Å²	115	87%	0.872	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	21.8	-143.1	-119.3	-17.1	0	0	0	116.5
1725	R	41.7	Very low	41.4	Very low	215 Å²	215	117.9 Å²	117.9	81%	0.811	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	-7.5	-160.5	-85.3	-176.6	-89.3	-162.7	-4.6	120.2	D1723	D1723-R1725 VanDerWaalsContact C-N 3.3Å; D1723-R1725 PolarHBondContact O-N 2.85Å
1726	C	34.8	Very low	42.3	Very low	111 Å²	111	118.4 Å²	118.4	75%	0.75	60%	0.599	S	S	*	*			trans	-120.2	61.8	-170.6	-80.6	0	0	0	0	116.4
1727	F	37.1	Very low	43	Very low	190 Å²	190	119.9 Å²	119.9	83%	0.833	61%	0.607	S	S	*	*			trans	-94.6	-13.1	-174.9	-140.4	-94.1	0	0	0	117.3
1728	L	40.9	Very low	44	Very low	167 Å²	167	126 Å²	126	87%	0.874	63%	0.626	S	S	*	*	S	Bend	trans	-97.8	-32.3	-169.8	-99.1	95.7	0	0	0	117.5
1729	E	41	Very low	45.2	Very low	174 Å²	174	121.8 Å²	121.8	81%	0.813	62%	0.617	S	S	*	*	S	Bend	trans	-83.4	-28.2	-172.2	-63.7	-160.8	141.5	0	0	114.4	G1731 G1732	E1729-G1731 PolarHBondContact O-N 3.28Å; E1729-G1731 VanDerWaalsContact O-N 3.11Å; E1729-G1732 PolarHBondContact O-N 3.38Å
1730	F	39.8	Very low	46.3	Very low	103 Å²	103	121.8 Å²	121.8	45%	0.452	61%	0.608	S	S	.	*	H	α-helix	trans	-69.9	-11.2	-173.8	-86.6	-86	0	0	0	115.4	L1717 G1732 L1733 K1734	L1717-F1730 HydrophobicContact CD1-CE1 4.29Å; L1717-F1730 HydrophobicContact CD1-CZ 4.29Å; F1730-G1732 PolarHBondContact O-N 2.95Å; F1730-L1733 HydrophobicContact CD1-CB 4.13Å; F1730-L1733 HydrophobicContact CD1-CD2 4.09Å; F1730-L1733 HydrophobicContact CE1-CD2 3.74Å; F1730-L1733 PolarHBondContact O-N 3.18Å; F1730-K1734 PolarHBondContact O-N 3.31Å
1731	G	42	Very low	47.2	Very low	44 Å²	44	120.6 Å²	120.6	45%	0.454	60%	0.598	S	S	.	*	H	α-helix	trans	-59.5	-30.2	164.7	0	0	0	0	0	112.5	E1729 R1735	E1729-G1731 PolarHBondContact O-N 3.28Å; E1729-G1731 VanDerWaalsContact O-N 3.11Å; G1731-R1735 WeakPolarHBondContact O-CB 3.02Å; G1731-R1735 WeakPolarHBondContact O-CD 3.03Å; G1731-R1735 VanDerWaalsContact O-CG 3.24Å; G1731-R1735 WeakPolarHBondContact O-CG 3.24Å; G1731-R1735 PolarHBondContact O-N 2.88Å
1732	G	46.7	Very low	48.2	Very low	45 Å²	45	117.7 Å²	117.7	46%	0.464	59%	0.59	S	S	.	*	H	α-helix	trans	-71.5	-48.7	173.6	0	0	0	0	0	112.9	E1729 F1730 R1735 S1736	E1729-G1732 PolarHBondContact O-N 3.38Å; F1730-G1732 PolarHBondContact O-N 2.95Å; G1732-R1735 CarbonylContact O-C 3.46Å; G1732-R1735 PolarHBondContact O-N 2.83Å; G1732-S1736 PolarHBondContact O-N 3.42Å
1733	L	48	Very low	49.4	Very low	90 Å²	90	113.9 Å²	113.9	47%	0.471	58%	0.577	S	S	.	*	H	α-helix	trans	-69.5	-39	-174.6	-158.6	78.4	0	0	0	113	F1730 R1735 S1736 L1737	F1730-L1733 HydrophobicContact CD1-CB 4.13Å; F1730-L1733 HydrophobicContact CD1-CD2 4.09Å; F1730-L1733 HydrophobicContact CE1-CD2 3.74Å; F1730-L1733 PolarHBondContact O-N 3.18Å; L1733-R1735 VanDerWaalsContact C-N 3.3Å; L1733-R1735 PolarHBondContact O-N 3.05Å; L1733-S1736 WeakPolarHBondContact CA-OG 3.16Å; L1733-S1736 PolarHBondContact O-N 2.89Å; L1733-S1736 PolarHBondContact O-OG 3.41Å; L1733-S1736 VanDerWaalsContact O-OG 3.07Å; L1733-L1737 HydrophobicContact CD2-CD1 4.49Å; L1733-L1737 HydrophobicContact CG-CD1 4.27Å; L1733-L1737 WeakPolarHBondContact O-CB 3.47Å; L1733-L1737 WeakPolarHBondContact O-CG 3.23Å; L1733-L1737 PolarHBondContact O-N 3.49Å
1734	K	50.6	Low	50.4	Low	148 Å²	148	109.1 Å²	109.1	64%	0.643	55%	0.552	S	S	*	*	H	α-helix	trans	-60.3	-41.5	170.6	-89.5	174.7	179.2	162.3	0	111.3	F1730 W1738	F1730-K1734 PolarHBondContact O-N 3.31Å; K1734-W1738 WeakPolarHBondContact O-CB 3.39Å; K1734-W1738 VanDerWaalsContact O-CD1 3.29Å; K1734-W1738 PolarHBondContact O-N 3.19Å
1735	R	53.9	Low	51.5	Low	201 Å²	201	105.8 Å²	105.8	76%	0.758	53%	0.533	S	S	*	.	H	α-helix	trans	-68.5	-39.9	177.1	-76	176	179.8	173.8	1.8	112.3	G1731 G1732 L1733 W1738 A1739	G1731-R1735 WeakPolarHBondContact O-CB 3.02Å; G1731-R1735 WeakPolarHBondContact O-CD 3.03Å; G1731-R1735 VanDerWaalsContact O-CG 3.24Å; G1731-R1735 WeakPolarHBondContact O-CG 3.24Å; G1731-R1735 PolarHBondContact O-N 2.88Å; G1732-R1735 CarbonylContact O-C 3.46Å; G1732-R1735 PolarHBondContact O-N 2.83Å; L1733-R1735 VanDerWaalsContact C-N 3.3Å; L1733-R1735 PolarHBondContact O-N 3.05Å; R1735-W1738 PolarHBondContact O-N 3.45Å; R1735-A1739 VanDerWaalsContact O-CB 3.24Å; R1735-A1739 WeakPolarHBondContact O-CB 3.31Å; R1735-A1739 PolarHBondContact O-N 3.06Å
1736	S	56.5	Low	52.6	Low	48 Å²	48	101.6 Å²	101.6	34%	0.336	52%	0.524	S	S	.	.	H	α-helix	trans	-69.2	-41.3	178.7	70.6	0	0	0	0	111.8	G1732 L1733 A1739 I1740	G1732-S1736 PolarHBondContact O-N 3.42Å; L1733-S1736 WeakPolarHBondContact CA-OG 3.16Å; L1733-S1736 PolarHBondContact O-N 2.89Å; L1733-S1736 PolarHBondContact O-OG 3.41Å; L1733-S1736 VanDerWaalsContact O-OG 3.07Å; S1736-A1739 CarbonylContact O-C 3.53Å; S1736-A1739 WeakPolarHBondContact O-CB 3.35Å; S1736-A1739 PolarHBondContact O-N 3.45Å; S1736-I1740 VanDerWaalsContact O-CG1 3.26Å; S1736-I1740 WeakPolarHBondContact O-CG1 3.43Å; S1736-I1740 PolarHBondContact O-N 3.48Å
1737	L	54.5	Low	54	Low	63 Å²	63	97.3 Å²	97.3	33%	0.33	50%	0.498	S	S	.	.	H	α-helix	trans	-66.3	-38.6	174	-71.9	169.8	0	0	0	112.4	L1733 A1739 I1740 F1741	L1733-L1737 HydrophobicContact CD2-CD1 4.49Å; L1733-L1737 HydrophobicContact CG-CD1 4.27Å; L1733-L1737 WeakPolarHBondContact O-CB 3.47Å; L1733-L1737 WeakPolarHBondContact O-CG 3.23Å; L1733-L1737 PolarHBondContact O-N 3.49Å; L1737-A1739 VanDerWaalsContact C-N 3.35Å; L1737-I1740 PolarHBondContact O-N 3.3Å; L1737-F1741 WeakPolarHBondContact O-CB 3.39Å; L1737-F1741 PolarHBondContact O-N 3.32Å
1738	W	58.8	Low	55.2	Low	179 Å²	179	89.7 Å²	89.7	68%	0.678	47%	0.47	S	S	*	.	H	α-helix	trans	-67.8	-32.1	170.5	-90.7	92.5	0	0	0	112.9	K1734 R1735 F1741 A1742	K1734-W1738 WeakPolarHBondContact O-CB 3.39Å; K1734-W1738 VanDerWaalsContact O-CD1 3.29Å; K1734-W1738 PolarHBondContact O-N 3.19Å; R1735-W1738 PolarHBondContact O-N 3.45Å; W1738-F1741 AromaticContact CE3-CD1 3.78Å; W1738-F1741 HydrophobicContact CE3-CD1 3.78Å; W1738-F1741 HydrophobicContact CE3-CE1 4.31Å; W1738-F1741 HydrophobicContact CH2-CE1 4.46Å; W1738-F1741 AromaticContact CZ3-CD1 3.77Å; W1738-F1741 HydrophobicContact CZ3-CD1 3.77Å; W1738-F1741 AromaticContact CZ3-CE1 3.82Å; W1738-F1741 HydrophobicContact CZ3-CE1 3.82Å; W1738-F1741 PolarHBondContact O-N 3.08Å; W1738-A1742 VanDerWaalsContact O-CB 3.29Å; W1738-A1742 WeakPolarHBondContact O-CB 3.09Å; W1738-A1742 PolarHBondContact O-N 3.32Å
1739	A	61.7	Low	56.3	Low	48 Å²	48	85.9 Å²	85.9	40%	0.397	45%	0.454	S	S	.	.	H	α-helix	trans	-71.3	-38	173.6	0	0	0	0	0	111.8	R1735 S1736 L1737 A1742 L1743	R1735-A1739 VanDerWaalsContact O-CB 3.24Å; R1735-A1739 WeakPolarHBondContact O-CB 3.31Å; R1735-A1739 PolarHBondContact O-N 3.06Å; S1736-A1739 CarbonylContact O-C 3.53Å; S1736-A1739 WeakPolarHBondContact O-CB 3.35Å; S1736-A1739 PolarHBondContact O-N 3.45Å; L1737-A1739 VanDerWaalsContact C-N 3.35Å; A1739-A1742 PolarHBondContact O-N 2.95Å; A1739-L1743 WeakPolarHBondContact O-CB 3.04Å; A1739-L1743 VanDerWaalsContact O-CG 3.3Å; A1739-L1743 WeakPolarHBondContact O-CG 3.03Å; A1739-L1743 PolarHBondContact O-N 3.21Å
1740	I	61.9	Low	57.4	Low	57 Å²	57	80.4 Å²	80.4	29%	0.292	44%	0.439	S	S	.	.	H	α-helix	trans	-67.3	-42.1	172	-62.3	161.3	0	0	0	109.6	F1703 S1736 L1737 A1742 L1743 V1744	F1703-I1740 HydrophobicContact CD2-CG2 4.27Å; F1703-I1740 HydrophobicContact CE2-CB 4.3Å; F1703-I1740 HydrophobicContact CE2-CG2 3.48Å; F1703-I1740 VanDerWaalsContact CE2-CG2 3.48Å; F1703-I1740 HydrophobicContact CZ-CB 4.5Å; F1703-I1740 HydrophobicContact CZ-CG2 4.1Å; S1736-I1740 VanDerWaalsContact O-CG1 3.26Å; S1736-I1740 WeakPolarHBondContact O-CG1 3.43Å; S1736-I1740 PolarHBondContact O-N 3.48Å; L1737-I1740 PolarHBondContact O-N 3.3Å; I1740-A1742 VanDerWaalsContact C-N 3.34Å; I1740-A1742 PolarHBondContact O-N 3.37Å; I1740-L1743 PolarHBondContact O-N 3.26Å; I1740-V1744 HydrophobicContact CG2-CG2 4.21Å; I1740-V1744 WeakPolarHBondContact O-CB 3.45Å; I1740-V1744 VanDerWaalsContact O-CG2 3.27Å; I1740-V1744 WeakPolarHBondContact O-CG2 3.48Å; I1740-V1744 PolarHBondContact O-N 2.85Å
1741	F	60.5	Low	58.5	Low	78 Å²	78	78.6 Å²	78.6	34%	0.342	43%	0.431	S	S	.	.	H	α-helix	trans	-59.3	-44.3	171.8	175.9	-114.8	0	0	0	111.6	F1703 L1737 W1738 V1744 M1745	F1703-F1741 HydrophobicContact CD1-CD2 4.07Å; F1703-F1741 HydrophobicContact CE1-CB 3.7Å; F1703-F1741 AromaticContact CE1-CD2 3.63Å; F1703-F1741 HydrophobicContact CE1-CD2 3.63Å; F1703-F1741 HydrophobicContact CE1-CG 4.14Å; F1703-F1741 HydrophobicContact CZ-CB 3.96Å; L1737-F1741 WeakPolarHBondContact O-CB 3.39Å; L1737-F1741 PolarHBondContact O-N 3.32Å; W1738-F1741 AromaticContact CE3-CD1 3.78Å; W1738-F1741 HydrophobicContact CE3-CD1 3.78Å; W1738-F1741 HydrophobicContact CE3-CE1 4.31Å; W1738-F1741 HydrophobicContact CH2-CE1 4.46Å; W1738-F1741 AromaticContact CZ3-CD1 3.77Å; W1738-F1741 HydrophobicContact CZ3-CD1 3.77Å; W1738-F1741 AromaticContact CZ3-CE1 3.82Å; W1738-F1741 HydrophobicContact CZ3-CE1 3.82Å; W1738-F1741 PolarHBondContact O-N 3.08Å; F1741-V1744 PolarHBondContact O-N 3.29Å; F1741-M1745 HydrophobicContact CD1-CG 4.48Å; F1741-M1745 HydrophobicContact CD2-CG 3.98Å; F1741-M1745 HydrophobicContact CE1-CG 4.15Å; F1741-M1745 HydrophobicContact CE2-CG 3.63Å; F1741-M1745 HydrophobicContact CE2-SD 4.02Å; F1741-M1745 HydrophobicContact CG-CG 4.41Å; F1741-M1745 HydrophobicContact CZ-CG 3.73Å; F1741-M1745 HydrophobicContact CZ-SD 4.2Å; F1741-M1745 VanDerWaalsContact O-CB 3.32Å; F1741-M1745 WeakPolarHBondContact O-CB 3.4Å; F1741-M1745 VanDerWaalsContact O-CG 3.24Å; F1741-M1745 WeakPolarHBondContact O-CG 3.37Å; F1741-M1745 PolarHBondContact O-N 3.38Å
1742	A	63.7	Low	59.2	Low	46 Å²	46	78.6 Å²	78.6	38%	0.38	42%	0.422	S	S	.	.	H	α-helix	trans	-62.3	-43.4	175.2	0	0	0	0	0	111.8	W1738 A1739 I1740 M1745 M1746	W1738-A1742 VanDerWaalsContact O-CB 3.29Å; W1738-A1742 WeakPolarHBondContact O-CB 3.09Å; W1738-A1742 PolarHBondContact O-N 3.32Å; A1739-A1742 PolarHBondContact O-N 2.95Å; I1740-A1742 VanDerWaalsContact C-N 3.34Å; I1740-A1742 PolarHBondContact O-N 3.37Å; A1742-M1745 PolarHBondContact O-N 2.84Å; A1742-M1746 WeakPolarHBondContact O-CB 3.39Å; A1742-M1746 VanDerWaalsContact O-CG 3.23Å; A1742-M1746 WeakPolarHBondContact O-CG 3.38Å; A1742-M1746 PolarHBondContact O-N 3.05Å
1743	L	65.4	Low	60	Low	105 Å²	105	80.7 Å²	80.7	55%	0.55	43%	0.426	S	S	.	.	H	α-helix	trans	-64.7	-39.3	175	-77.7	166.4	0	0	0	112.6	A1739 I1740 G1747	A1739-L1743 WeakPolarHBondContact O-CB 3.04Å; A1739-L1743 VanDerWaalsContact O-CG 3.3Å; A1739-L1743 WeakPolarHBondContact O-CG 3.03Å; A1739-L1743 PolarHBondContact O-N 3.21Å; I1740-L1743 PolarHBondContact O-N 3.26Å; L1743-G1747 PolarHBondContact O-N 3.42Å
1744	V	60.8	Low	60.6	Low	16 Å²	16	80.7 Å²	80.7	10%	0.097	43%	0.425	C	S	.	.	H	α-helix	trans	-69.4	-38.5	175.8	169.1	0	0	0	0	110.7	F1700 F1703 I1740 F1741 G1747 A1748	F1700-V1744 HydrophobicContact CD1-CG1 4.35Å; F1703-V1744 HydrophobicContact CB-CG1 3.92Å; F1703-V1744 HydrophobicContact CD1-CG1 4.33Å; F1703-V1744 HydrophobicContact CD2-CG2 3.89Å; F1703-V1744 HydrophobicContact CE2-CG2 4.35Å; F1703-V1744 HydrophobicContact CG-CB 4.34Å; F1703-V1744 HydrophobicContact CG-CG1 4.01Å; F1703-V1744 HydrophobicContact CG-CG2 4.1Å; I1740-V1744 HydrophobicContact CG2-CG2 4.21Å; I1740-V1744 WeakPolarHBondContact O-CB 3.45Å; I1740-V1744 VanDerWaalsContact O-CG2 3.27Å; I1740-V1744 WeakPolarHBondContact O-CG2 3.48Å; I1740-V1744 PolarHBondContact O-N 2.85Å; F1741-V1744 PolarHBondContact O-N 3.29Å; V1744-G1747 CarbonylContact O-C 3.56Å; V1744-G1747 PolarHBondContact O-N 3.4Å; V1744-A1748 VanDerWaalsContact O-CB 3.3Å; V1744-A1748 WeakPolarHBondContact O-CB 3.32Å; V1744-A1748 PolarHBondContact O-N 2.87Å
1745	M	60.7	Low	60.8	Low	93 Å²	93	76.7 Å²	76.7	46%	0.458	41%	0.411	S	S	.	.	H	α-helix	trans	-69.3	-42	173.9	-72.8	-63.7	-71.9	0	0	111.7	F1741 A1742 G1747 A1748 T1749	F1741-M1745 HydrophobicContact CD1-CG 4.48Å; F1741-M1745 HydrophobicContact CD2-CG 3.98Å; F1741-M1745 HydrophobicContact CE1-CG 4.15Å; F1741-M1745 HydrophobicContact CE2-CG 3.63Å; F1741-M1745 HydrophobicContact CE2-SD 4.02Å; F1741-M1745 HydrophobicContact CG-CG 4.41Å; F1741-M1745 HydrophobicContact CZ-CG 3.73Å; F1741-M1745 HydrophobicContact CZ-SD 4.2Å; F1741-M1745 VanDerWaalsContact O-CB 3.32Å; F1741-M1745 WeakPolarHBondContact O-CB 3.4Å; F1741-M1745 VanDerWaalsContact O-CG 3.24Å; F1741-M1745 WeakPolarHBondContact O-CG 3.37Å; F1741-M1745 PolarHBondContact O-N 3.38Å; A1742-M1745 PolarHBondContact O-N 2.84Å; M1745-G1747 VanDerWaalsContact C-N 3.33Å; M1745-G1747 PolarHBondContact O-N 3.49Å; M1745-A1748 PolarHBondContact O-N 2.96Å; M1745-T1749 WeakPolarHBondContact O-CG2 3.32Å; M1745-T1749 PolarHBondContact O-N 2.99Å
1746	M	64.7	Low	60.8	Low	127 Å²	127	67.8 Å²	67.8	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-59.9	-45	170.2	-74.6	178.2	77.7	0	0	110.4	A1742 A1748 T1749 A1750	A1742-M1746 WeakPolarHBondContact O-CB 3.39Å; A1742-M1746 VanDerWaalsContact O-CG 3.23Å; A1742-M1746 WeakPolarHBondContact O-CG 3.38Å; A1742-M1746 PolarHBondContact O-N 3.05Å; M1746-A1748 VanDerWaalsContact C-N 3.34Å; M1746-A1748 PolarHBondContact O-N 3.36Å; M1746-T1749 PolarHBondContact O-N 3.11Å; M1746-T1749 PolarHBondContact O-OG1 3.34Å; M1746-A1750 WeakPolarHBondContact O-CB 3.37Å; M1746-A1750 PolarHBondContact O-N 2.85Å
1747	G	65.1	Low	60.8	Low	21 Å²	21	68.1 Å²	68.1	22%	0.216	38%	0.38	C	S	.	.	H	α-helix	trans	-60.6	-39.3	173.5	0	0	0	0	0	112.7	F1700 L1743 V1744 M1745 A1750 F1751	F1700-G1747 WeakPolarHBondContact CE1-O 3.38Å; F1700-G1747 VanDerWaalsContact CZ-O 3.31Å; F1700-G1747 WeakPolarHBondContact CZ-O 3.2Å; L1743-G1747 PolarHBondContact O-N 3.42Å; V1744-G1747 CarbonylContact O-C 3.56Å; V1744-G1747 PolarHBondContact O-N 3.4Å; M1745-G1747 VanDerWaalsContact C-N 3.33Å; M1745-G1747 PolarHBondContact O-N 3.49Å; G1747-A1750 CarbonylContact O-C 3.49Å; G1747-A1750 WeakPolarHBondContact O-CB 3.16Å; G1747-A1750 PolarHBondContact O-N 3.33Å; G1747-F1751 WeakPolarHBondContact O-CB 3.15Å; G1747-F1751 PolarHBondContact O-N 3.49Å
1748	A	61.3	Low	60.6	Low	30 Å²	30	70.5 Å²	70.5	25%	0.248	39%	0.389	C	S	.	.	H	α-helix	trans	-68.9	-38	176.6	0	0	0	0	0	111.1	F1700 V1744 M1745 M1746 F1751 V1752	F1700-A1748 HydrophobicContact CD1-CB 3.95Å; F1700-A1748 HydrophobicContact CE1-CB 4.35Å; F1700-A1748 VanDerWaalsContact CE1-N 3.29Å; V1744-A1748 VanDerWaalsContact O-CB 3.3Å; V1744-A1748 WeakPolarHBondContact O-CB 3.32Å; V1744-A1748 PolarHBondContact O-N 2.87Å; M1745-A1748 PolarHBondContact O-N 2.96Å; M1746-A1748 VanDerWaalsContact C-N 3.34Å; M1746-A1748 PolarHBondContact O-N 3.36Å; A1748-F1751 PolarHBondContact O-N 3.33Å; A1748-V1752 WeakPolarHBondContact O-CG2 3.34Å; A1748-V1752 PolarHBondContact O-N 3.5Å
1749	T	64.1	Low	60.3	Low	87 Å²	87	65.1 Å²	65.1	53%	0.534	37%	0.374	S	S	.	.	H	α-helix	trans	-65.4	-40.4	169.3	65.8	0	0	0	0	111.5	M1745 M1746 F1751 V1752 V1753	M1745-T1749 WeakPolarHBondContact O-CG2 3.32Å; M1745-T1749 PolarHBondContact O-N 2.99Å; M1746-T1749 PolarHBondContact O-N 3.11Å; M1746-T1749 PolarHBondContact O-OG1 3.34Å; T1749-F1751 VanDerWaalsContact C-N 3.27Å; T1749-F1751 PolarHBondContact O-N 3.45Å; T1749-V1752 PolarHBondContact O-N 3.01Å; T1749-V1753 WeakPolarHBondContact O-CG2 3.27Å; T1749-V1753 PolarHBondContact O-N 3.24Å
1750	A	65.3	Low	59.8	Low	59 Å²	59	69.7 Å²	69.7	49%	0.488	39%	0.387	S	S	.	.	H	α-helix	trans	-64.9	-29.9	173.8	0	0	0	0	0	112.2	M1746 G1747 V1753 L1754	M1746-A1750 WeakPolarHBondContact O-CB 3.37Å; M1746-A1750 PolarHBondContact O-N 2.85Å; G1747-A1750 CarbonylContact O-C 3.49Å; G1747-A1750 WeakPolarHBondContact O-CB 3.16Å; G1747-A1750 PolarHBondContact O-N 3.33Å; A1750-V1753 CarbonylContact O-C 3.59Å; A1750-L1754 VanDerWaalsContact O-CB 3.3Å; A1750-L1754 WeakPolarHBondContact O-CB 3.18Å; A1750-L1754 PolarHBondContact O-N 2.79Å
1751	F	62.4	Low	59.1	Low	66 Å²	66	70 Å²	70	29%	0.289	39%	0.387	S	S	.	.	H	α-helix	trans	-78.4	-34.1	173.7	-175.6	-110.6	0	0	0	112.5	F1700 G1747 A1748 T1749 V1753 L1754 I1755	F1700-F1751 HydrophobicContact CD2-CB 4.2Å; F1700-F1751 HydrophobicContact CD2-CD1 4.01Å; F1700-F1751 HydrophobicContact CD2-CD2 4.48Å; F1700-F1751 AromaticContact CD2-CG 3.99Å; F1700-F1751 HydrophobicContact CD2-CG 3.99Å; F1700-F1751 HydrophobicContact CE2-CB 3.44Å; F1700-F1751 VanDerWaalsContact CE2-CB 3.44Å; F1700-F1751 AromaticContact CE2-CD1 3.95Å; F1700-F1751 HydrophobicContact CE2-CD1 3.95Å; F1700-F1751 AromaticContact CE2-CD2 3.73Å; F1700-F1751 HydrophobicContact CE2-CD2 3.73Å; F1700-F1751 HydrophobicContact CE2-CE2 4.45Å; F1700-F1751 AromaticContact CE2-CG 3.44Å; F1700-F1751 HydrophobicContact CE2-CG 3.44Å; F1700-F1751 VanDerWaalsContact CE2-CG 3.44Å; F1700-F1751 HydrophobicContact CZ-CB 3.66Å; F1700-F1751 HydrophobicContact CZ-CG 4.19Å; G1747-F1751 WeakPolarHBondContact O-CB 3.15Å; G1747-F1751 PolarHBondContact O-N 3.49Å; A1748-F1751 PolarHBondContact O-N 3.33Å; T1749-F1751 VanDerWaalsContact C-N 3.27Å; T1749-F1751 PolarHBondContact O-N 3.45Å; F1751-V1753 VanDerWaalsContact C-N 3.33Å; F1751-L1754 HydrophobicContact CD2-CB 4.48Å; F1751-L1754 HydrophobicContact CD2-CD2 4.02Å; F1751-L1754 HydrophobicContact CE2-CD2 4.37Å; F1751-L1754 CarbonylContact O-C 3.44Å; F1751-L1754 WeakPolarHBondContact O-CB 3.48Å; F1751-L1754 PolarHBondContact O-N 3.35Å; F1751-I1755 HydrophobicContact CD1-CD1 3.86Å; F1751-I1755 HydrophobicContact CE1-CD1 3.52Å; F1751-I1755 HydrophobicContact CE1-CG1 4.29Å; F1751-I1755 HydrophobicContact CZ-CD1 3.98Å; F1751-I1755 HydrophobicContact CZ-CG1 4.34Å; F1751-I1755 WeakPolarHBondContact O-CB 3.38Å; F1751-I1755 WeakPolarHBondContact O-CG1 3.33Å; F1751-I1755 PolarHBondContact O-N 3.27Å
1752	V	57.5	Low	58.3	Low	43 Å²	43	69.5 Å²	69.5	26%	0.261	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-41.3	167	167	0	0	0	0	110.5	S1641 A1748 T1749 I1755 A1756	S1641-V1752 VanDerWaalsContact OG-CG1 3.26Å; S1641-V1752 WeakPolarHBondContact OG-CG1 3.4Å; S1641-V1752 WeakPolarHBondContact OG-CG2 3.24Å; A1748-V1752 WeakPolarHBondContact O-CG2 3.34Å; A1748-V1752 PolarHBondContact O-N 3.5Å; T1749-V1752 PolarHBondContact O-N 3.01Å; V1752-I1755 PolarHBondContact O-N 2.72Å; V1752-A1756 WeakPolarHBondContact O-CB 3.1Å; V1752-A1756 PolarHBondContact O-N 3.3Å
1753	V	63.6	Low	57.1	Low	90 Å²	90	74.8 Å²	74.8	55%	0.545	40%	0.398	S	S	.	.	H	α-helix	trans	-64.1	-40.9	170.4	171.4	0	0	0	0	110.7	T1749 A1750 F1751 I1755 A1756 V1757	T1749-V1753 WeakPolarHBondContact O-CG2 3.27Å; T1749-V1753 PolarHBondContact O-N 3.24Å; A1750-V1753 CarbonylContact O-C 3.59Å; F1751-V1753 VanDerWaalsContact C-N 3.33Å; V1753-I1755 PolarHBondContact O-N 3.39Å; V1753-A1756 CarbonylContact O-C 3.49Å; V1753-A1756 WeakPolarHBondContact O-CA 3.48Å; V1753-A1756 WeakPolarHBondContact O-CB 3.46Å; V1753-A1756 PolarHBondContact O-N 3.26Å; V1753-A1756 VanDerWaalsContact O-N 3.13Å; V1753-V1757 HydrophobicContact CG1-CG2 4.3Å; V1753-V1757 WeakPolarHBondContact O-CB 3.16Å; V1753-V1757 VanDerWaalsContact O-CG2 3.29Å; V1753-V1757 WeakPolarHBondContact O-CG2 3.43Å; V1753-V1757 PolarHBondContact O-N 2.83Å
1754	L	60.3	Low	56.1	Low	89 Å²	89	74.6 Å²	74.6	47%	0.466	39%	0.392	S	S	.	.	H	α-helix	trans	-62.5	-42.6	176.3	-166.1	77	0	0	0	111	A1750 F1751 A1756 V1757 E1758	A1750-L1754 VanDerWaalsContact O-CB 3.3Å; A1750-L1754 WeakPolarHBondContact O-CB 3.18Å; A1750-L1754 PolarHBondContact O-N 2.79Å; F1751-L1754 HydrophobicContact CD2-CB 4.48Å; F1751-L1754 HydrophobicContact CD2-CD2 4.02Å; F1751-L1754 HydrophobicContact CE2-CD2 4.37Å; F1751-L1754 CarbonylContact O-C 3.44Å; F1751-L1754 WeakPolarHBondContact O-CB 3.48Å; F1751-L1754 PolarHBondContact O-N 3.35Å; L1754-A1756 VanDerWaalsContact C-N 3.34Å; L1754-V1757 CarbonylContact O-C 3.51Å; L1754-V1757 PolarHBondContact O-N 2.93Å; L1754-E1758 HydrophobicContact CG-CG 4.37Å; L1754-E1758 VanDerWaalsContact O-CB 3.24Å; L1754-E1758 WeakPolarHBondContact O-CB 3.3Å; L1754-E1758 WeakPolarHBondContact O-CG 3.37Å; L1754-E1758 PolarHBondContact O-N 2.78Å
1755	I	54.3	Low	55.3	Low	65 Å²	65	78.2 Å²	78.2	33%	0.333	41%	0.408	S	S	.	.	H	α-helix	trans	-63.4	-39.5	173	-73.1	169	0	0	0	110.8	F1751 V1752 V1753 V1757 N1759	F1751-I1755 HydrophobicContact CD1-CD1 3.86Å; F1751-I1755 HydrophobicContact CE1-CD1 3.52Å; F1751-I1755 HydrophobicContact CE1-CG1 4.29Å; F1751-I1755 HydrophobicContact CZ-CD1 3.98Å; F1751-I1755 HydrophobicContact CZ-CG1 4.34Å; F1751-I1755 WeakPolarHBondContact O-CB 3.38Å; F1751-I1755 WeakPolarHBondContact O-CG1 3.33Å; F1751-I1755 PolarHBondContact O-N 3.27Å; V1752-I1755 PolarHBondContact O-N 2.72Å; V1753-I1755 PolarHBondContact O-N 3.39Å; I1755-V1757 VanDerWaalsContact C-N 3.32Å; I1755-V1757 PolarHBondContact O-N 2.84Å; I1755-N1759 WeakPolarHBondContact O-CB 3.47Å; I1755-N1759 PolarHBondContact O-N 3.09Å; I1755-N1759 VanDerWaalsContact O-N 3.07Å; I1755-N1759 PolarHBondContact O-ND2 3.12Å
1756	A	53.7	Low	54.1	Low	14 Å²	14	77.8 Å²	77.8	12%	0.116	41%	0.413	C	S	.	.	H	α-helix	trans	-65	-34.9	174.1	0	0	0	0	0	112.4	A1637 V1752 V1753 L1754	A1637-A1756 HydrophobicContact CB-CB 4Å; V1752-A1756 WeakPolarHBondContact O-CB 3.1Å; V1752-A1756 PolarHBondContact O-N 3.3Å; V1753-A1756 CarbonylContact O-C 3.49Å; V1753-A1756 WeakPolarHBondContact O-CA 3.48Å; V1753-A1756 WeakPolarHBondContact O-CB 3.46Å; V1753-A1756 PolarHBondContact O-N 3.26Å; V1753-A1756 VanDerWaalsContact O-N 3.13Å; L1754-A1756 VanDerWaalsContact C-N 3.34Å
1757	V	56.1	Low	52.8	Low	55 Å²	55	76.4 Å²	76.4	33%	0.333	41%	0.409	S	S	.	.	H	α-helix	trans	-79.4	-38.1	177.4	170	0	0	0	0	112.6	V1753 L1754 I1755 N1759	V1753-V1757 HydrophobicContact CG1-CG2 4.3Å; V1753-V1757 WeakPolarHBondContact O-CB 3.16Å; V1753-V1757 VanDerWaalsContact O-CG2 3.29Å; V1753-V1757 WeakPolarHBondContact O-CG2 3.43Å; V1753-V1757 PolarHBondContact O-N 2.83Å; L1754-V1757 CarbonylContact O-C 3.51Å; L1754-V1757 PolarHBondContact O-N 2.93Å; I1755-V1757 VanDerWaalsContact C-N 3.32Å; I1755-V1757 PolarHBondContact O-N 2.84Å; V1757-N1759 VanDerWaalsContact C-N 3.32Å
1758	E	51.3	Low	51.6	Low	112 Å²	112	78.2 Å²	78.2	52%	0.523	42%	0.421	S	S	.	.	H	α-helix	trans	-74.4	-18.3	177.8	-84.4	-136.1	129.8	0	0	113.5	L1754 Q1760	L1754-E1758 HydrophobicContact CG-CG 4.37Å; L1754-E1758 VanDerWaalsContact O-CB 3.24Å; L1754-E1758 WeakPolarHBondContact O-CB 3.3Å; L1754-E1758 WeakPolarHBondContact O-CG 3.37Å; L1754-E1758 PolarHBondContact O-N 2.78Å; E1758-Q1760 PolarHBondContact O-N 3.29Å
1759	N	52.8	Low	50.7	Low	66 Å²	66	84.7 Å²	84.7	35%	0.353	44%	0.441	S	S	.	.	S	Bend	trans	-68.9	56.6	172.2	-93.1	-43.2	0	0	0	112.6	I1755 V1757 Q1761	I1755-N1759 WeakPolarHBondContact O-CB 3.47Å; I1755-N1759 PolarHBondContact O-N 3.09Å; I1755-N1759 VanDerWaalsContact O-N 3.07Å; I1755-N1759 PolarHBondContact O-ND2 3.12Å; V1757-N1759 VanDerWaalsContact C-N 3.32Å; N1759-Q1761 PolarHBondContact O-N 3.15Å
1760	Q	49.7	Very low	49.3	Very low	145 Å²	145	88.8 Å²	88.8	68%	0.678	45%	0.447	S	S	*	.	S	Bend	trans	41.3	6	160.3	-70.3	-159.3	-1.8	0	0	120.7	E1758 K1764	E1758-Q1760 PolarHBondContact O-N 3.29Å; Q1760-K1764 WeakPolarHBondContact O-CD 3.26Å; Q1760-K1764 WeakPolarHBondContact O-CE 3.37Å; Q1760-K1764 PolarHBondContact O-NZ 3.25Å
1761	Q	48.4	Very low	48.1	Very low	64 Å²	64	90.6 Å²	90.6	30%	0.299	45%	0.452	S	S	.	.	S	Bend	trans	-114.5	-55.1	176.3	-128.6	79	5.8	0	0	111.3	L1630 N1759 R1763 K1764 E1765	L1630-Q1761 VanDerWaalsContact CD2-NE2 3.32Å; N1759-Q1761 PolarHBondContact O-N 3.15Å; Q1761-R1763 PolarHBondContact O-N 2.73Å; Q1761-K1764 WeakPolarHBondContact O-CA 3.5Å; Q1761-K1764 VanDerWaalsContact O-CB 3.27Å; Q1761-K1764 WeakPolarHBondContact O-CB 3.4Å; Q1761-K1764 PolarHBondContact O-N 3.22Å; Q1761-E1765 PolarHBondContact O-N 3.15Å; Q1761-E1765 VanDerWaalsContact O-N 3.16Å
1762	L	42.7	Very low	47	Very low	66 Å²	66	88.9 Å²	88.9	35%	0.346	45%	0.451	S	S	.	.	H	α-helix	trans	-59.8	-41	-176.1	-85.1	158.2	0	0	0	113.9	K1764 E1765 C1766	L1762-K1764 PolarHBondContact O-N 2.95Å; L1762-K1764 VanDerWaalsContact O-N 3.14Å; L1762-E1765 PolarHBondContact O-N 2.78Å; L1762-C1766 PolarHBondContact O-N 3.19Å
1763	R	38.3	Very low	46.2	Very low	158 Å²	158	92 Å²	92	60%	0.596	47%	0.465	S	S	*	.	H	α-helix	trans	-65.2	-16.3	174.7	-146.4	177.3	-167.7	-178.8	6	113.6	Q1761 N1767	Q1761-R1763 PolarHBondContact O-N 2.73Å; R1763-N1767 PolarHBondContact O-ND2 2.99Å
1764	K	45.2	Very low	45	Very low	100 Å²	100	93.9 Å²	93.9	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-86.1	-32.9	171.8	-58.9	175	-177.6	148.2	0	111.4	Q1760 Q1761 L1762 A1768	Q1760-K1764 WeakPolarHBondContact O-CD 3.26Å; Q1760-K1764 WeakPolarHBondContact O-CE 3.37Å; Q1760-K1764 PolarHBondContact O-NZ 3.25Å; Q1761-K1764 WeakPolarHBondContact O-CA 3.5Å; Q1761-K1764 VanDerWaalsContact O-CB 3.27Å; Q1761-K1764 WeakPolarHBondContact O-CB 3.4Å; Q1761-K1764 PolarHBondContact O-N 3.22Å; L1762-K1764 PolarHBondContact O-N 2.95Å; L1762-K1764 VanDerWaalsContact O-N 3.14Å; K1764-A1768 WeakPolarHBondContact O-CB 3.47Å; K1764-A1768 PolarHBondContact O-N 2.87Å; K1764-A1768 VanDerWaalsContact O-N 3.11Å
1765	E	43.4	Very low	44.1	Very low	93 Å²	93	92.5 Å²	92.5	44%	0.435	47%	0.469	S	S	.	.	H	α-helix	trans	-78.1	-45.1	178.2	-73.9	169.2	-167.2	0	0	112.1	Q1761 L1762 N1767 A1768 Y1769	Q1761-E1765 PolarHBondContact O-N 3.15Å; Q1761-E1765 VanDerWaalsContact O-N 3.16Å; L1762-E1765 PolarHBondContact O-N 2.78Å; E1765-N1767 VanDerWaalsContact C-N 3.3Å; E1765-N1767 PolarHBondContact O-N 3.29Å; E1765-A1768 CarbonylContact O-C 2.97Å; E1765-A1768 WeakPolarHBondContact O-CA 3.43Å; E1765-A1768 WeakPolarHBondContact O-CB 3.35Å; E1765-A1768 PolarHBondContact O-N 3.34Å; E1765-Y1769 PolarHBondContact O-N 3.23Å
1766	C	36.4	Very low	43.2	Very low	83 Å²	83	95.4 Å²	95.4	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-60.8	-37.5	174.1	-66.5	0	0	0	0	112.3	L1762 Y1769 Y1770	L1762-C1766 PolarHBondContact O-N 3.19Å; C1766-Y1769 PolarHBondContact O-N 3.2Å; C1766-Y1770 WeakPolarHBondContact O-CB 3.48Å; C1766-Y1770 PolarHBondContact O-N 2.82Å
1767	N	38	Very low	42.1	Very low	98 Å²	98	103 Å²	103	52%	0.524	52%	0.518	S	S	.	.	H	α-helix	trans	-69.2	-33	172.3	-85.6	-70	0	0	0	112.7	R1763 E1765 V1771	R1763-N1767 PolarHBondContact O-ND2 2.99Å; E1765-N1767 VanDerWaalsContact C-N 3.3Å; E1765-N1767 PolarHBondContact O-N 3.29Å; N1767-V1771 WeakPolarHBondContact O-CB 3.37Å; N1767-V1771 VanDerWaalsContact O-CG2 3.23Å; N1767-V1771 WeakPolarHBondContact O-CG2 3.31Å; N1767-V1771 PolarHBondContact O-N 3.43Å
1768	A	39.9	Very low	40.8	Very low	59 Å²	59	105.1 Å²	105.1	49%	0.488	53%	0.533	S	S	.	.	H	α-helix	trans	-68.6	-36.8	172.8	0	0	0	0	0	111.4	K1764 E1765 A1772	K1764-A1768 WeakPolarHBondContact O-CB 3.47Å; K1764-A1768 PolarHBondContact O-N 2.87Å; K1764-A1768 VanDerWaalsContact O-N 3.11Å; E1765-A1768 CarbonylContact O-C 2.97Å; E1765-A1768 WeakPolarHBondContact O-CA 3.43Å; E1765-A1768 WeakPolarHBondContact O-CB 3.35Å; E1765-A1768 PolarHBondContact O-N 3.34Å; A1768-A1772 WeakPolarHBondContact O-CB 3.36Å; A1768-A1772 PolarHBondContact O-N 3.2Å
1769	Y	41.2	Very low	39.5	Very low	167 Å²	167	108.7 Å²	108.7	66%	0.655	55%	0.547	S	S	*	.	H	α-helix	trans	-69.7	-42.5	175.7	-144.6	-97.3	0	0	0	111.5	E1765 C1766 A1772 L1773	E1765-Y1769 PolarHBondContact O-N 3.23Å; C1766-Y1769 PolarHBondContact O-N 3.2Å; Y1769-A1772 CarbonylContact O-C 3.55Å; Y1769-A1772 WeakPolarHBondContact O-CB 3.21Å; Y1769-A1772 PolarHBondContact O-N 2.59Å; Y1769-A1772 VanDerWaalsContact O-N 3.12Å; Y1769-L1773 HydrophobicContact CD1-CD1 3.39Å; Y1769-L1773 HydrophobicContact CE1-CD1 3.53Å; Y1769-L1773 HydrophobicContact CG-CD1 4.45Å; Y1769-L1773 PolarHBondContact O-N 2.95Å
1770	Y	35.1	Very low	38.3	Very low	172 Å²	172	114.1 Å²	114.1	68%	0.675	57%	0.567	S	S	*	*	H	α-helix	trans	-64.3	-41.7	175.1	-139.2	-90.8	0	0	0	112.1	C1766 A1772 L1773 L1774	C1766-Y1770 WeakPolarHBondContact O-CB 3.48Å; C1766-Y1770 PolarHBondContact O-N 2.82Å; Y1770-A1772 VanDerWaalsContact C-N 3.31Å; Y1770-L1773 PolarHBondContact O-N 2.81Å; Y1770-L1774 HydrophobicContact CD1-CD1 3.89Å; Y1770-L1774 HydrophobicContact CE1-CD1 4.3Å; Y1770-L1774 WeakPolarHBondContact O-CB 3.43Å; Y1770-L1774 WeakPolarHBondContact O-CG 3.29Å; Y1770-L1774 PolarHBondContact O-N 3.45Å
1771	V	39.8	Very low	37.3	Very low	97 Å²	97	115.2 Å²	115.2	59%	0.588	57%	0.57	S	S	*	*	H	α-helix	trans	-69.8	-27.8	172.7	172.7	0	0	0	0	111.8	N1767 S1775	N1767-V1771 WeakPolarHBondContact O-CB 3.37Å; N1767-V1771 VanDerWaalsContact O-CG2 3.23Å; N1767-V1771 WeakPolarHBondContact O-CG2 3.31Å; N1767-V1771 PolarHBondContact O-N 3.43Å; V1771-S1775 WeakPolarHBondContact O-CB 3.18Å; V1771-S1775 PolarHBondContact O-N 2.73Å
1772	A	40.1	Very low	36.3	Very low	31 Å²	31	123 Å²	123	26%	0.256	60%	0.596	S	S	.	*	H	α-helix	trans	-73.4	-41.8	173.5	0	0	0	0	0	112.4	A1768 Y1769 Y1770 S1775 L1776	A1768-A1772 WeakPolarHBondContact O-CB 3.36Å; A1768-A1772 PolarHBondContact O-N 3.2Å; Y1769-A1772 CarbonylContact O-C 3.55Å; Y1769-A1772 WeakPolarHBondContact O-CB 3.21Å; Y1769-A1772 PolarHBondContact O-N 2.59Å; Y1769-A1772 VanDerWaalsContact O-N 3.12Å; Y1770-A1772 VanDerWaalsContact C-N 3.31Å; A1772-S1775 WeakPolarHBondContact CA-OG 3.48Å; A1772-S1775 CarbonylContact O-C 3.57Å; A1772-S1775 WeakPolarHBondContact O-CA 3.06Å; A1772-S1775 WeakPolarHBondContact O-CB 3.4Å; A1772-S1775 PolarHBondContact O-N 3.3Å; A1772-S1775 PolarHBondContact O-OG 3.03Å; A1772-L1776 PolarHBondContact O-N 3.16Å
1773	L	40.4	Very low	35.5	Very low	107 Å²	107	124 Å²	124	56%	0.56	61%	0.614	S	S	*	*	H	α-helix	trans	-62.7	-45.6	172.3	-99.3	112.9	0	0	0	111.5	Y1769 Y1770 S1775 L1776	Y1769-L1773 HydrophobicContact CD1-CD1 3.39Å; Y1769-L1773 HydrophobicContact CE1-CD1 3.53Å; Y1769-L1773 HydrophobicContact CG-CD1 4.45Å; Y1769-L1773 PolarHBondContact O-N 2.95Å; Y1770-L1773 PolarHBondContact O-N 2.81Å; L1773-S1775 PolarHBondContact O-N 3.23Å; L1773-L1776 PolarHBondContact O-N 3.09Å
1774	L	38.3	Very low	35	Very low	130 Å²	130	126.6 Å²	126.6	68%	0.681	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-11.7	171.6	-74.5	165.3	0	0	0	113.4	Y1770	Y1770-L1774 HydrophobicContact CD1-CD1 3.89Å; Y1770-L1774 HydrophobicContact CE1-CD1 4.3Å; Y1770-L1774 WeakPolarHBondContact O-CB 3.43Å; Y1770-L1774 WeakPolarHBondContact O-CG 3.29Å; Y1770-L1774 PolarHBondContact O-N 3.45Å
1775	S	40.9	Very low	34.2	Very low	60 Å²	60	128.5 Å²	128.5	42%	0.42	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.1	6.6	174.5	81.2	0	0	0	0	114.7	V1771 A1772 L1773 K1859	V1771-S1775 WeakPolarHBondContact O-CB 3.18Å; V1771-S1775 PolarHBondContact O-N 2.73Å; A1772-S1775 WeakPolarHBondContact CA-OG 3.48Å; A1772-S1775 CarbonylContact O-C 3.57Å; A1772-S1775 WeakPolarHBondContact O-CA 3.06Å; A1772-S1775 WeakPolarHBondContact O-CB 3.4Å; A1772-S1775 PolarHBondContact O-N 3.3Å; A1772-S1775 PolarHBondContact O-OG 3.03Å; L1773-S1775 PolarHBondContact O-N 3.23Å; S1775-K1859 PolarHBondContact OG-NZ 2.8Å
1776	L	36.4	Very low	33.5	Very low	126 Å²	126	132.4 Å²	132.4	66%	0.66	66%	0.658	S	S	*	*			trans	-109	1.4	-175.3	-82	163.9	0	0	0	114.7	A1772 L1773 P1778	A1772-L1776 PolarHBondContact O-N 3.16Å; L1773-L1776 PolarHBondContact O-N 3.09Å; L1776-P1778 WeakPolarHBondContact O-CD 3.4Å
1777	Q	29.7	Very low	33.1	Very low	173 Å²	173	136.7 Å²	136.7	81%	0.808	67%	0.67	S	S	*	*			trans	-73.6	122.3	167.9	-78.3	-70.6	-18.4	0	0	110.7
1778	P	27.9	Very low	32.6	Very low	100 Å²	100	136 Å²	136	65%	0.649	68%	0.678	S	S	*	*			trans	-95	152.4	-173.8	36.2	-34.1	0	0	0	114.2	L1776	L1776-P1778 WeakPolarHBondContact O-CD 3.4Å
1779	K	25.2	Very low	32.1	Very low	188 Å²	188	141.4 Å²	141.4	82%	0.817	70%	0.697	S	S	*	*			trans	82.3	130.9	157.4	-69.7	170.4	179.7	172.3	0	120.7
1780	K	28.1	Very low	31.6	Very low	180 Å²	180	137.3 Å²	137.3	78%	0.783	69%	0.693	S	S	*	*			trans	92.5	112.4	141.6	-76.8	170.2	179.4	178.5	0	121.8
1781	K	27.9	Very low	31.5	Very low	167 Å²	167	135.5 Å²	135.5	73%	0.726	70%	0.695	S	S	*	*				91.2	115.6	129.7	-76.6	-174.5	175.4	-178.9	0	121.9
1782	R	27.9	Very low	31.3	Very low	228 Å²	228	139 Å²	139	86%	0.86	71%	0.709	S	S	*	*			trans	85.7	127.3	134.8	-71.7	-178.6	173.2	173.3	-4.7	120
1783	A	25.2	Very low	31.2	Very low	88 Å²	88	141.2 Å²	141.2	73%	0.727	72%	0.723	S	S	*	*			trans	-85.2	167.4	164	0	0	0	0	0	110.8
1784	Y	28.8	Very low	30.9	Very low	211 Å²	211	138.7 Å²	138.7	83%	0.827	72%	0.715	S	S	*	*				-162.1	165	123.8	-119.6	-83.6	0	0	0	110.7
1785	E	26.9	Very low	30.6	Very low	141 Å²	141	139.4 Å²	139.4	66%	0.659	72%	0.718	S	S	*	*			trans	-71.1	168.7	-167.8	-58.8	134.2	162.6	0	0	115
1786	I	28.7	Very low	30.4	Very low	174 Å²	174	145.1 Å²	145.1	89%	0.892	74%	0.736	S	S	*	*				-151	127.4	120.8	-95.8	150.1	0	0	0	107.8
1787	H	28.1	Very low	30.5	Very low	174 Å²	174	141.3 Å²	141.3	81%	0.806	72%	0.72	S	S	*	*			trans	-84.9	-178.6	177	-112.3	-106	0	0	0	111.6
1788	A	28.8	Very low	30.7	Very low	84 Å²	84	137.8 Å²	137.8	69%	0.694	71%	0.706	S	S	*	*			trans	75.7	75.9	163.3	0	0	0	0	0	118.1
1789	L	29.7	Very low	31.1	Very low	172 Å²	172	140.9 Å²	140.9	90%	0.901	71%	0.71	S	S	*	*			trans	-148.3	47.4	136.8	-110.1	167.2	0	0	0	110.1
1790	S	30.3	Very low	31.7	Very low	80 Å²	80	134.4 Å²	134.4	56%	0.559	69%	0.691	S	S	*	*			trans	-70.5	138.9	154.8	54.8	0	0	0	0	107.1
1791	D	32.1	Very low	32.1	Very low	134 Å²	134	129 Å²	129	72%	0.717	67%	0.673	S	S	*	*	S	Bend		-150.7	13	56.3	-77.8	-50.9	0	0	0	115.2	S1794	D1791-S1794 PolarHBondContact O-OG 3.32Å
1792	L	34.8	Very low	32.5	Very low	171 Å²	171	127.5 Å²	127.5	90%	0.895	67%	0.667	S	S	*	*	S	Bend	trans	-99.4	-8.3	-178.1	-93.3	158.1	0	0	0	115.5
1793	S	39.3	Very low	33	Very low	78 Å²	78	123.5 Å²	123.5	55%	0.545	66%	0.656	S	S	.	*	S	Bend	trans	-85.5	-19.9	178.6	55.3	0	0	0	0	114	L1795 F1796 S1797	S1793-L1795 PolarHBondContact O-N 3.37Å; S1793-F1796 PolarHBondContact O-N 2.93Å; S1793-S1797 WeakPolarHBondContact O-CB 3.27Å; S1793-S1797 PolarHBondContact O-N 2.88Å; S1793-S1797 PolarHBondContact O-OG 2.76Å; S1793-S1797 VanDerWaalsContact O-OG 3.11Å
1794	S	33.5	Very low	33.7	Very low	54 Å²	54	124.6 Å²	124.6	38%	0.378	65%	0.646	S	S	.	*	H	α-helix	trans	-65.3	-30.4	-169	56.4	0	0	0	0	114.8	D1791 S1797 N1798	D1791-S1794 PolarHBondContact O-OG 3.32Å; S1794-S1797 WeakPolarHBondContact CA-OG 3.31Å; S1794-S1797 PolarHBondContact O-OG 3.36Å; S1794-N1798 WeakPolarHBondContact O-CB 3.42Å; S1794-N1798 PolarHBondContact O-N 2.93Å; S1794-N1798 PolarHBondContact O-ND2 3.28Å; S1794-N1798 PolarHBondContact O-OD1 3.41Å
1795	L	32.2	Very low	34.2	Very low	144 Å²	144	117.1 Å²	117.1	75%	0.754	63%	0.628	S	S	*	*	H	α-helix	trans	-79.4	-34	-179.9	-90.2	160.6	0	0	0	113.7	S1793	S1793-L1795 PolarHBondContact O-N 3.37Å
1796	F	37.5	Very low	35	Very low	181 Å²	181	114.9 Å²	114.9	79%	0.794	62%	0.619	S	S	*	*	H	α-helix	trans	-89.9	-28.6	176	-85.6	-83.2	0	0	0	113.1	S1793 N1798 A1800	S1793-F1796 PolarHBondContact O-N 2.93Å; F1796-N1798 VanDerWaalsContact C-N 3.33Å; F1796-A1800 PolarHBondContact O-N 3.15Å
1797	S	38.2	Very low	35.5	Very low	46 Å²	46	111.4 Å²	111.4	32%	0.322	60%	0.598	S	S	.	*	H	α-helix	trans	-61.6	-43.9	170	64.1	0	0	0	0	110.7	S1793 S1794 F1799 A1800 T1801	S1793-S1797 WeakPolarHBondContact O-CB 3.27Å; S1793-S1797 PolarHBondContact O-N 2.88Å; S1793-S1797 PolarHBondContact O-OG 2.76Å; S1793-S1797 VanDerWaalsContact O-OG 3.11Å; S1794-S1797 WeakPolarHBondContact CA-OG 3.31Å; S1794-S1797 PolarHBondContact O-OG 3.36Å; S1797-F1799 PolarHBondContact O-N 2.79Å; S1797-A1800 PolarHBondContact O-N 2.94Å; S1797-A1800 VanDerWaalsContact O-N 3.1Å; S1797-T1801 WeakPolarHBondContact O-CG2 3.48Å; S1797-T1801 PolarHBondContact O-N 3.22Å; S1797-T1801 PolarHBondContact O-OG1 3.25Å
1798	N	32.8	Very low	36.3	Very low	98 Å²	98	107 Å²	107	52%	0.524	58%	0.577	S	S	.	*	H	α-helix	trans	-64.7	-33.1	-174.1	-74.4	-5.1	0	0	0	113.7	S1794 F1796 T1801 F1802	S1794-N1798 WeakPolarHBondContact O-CB 3.42Å; S1794-N1798 PolarHBondContact O-N 2.93Å; S1794-N1798 PolarHBondContact O-ND2 3.28Å; S1794-N1798 PolarHBondContact O-OD1 3.41Å; F1796-N1798 VanDerWaalsContact C-N 3.33Å; N1798-T1801 WeakPolarHBondContact CA-OG1 3.01Å; N1798-F1802 WeakPolarHBondContact O-CB 3.49Å; N1798-F1802 PolarHBondContact O-N 3.43Å
1799	F	36.6	Very low	37	Very low	166 Å²	166	105.2 Å²	105.2	73%	0.728	56%	0.563	S	S	*	*	H	α-helix	trans	-75.7	-28.3	174	-104.2	-81	0	0	0	113.8	S1797 K1803	S1797-F1799 PolarHBondContact O-N 2.79Å; F1799-K1803 VanDerWaalsContact O-CB 3.28Å; F1799-K1803 WeakPolarHBondContact O-CB 3.44Å; F1799-K1803 PolarHBondContact O-N 3.16Å
1800	A	37.5	Very low	37.7	Very low	51 Å²	51	99.1 Å²	99.1	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-74	-53.6	172.9	0	0	0	0	0	110.6	F1796 S1797 F1802 K1803 E1804	F1796-A1800 PolarHBondContact O-N 3.15Å; S1797-A1800 PolarHBondContact O-N 2.94Å; S1797-A1800 VanDerWaalsContact O-N 3.1Å; A1800-F1802 PolarHBondContact O-N 3Å; A1800-K1803 CarbonylContact O-C 3.32Å; A1800-K1803 PolarHBondContact O-N 2.86Å; A1800-K1803 VanDerWaalsContact O-N 3.12Å; A1800-E1804 WeakPolarHBondContact O-CB 3.44Å; A1800-E1804 WeakPolarHBondContact O-CG 3.34Å; A1800-E1804 PolarHBondContact O-N 3.35Å
1801	T	38	Very low	38.5	Very low	66 Å²	66	98.4 Å²	98.4	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-32.6	-179.2	59.8	0	0	0	0	112.6	S1797 N1798 E1804 A1805	S1797-T1801 WeakPolarHBondContact O-CG2 3.48Å; S1797-T1801 PolarHBondContact O-N 3.22Å; S1797-T1801 PolarHBondContact O-OG1 3.25Å; N1798-T1801 WeakPolarHBondContact CA-OG1 3.01Å; T1801-E1804 PolarHBondContact O-N 3.03Å; T1801-A1805 WeakPolarHBondContact O-CB 3.42Å; T1801-A1805 PolarHBondContact O-N 3.44Å
1802	F	36.2	Very low	39.3	Very low	137 Å²	137	96.6 Å²	96.6	60%	0.601	51%	0.512	S	S	*	.	H	α-helix	trans	-70.7	-34.9	173.5	-165	-109.5	0	0	0	111.9	N1798 A1800 I1806	N1798-F1802 WeakPolarHBondContact O-CB 3.49Å; N1798-F1802 PolarHBondContact O-N 3.43Å; A1800-F1802 PolarHBondContact O-N 3Å; F1802-I1806 HydrophobicContact CD1-CD1 3.59Å; F1802-I1806 HydrophobicContact CD1-CG1 4.48Å; F1802-I1806 HydrophobicContact CE1-CD1 3.42Å; F1802-I1806 VanDerWaalsContact CE1-CD1 3.42Å; F1802-I1806 HydrophobicContact CE1-CG1 4.44Å; F1802-I1806 HydrophobicContact CG-CD1 4.31Å; F1802-I1806 HydrophobicContact CZ-CD1 4.02Å; F1802-I1806 WeakPolarHBondContact O-CB 3.28Å; F1802-I1806 VanDerWaalsContact O-CG1 3.26Å; F1802-I1806 WeakPolarHBondContact O-CG1 3.27Å; F1802-I1806 PolarHBondContact O-N 3.18Å
1803	K	38.2	Very low	40	Very low	143 Å²	143	95.1 Å²	95.1	62%	0.622	50%	0.501	S	S	*	.	H	α-helix	trans	-76.6	-26	175.7	-158.6	173.8	-163.7	169.4	0	112.6	F1799 A1800 K1807	F1799-K1803 VanDerWaalsContact O-CB 3.28Å; F1799-K1803 WeakPolarHBondContact O-CB 3.44Å; F1799-K1803 PolarHBondContact O-N 3.16Å; A1800-K1803 CarbonylContact O-C 3.32Å; A1800-K1803 PolarHBondContact O-N 2.86Å; A1800-K1803 VanDerWaalsContact O-N 3.12Å; K1803-K1807 WeakPolarHBondContact O-CD 3.36Å; K1803-K1807 VanDerWaalsContact O-CG 3.29Å; K1803-K1807 WeakPolarHBondContact O-CG 3.23Å; K1803-K1807 PolarHBondContact O-N 3.28Å
1804	E	38.9	Very low	40.6	Very low	112 Å²	112	93.3 Å²	93.3	52%	0.523	49%	0.486	S	S	.	.	H	α-helix	trans	-73.3	-52.1	167.7	-73	170.3	161.9	0	0	110.4	A1800 T1801 I1806 K1807 E1808	A1800-E1804 WeakPolarHBondContact O-CB 3.44Å; A1800-E1804 WeakPolarHBondContact O-CG 3.34Å; A1800-E1804 PolarHBondContact O-N 3.35Å; T1801-E1804 PolarHBondContact O-N 3.03Å; E1804-I1806 PolarHBondContact O-N 3.39Å; E1804-K1807 CarbonylContact O-C 3.54Å; E1804-K1807 PolarHBondContact O-N 2.67Å; E1804-E1808 WeakPolarHBondContact O-CB 3.44Å; E1804-E1808 PolarHBondContact O-N 2.94Å
1805	A	40.3	Very low	41.5	Very low	53 Å²	53	92.9 Å²	92.9	44%	0.438	48%	0.482	S	S	.	.	H	α-helix	trans	-59.1	-43.2	178.6	0	0	0	0	0	112.6	T1801 K1807 E1808 A1809	T1801-A1805 WeakPolarHBondContact O-CB 3.42Å; T1801-A1805 PolarHBondContact O-N 3.44Å; A1805-K1807 VanDerWaalsContact C-N 3.31Å; A1805-K1807 PolarHBondContact O-N 3.17Å; A1805-E1808 PolarHBondContact O-N 3.43Å; A1805-A1809 WeakPolarHBondContact O-CB 3.35Å; A1805-A1809 PolarHBondContact O-N 3.21Å
1806	I	43.2	Very low	42.6	Very low	94 Å²	94	90.7 Å²	90.7	48%	0.482	47%	0.47	S	S	.	.	H	α-helix	trans	-62.3	-38.6	174.2	-73.5	170	0	0	0	111.3	F1802 E1804 A1810	F1802-I1806 HydrophobicContact CD1-CD1 3.59Å; F1802-I1806 HydrophobicContact CD1-CG1 4.48Å; F1802-I1806 HydrophobicContact CE1-CD1 3.42Å; F1802-I1806 VanDerWaalsContact CE1-CD1 3.42Å; F1802-I1806 HydrophobicContact CE1-CG1 4.44Å; F1802-I1806 HydrophobicContact CG-CD1 4.31Å; F1802-I1806 HydrophobicContact CZ-CD1 4.02Å; F1802-I1806 WeakPolarHBondContact O-CB 3.28Å; F1802-I1806 VanDerWaalsContact O-CG1 3.26Å; F1802-I1806 WeakPolarHBondContact O-CG1 3.27Å; F1802-I1806 PolarHBondContact O-N 3.18Å; E1804-I1806 PolarHBondContact O-N 3.39Å; I1806-A1810 WeakPolarHBondContact O-CB 3.43Å; I1806-A1810 PolarHBondContact O-N 3.31Å
1807	K	38.6	Very low	43.5	Very low	101 Å²	101	86.4 Å²	86.4	44%	0.439	46%	0.455	S	S	.	.	H	α-helix	trans	-74.8	-38.1	178.2	-76.9	177.1	179.1	177.8	0	112.5	K1803 E1804 A1805 A1810 I1811	K1803-K1807 WeakPolarHBondContact O-CD 3.36Å; K1803-K1807 VanDerWaalsContact O-CG 3.29Å; K1803-K1807 WeakPolarHBondContact O-CG 3.23Å; K1803-K1807 PolarHBondContact O-N 3.28Å; E1804-K1807 CarbonylContact O-C 3.54Å; E1804-K1807 PolarHBondContact O-N 2.67Å; A1805-K1807 VanDerWaalsContact C-N 3.31Å; A1805-K1807 PolarHBondContact O-N 3.17Å; K1807-A1810 PolarHBondContact O-N 3.3Å; K1807-I1811 WeakPolarHBondContact O-CB 3.32Å; K1807-I1811 VanDerWaalsContact O-CG1 3.23Å; K1807-I1811 WeakPolarHBondContact O-CG1 3.2Å; K1807-I1811 PolarHBondContact O-N 3.13Å
1808	E	44.9	Very low	44.4	Very low	81 Å²	81	87 Å²	87	38%	0.379	45%	0.454	S	S	.	.	H	α-helix	trans	-71.4	-38.9	178.1	-153.2	-176.9	-144.5	0	0	110.5	E1804 A1805 I1811 K1812	E1804-E1808 WeakPolarHBondContact O-CB 3.44Å; E1804-E1808 PolarHBondContact O-N 2.94Å; A1805-E1808 PolarHBondContact O-N 3.43Å; E1808-I1811 PolarHBondContact O-N 3.48Å; E1808-K1812 VanDerWaalsContact O-CB 3.31Å; E1808-K1812 WeakPolarHBondContact O-CB 3.43Å; E1808-K1812 WeakPolarHBondContact O-CG 3.39Å; E1808-K1812 PolarHBondContact O-N 3.41Å
1809	A	45.2	Very low	45.4	Very low	48 Å²	48	90.4 Å²	90.4	40%	0.397	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-46	168.7	0	0	0	0	0	111.5	A1805 I1811 K1812 Q1813	A1805-A1809 WeakPolarHBondContact O-CB 3.35Å; A1805-A1809 PolarHBondContact O-N 3.21Å; A1809-I1811 PolarHBondContact O-N 3.24Å; A1809-K1812 PolarHBondContact O-N 3.2Å; A1809-Q1813 VanDerWaalsContact O-CB 3.24Å; A1809-Q1813 WeakPolarHBondContact O-CB 3.44Å; A1809-Q1813 VanDerWaalsContact O-CG 3.3Å; A1809-Q1813 WeakPolarHBondContact O-CG 3.48Å; A1809-Q1813 PolarHBondContact O-N 2.94Å
1810	A	43.2	Very low	46.5	Very low	43 Å²	43	85.8 Å²	85.8	36%	0.355	45%	0.448	S	S	.	.	H	α-helix	trans	-62.7	-39.1	176.4	0	0	0	0	0	112.4	I1806 K1807 T1814	I1806-A1810 WeakPolarHBondContact O-CB 3.43Å; I1806-A1810 PolarHBondContact O-N 3.31Å; K1807-A1810 PolarHBondContact O-N 3.3Å; A1810-T1814 WeakPolarHBondContact O-CB 3.22Å; A1810-T1814 PolarHBondContact O-N 3.12Å; A1810-T1814 PolarHBondContact O-OG1 3.13Å
1811	I	48.4	Very low	47.8	Very low	66 Å²	66	85.8 Å²	85.8	34%	0.338	44%	0.441	S	S	.	.	H	α-helix	trans	-71.8	-43.5	176.6	-68.3	165.3	0	0	0	111	K1807 E1808 A1809 T1814 V1815 A1850	K1807-I1811 WeakPolarHBondContact O-CB 3.32Å; K1807-I1811 VanDerWaalsContact O-CG1 3.23Å; K1807-I1811 WeakPolarHBondContact O-CG1 3.2Å; K1807-I1811 PolarHBondContact O-N 3.13Å; E1808-I1811 PolarHBondContact O-N 3.48Å; A1809-I1811 PolarHBondContact O-N 3.24Å; I1811-T1814 PolarHBondContact O-N 2.74Å; I1811-V1815 HydrophobicContact CG2-CG2 4.37Å; I1811-V1815 WeakPolarHBondContact O-CB 3.32Å; I1811-V1815 WeakPolarHBondContact O-CG2 3.47Å; I1811-V1815 PolarHBondContact O-N 3.27Å; I1811-A1850 HydrophobicContact CD1-CB 4.17Å
1812	K	47.7	Very low	49.1	Very low	96 Å²	96	91.2 Å²	91.2	42%	0.417	45%	0.454	S	S	.	.	H	α-helix	trans	-58.1	-48.4	171.8	-84	-179.4	174.2	169.5	0	111.2	E1808 A1809 T1814 V1815 N1816 M1856	E1808-K1812 VanDerWaalsContact O-CB 3.31Å; E1808-K1812 WeakPolarHBondContact O-CB 3.43Å; E1808-K1812 WeakPolarHBondContact O-CG 3.39Å; E1808-K1812 PolarHBondContact O-N 3.41Å; A1809-K1812 PolarHBondContact O-N 3.2Å; K1812-T1814 PolarHBondContact O-N 3.01Å; K1812-V1815 PolarHBondContact O-N 3.18Å; K1812-N1816 VanDerWaalsContact O-CB 3.25Å; K1812-N1816 WeakPolarHBondContact O-CB 3.47Å; K1812-N1816 PolarHBondContact O-N 3.28Å; K1812-N1816 PolarHBondContact O-OD1 3.32Å; K1812-M1856 HydrophobicContact CD-CE 4.34Å; K1812-M1856 HydrophobicContact CG-CE 3.43Å; K1812-M1856 VanDerWaalsContact CG-CE 3.43Å; K1812-M1856 HydrophobicContact CG-SD 4.17Å
1813	Q	50.8	Low	50.4	Low	139 Å²	139	91.1 Å²	91.1	65%	0.65	47%	0.467	S	S	*	.	H	α-helix	trans	-60.2	-43.4	175.6	-78.2	-179.9	-14.4	0	0	111.3	A1809 N1816 L1817	A1809-Q1813 VanDerWaalsContact O-CB 3.24Å; A1809-Q1813 WeakPolarHBondContact O-CB 3.44Å; A1809-Q1813 VanDerWaalsContact O-CG 3.3Å; A1809-Q1813 WeakPolarHBondContact O-CG 3.48Å; A1809-Q1813 PolarHBondContact O-N 2.94Å; Q1813-N1816 PolarHBondContact O-N 3.28Å; Q1813-L1817 VanDerWaalsContact O-CB 3.23Å; Q1813-L1817 WeakPolarHBondContact O-CB 3.38Å; Q1813-L1817 PolarHBondContact O-N 3.49Å
1814	T	50.5	Low	51.9	Low	40 Å²	40	88.3 Å²	88.3	25%	0.245	48%	0.478	C	S	.	.	H	α-helix	trans	-67.4	-41.5	178.9	-49.8	0	0	0	0	112.3	A1810 I1811 K1812 N1816 L1817 I1818 V1840	A1810-T1814 WeakPolarHBondContact O-CB 3.22Å; A1810-T1814 PolarHBondContact O-N 3.12Å; A1810-T1814 PolarHBondContact O-OG1 3.13Å; I1811-T1814 PolarHBondContact O-N 2.74Å; K1812-T1814 PolarHBondContact O-N 3.01Å; T1814-N1816 VanDerWaalsContact C-N 3.35Å; T1814-L1817 WeakPolarHBondContact O-CB 3.22Å; T1814-L1817 PolarHBondContact O-N 2.99Å; T1814-I1818 HydrophobicContact CG2-CD1 4.07Å; T1814-I1818 WeakPolarHBondContact O-CD1 3.46Å; T1814-I1818 VanDerWaalsContact O-CG1 3.28Å; T1814-I1818 WeakPolarHBondContact O-CG1 3.48Å; T1814-I1818 PolarHBondContact O-N 3.35Å; T1814-V1840 HydrophobicContact CG2-CG1 3.58Å
1815	V	52.9	Low	53.7	Low	46 Å²	46	87.1 Å²	87.1	28%	0.279	47%	0.473	S	S	.	.	H	α-helix	trans	-68	-37.1	176.8	172.9	0	0	0	0	110.9	I1811 K1812 I1818 R1819	I1811-V1815 HydrophobicContact CG2-CG2 4.37Å; I1811-V1815 WeakPolarHBondContact O-CB 3.32Å; I1811-V1815 WeakPolarHBondContact O-CG2 3.47Å; I1811-V1815 PolarHBondContact O-N 3.27Å; K1812-V1815 PolarHBondContact O-N 3.18Å; V1815-I1818 PolarHBondContact O-N 3.41Å; V1815-R1819 WeakPolarHBondContact O-CB 3.28Å; V1815-R1819 PolarHBondContact O-N 3.03Å
1816	N	54.5	Low	55.2	Low	97 Å²	97	90.2 Å²	90.2	52%	0.519	49%	0.49	S	S	.	.	H	α-helix	trans	-66.5	-39	171.8	-71.5	-2.2	0	0	0	111.6	K1812 Q1813 T1814 I1818 R1819 S1820	K1812-N1816 VanDerWaalsContact O-CB 3.25Å; K1812-N1816 WeakPolarHBondContact O-CB 3.47Å; K1812-N1816 PolarHBondContact O-N 3.28Å; K1812-N1816 PolarHBondContact O-OD1 3.32Å; Q1813-N1816 PolarHBondContact O-N 3.28Å; T1814-N1816 VanDerWaalsContact C-N 3.35Å; N1816-I1818 VanDerWaalsContact C-N 3.28Å; N1816-I1818 PolarHBondContact O-N 2.95Å; N1816-R1819 CarbonylContact O-C 3.57Å; N1816-R1819 PolarHBondContact O-N 2.9Å; N1816-R1819 VanDerWaalsContact O-N 3.16Å; N1816-S1820 WeakPolarHBondContact O-CB 3.46Å; N1816-S1820 PolarHBondContact O-N 3.45Å; N1816-S1820 PolarHBondContact O-OG 3.33Å
1817	L	56.3	Low	56.6	Low	91 Å²	91	89.9 Å²	89.9	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-64.5	-31.7	175.1	-159.4	93	0	0	0	112	Q1813 T1814 S1820 I1821	Q1813-L1817 VanDerWaalsContact O-CB 3.23Å; Q1813-L1817 WeakPolarHBondContact O-CB 3.38Å; Q1813-L1817 PolarHBondContact O-N 3.49Å; T1814-L1817 WeakPolarHBondContact O-CB 3.22Å; T1814-L1817 PolarHBondContact O-N 2.99Å; L1817-S1820 WeakPolarHBondContact CA-OG 3.15Å; L1817-S1820 PolarHBondContact O-OG 3.28Å; L1817-I1821 WeakPolarHBondContact O-CG1 3.14Å
1818	I	57.7	Low	58.4	Low	58 Å²	58	87 Å²	87	30%	0.297	49%	0.488	S	S	.	.	H	α-helix	trans	-78.5	-33.8	173.2	-66.2	161.2	0	0	0	111	T1814 V1815 N1816 S1820 A1844	T1814-I1818 HydrophobicContact CG2-CD1 4.07Å; T1814-I1818 WeakPolarHBondContact O-CD1 3.46Å; T1814-I1818 VanDerWaalsContact O-CG1 3.28Å; T1814-I1818 WeakPolarHBondContact O-CG1 3.48Å; T1814-I1818 PolarHBondContact O-N 3.35Å; V1815-I1818 PolarHBondContact O-N 3.41Å; N1816-I1818 VanDerWaalsContact C-N 3.28Å; N1816-I1818 PolarHBondContact O-N 2.95Å; I1818-S1820 VanDerWaalsContact C-N 3.31Å; I1818-A1844 HydrophobicContact CD1-CB 3.63Å
1819	R	53.9	Low	59.6	Low	170 Å²	170	86.8 Å²	86.8	64%	0.642	49%	0.488	S	S	*	.	H	α-helix	trans	-71.8	-20.6	172.4	-97.4	-177.9	162	178.2	-7.9	113.7	V1815 N1816	V1815-R1819 WeakPolarHBondContact O-CB 3.28Å; V1815-R1819 PolarHBondContact O-N 3.03Å; N1816-R1819 CarbonylContact O-C 3.57Å; N1816-R1819 PolarHBondContact O-N 2.9Å; N1816-R1819 VanDerWaalsContact O-N 3.16Å
1820	S	60.4	Low	60.7	Low	70 Å²	70	93.1 Å²	93.1	49%	0.49	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-7.4	179.8	62.3	0	0	0	0	114.6	N1816 L1817 I1818 R1822	N1816-S1820 WeakPolarHBondContact O-CB 3.46Å; N1816-S1820 PolarHBondContact O-N 3.45Å; N1816-S1820 PolarHBondContact O-OG 3.33Å; L1817-S1820 WeakPolarHBondContact CA-OG 3.15Å; L1817-S1820 PolarHBondContact O-OG 3.28Å; I1818-S1820 VanDerWaalsContact C-N 3.31Å; S1820-R1822 PolarHBondContact O-N 3.43Å
1821	I	64	Low	61.7	Low	51 Å²	51	93.4 Å²	93.4	26%	0.262	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-72.1	116.2	-177.1	-43.8	-171.8	0	0	0	109.6	L1817 E1825 I1827	L1817-I1821 WeakPolarHBondContact O-CG1 3.14Å; I1821-E1825 HydrophobicContact CG2-CB 4.04Å; I1821-I1827 HydrophobicContact CB-CD1 4.35Å; I1821-I1827 HydrophobicContact CD1-CD1 3.84Å; I1821-I1827 HydrophobicContact CG1-CD1 3.63Å; I1821-I1827 HydrophobicContact CG2-CD1 4.16Å; I1821-I1827 HydrophobicContact CG2-CG1 4.47Å
1822	R	64.6	Low	62.2	Low	179 Å²	179	93 Å²	93	68%	0.675	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-79.9	151.6	172.8	-57.2	179.1	175	171.7	-3.4	110.6	S1820 G1824 E1825	S1820-R1822 PolarHBondContact O-N 3.43Å; R1822-G1824 PolarHBondContact O-N 2.96Å; R1822-E1825 HydrophobicContact CB-CG 3.99Å; R1822-E1825 WeakPolarHBondContact CD-OE1 3.31Å; R1822-E1825 WeakPolarHBondContact CG-OE1 3.04Å; R1822-E1825 PolarHBondContact N-OE2 3.31Å; R1822-E1825 WeakPolarHBondContact O-CB 3.12Å; R1822-E1825 PolarHBondContact O-N 3.38Å
1823	P	65.2	Low	62.6	Low	135 Å²	135	93.6 Å²	93.6	88%	0.877	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	127.8	170.6	-23.9	34.1	0	0	0	110.8
1824	G	69.7	Low	62.8	Low	84 Å²	84	91 Å²	91	87%	0.866	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.7	-9.8	-176.2	0	0	0	0	0	115.8	R1822	R1822-G1824 PolarHBondContact O-N 2.96Å
1825	E	75.2	Confident	63.5	Low	88 Å²	88	94.2 Å²	94.2	41%	0.411	56%	0.558	S	S	.	*			trans	-80.3	127.7	177.7	-71.6	177.9	171	0	0	113.1	I1821 R1822	I1821-E1825 HydrophobicContact CG2-CB 4.04Å; R1822-E1825 HydrophobicContact CB-CG 3.99Å; R1822-E1825 WeakPolarHBondContact CD-OE1 3.31Å; R1822-E1825 WeakPolarHBondContact CG-OE1 3.04Å; R1822-E1825 PolarHBondContact N-OE2 3.31Å; R1822-E1825 WeakPolarHBondContact O-CB 3.12Å; R1822-E1825 PolarHBondContact O-N 3.38Å
1826	C	72	Confident	64.1	Low	118 Å²	118	93 Å²	93	80%	0.797	56%	0.555	S	S	*	*			trans	-96.4	109.6	175.9	-77.5	0	0	0	0	111.5
1827	I	73.9	Confident	64.8	Low	87 Å²	87	91 Å²	91	45%	0.446	54%	0.541	S	S	.	.			trans	-107.7	129.4	179.3	-56.5	-167.9	0	0	0	112.1	I1821	I1821-I1827 HydrophobicContact CB-CD1 4.35Å; I1821-I1827 HydrophobicContact CD1-CD1 3.84Å; I1821-I1827 HydrophobicContact CG1-CD1 3.63Å; I1821-I1827 HydrophobicContact CG2-CD1 4.16Å; I1821-I1827 HydrophobicContact CG2-CG1 4.47Å
1828	G	75.2	Confident	65.3	Low	41 Å²	41	88 Å²	88	42%	0.423	53%	0.528	S	S	.	.			trans	-107.5	121.2	175.9	0	0	0	0	0	113.4	F1830	G1828-F1830 WeakPolarHBondContact O-CD2 3.34Å; G1828-F1830 WeakPolarHBondContact O-CE2 3.43Å; G1828-F1830 PolarHBondContact O-N 2.82Å
1829	I	70.9	Confident	65.6	Low	75 Å²	75	88.4 Å²	88.4	39%	0.385	54%	0.536	S	S	.	.			trans	-84	91.9	175.9	-53.9	-176.5	0	0	0	110.5	K1837 L1841	I1829-K1837 HydrophobicContact CG2-CB 4.36Å; I1829-K1837 HydrophobicContact CG2-CD 4.29Å; I1829-K1837 HydrophobicContact CG2-CG 4.05Å; I1829-K1837 WeakPolarHBondContact O-CD 3.44Å; I1829-K1837 VanDerWaalsContact O-CE 3.29Å; I1829-K1837 WeakPolarHBondContact O-CE 3.25Å; I1829-K1837 PolarHBondContact O-NZ 3.39Å; I1829-L1841 HydrophobicContact CD1-CD2 3.65Å; I1829-L1841 HydrophobicContact CD1-CG 4.23Å
1830	F	68.2	Low	66.1	Low	182 Å²	182	82.4 Å²	82.4	80%	0.798	52%	0.519	S	S	*	.			trans	-85.6	172.4	176	-59.3	-73.9	0	0	0	112.6	G1828 K1837	G1828-F1830 WeakPolarHBondContact O-CD2 3.34Å; G1828-F1830 WeakPolarHBondContact O-CE2 3.43Å; G1828-F1830 PolarHBondContact O-N 2.82Å; F1830-K1837 WeakPolarHBondContact O-CE 3.47Å
1831	G	64.6	Low	66.5	Low	49 Å²	49	80.4 Å²	80.4	51%	0.505	50%	0.502	S	S	.	.	S	Bend	trans	125.8	171.5	-171.7	0	0	0	0	0	113.6	K1837	G1831-K1837 VanDerWaalsContact C-CE 3.42Å; G1831-K1837 WeakPolarHBondContact O-CE 3.35Å; G1831-K1837 PolarHBondContact O-NZ 3.32Å
1832	A	58.5	Low	66.4	Low	58 Å²	58	83.1 Å²	83.1	48%	0.479	51%	0.509	S	S	.	.			trans	-75.8	146.9	-176.8	0	0	0	0	0	113.2	G1834 V1835	A1832-G1834 PolarHBondContact O-N 3.26Å; A1832-V1835 HydrophobicContact CB-CG2 3.98Å; A1832-V1835 WeakPolarHBondContact O-CB 3.47Å; A1832-V1835 VanDerWaalsContact O-CG2 3.28Å; A1832-V1835 WeakPolarHBondContact O-CG2 3.37Å; A1832-V1835 PolarHBondContact O-N 3.19Å; A1832-V1835 VanDerWaalsContact O-N 3.14Å
1833	N	55.4	Low	66.3	Low	108 Å²	108	77.5 Å²	77.5	58%	0.578	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	127.6	171.3	-63.9	30.9	0	0	0	109
1834	G	55.8	Low	66.1	Low	83 Å²	83	73.2 Å²	73.2	86%	0.856	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.9	-15.3	-173.7	0	0	0	0	0	115.1	A1832 G1836	A1832-G1834 PolarHBondContact O-N 3.26Å; G1834-G1836 PolarHBondContact O-N 3.32Å; G1834-G1836 VanDerWaalsContact O-N 3.12Å
1835	V	65	Low	65.6	Low	109 Å²	109	70.6 Å²	70.6	66%	0.661	43%	0.433	S	S	*	.	S	Bend	trans	-67.6	-9.7	175	176.6	0	0	0	0	112.7	A1832	A1832-V1835 HydrophobicContact CB-CG2 3.98Å; A1832-V1835 WeakPolarHBondContact O-CB 3.47Å; A1832-V1835 VanDerWaalsContact O-CG2 3.28Å; A1832-V1835 WeakPolarHBondContact O-CG2 3.37Å; A1832-V1835 PolarHBondContact O-N 3.19Å; A1832-V1835 VanDerWaalsContact O-N 3.14Å
1836	G	64.4	Low	64.5	Low	21 Å²	21	68.9 Å²	68.9	22%	0.216	44%	0.435	C	S	.	.	S	Bend	trans	99.7	13	174.4	0	0	0	0	0	115.1	G1834 S1838 S1839 V1840	G1834-G1836 PolarHBondContact O-N 3.32Å; G1834-G1836 VanDerWaalsContact O-N 3.12Å; G1836-S1838 PolarHBondContact O-N 3.39Å; G1836-S1839 CarbonylContact O-C 3.53Å; G1836-S1839 WeakPolarHBondContact O-CA 3.27Å; G1836-S1839 WeakPolarHBondContact O-CB 3.37Å; G1836-S1839 PolarHBondContact O-N 3.1Å; G1836-V1840 WeakPolarHBondContact O-CG2 3.49Å; G1836-V1840 PolarHBondContact O-N 2.71Å
1837	K	69.7	Low	63.6	Low	53 Å²	53	67.4 Å²	67.4	23%	0.23	41%	0.412	C	S	.	.	H	α-helix	trans	-45.1	-58.5	-179.8	-57.4	-176.5	-178.1	-172.4	0	114.4	I1829 F1830 G1831 S1839 V1840 L1841	I1829-K1837 HydrophobicContact CG2-CB 4.36Å; I1829-K1837 HydrophobicContact CG2-CD 4.29Å; I1829-K1837 HydrophobicContact CG2-CG 4.05Å; I1829-K1837 WeakPolarHBondContact O-CD 3.44Å; I1829-K1837 VanDerWaalsContact O-CE 3.29Å; I1829-K1837 WeakPolarHBondContact O-CE 3.25Å; I1829-K1837 PolarHBondContact O-NZ 3.39Å; F1830-K1837 WeakPolarHBondContact O-CE 3.47Å; G1831-K1837 VanDerWaalsContact C-CE 3.42Å; G1831-K1837 WeakPolarHBondContact O-CE 3.35Å; G1831-K1837 PolarHBondContact O-NZ 3.32Å; K1837-S1839 PolarHBondContact O-N 3.15Å; K1837-V1840 CarbonylContact O-C 3.49Å; K1837-V1840 WeakPolarHBondContact O-CA 3.3Å; K1837-V1840 WeakPolarHBondContact O-CB 3.47Å; K1837-V1840 PolarHBondContact O-N 3.45Å; K1837-L1841 PolarHBondContact O-N 3.46Å
1838	S	66.1	Low	62.3	Low	29 Å²	29	65.3 Å²	65.3	20%	0.203	41%	0.405	C	S	.	.	H	α-helix	trans	-66.9	-26.5	-179.7	-46.3	0	0	0	0	111.8	G1836 R1842 D1954	G1836-S1838 PolarHBondContact O-N 3.39Å; S1838-R1842 WeakPolarHBondContact O-CB 3.12Å; S1838-R1842 WeakPolarHBondContact O-CD 3.26Å; S1838-R1842 WeakPolarHBondContact O-CG 3.41Å; S1838-R1842 PolarHBondContact O-N 3.41Å; S1838-D1954 VanDerWaalsContact CB-OD2 3.27Å; S1838-D1954 WeakPolarHBondContact CB-OD2 3.11Å; S1838-D1954 PolarHBondContact OG-OD1 3.14Å; S1838-D1954 PolarHBondContact OG-OD2 2.75Å; S1838-D1954 VanDerWaalsContact OG-OD2 3.1Å
1839	S	64.3	Low	60.7	Low	66 Å²	66	71.4 Å²	71.4	46%	0.462	42%	0.416	S	S	.	.	H	α-helix	trans	-69.1	-41.1	170	-46.7	0	0	0	0	111.5	G1836 K1837 R1842 I1843	G1836-S1839 CarbonylContact O-C 3.53Å; G1836-S1839 WeakPolarHBondContact O-CA 3.27Å; G1836-S1839 WeakPolarHBondContact O-CB 3.37Å; G1836-S1839 PolarHBondContact O-N 3.1Å; K1837-S1839 PolarHBondContact O-N 3.15Å; S1839-R1842 CarbonylContact O-C 3.57Å; S1839-R1842 PolarHBondContact O-N 3.47Å; S1839-I1843 VanDerWaalsContact O-CG1 3.24Å; S1839-I1843 WeakPolarHBondContact O-CG1 3.34Å; S1839-I1843 PolarHBondContact O-N 3.41Å
1840	V	65.7	Low	59.7	Low	45 Å²	45	69.5 Å²	69.5	27%	0.273	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-44.8	175.3	168.6	0	0	0	0	110.8	T1814 G1836 K1837 R1842 I1843 A1844	T1814-V1840 HydrophobicContact CG2-CG1 3.58Å; G1836-V1840 WeakPolarHBondContact O-CG2 3.49Å; G1836-V1840 PolarHBondContact O-N 2.71Å; K1837-V1840 CarbonylContact O-C 3.49Å; K1837-V1840 WeakPolarHBondContact O-CA 3.3Å; K1837-V1840 WeakPolarHBondContact O-CB 3.47Å; K1837-V1840 PolarHBondContact O-N 3.45Å; V1840-R1842 VanDerWaalsContact C-N 3.34Å; V1840-R1842 PolarHBondContact O-N 3.48Å; V1840-I1843 PolarHBondContact O-N 3.28Å; V1840-I1843 VanDerWaalsContact O-N 3.12Å; V1840-A1844 WeakPolarHBondContact O-CB 3.4Å; V1840-A1844 PolarHBondContact O-N 3.46Å
1841	L	67.5	Low	58.8	Low	28 Å²	28	66 Å²	66	15%	0.147	41%	0.409	C	S	.	.	H	α-helix	trans	-60	-42.6	172.2	-69.4	178.3	0	0	0	111.6	I1829 K1837 I1843 A1844 M1845 V1952 D1954	I1829-L1841 HydrophobicContact CD1-CD2 3.65Å; I1829-L1841 HydrophobicContact CD1-CG 4.23Å; K1837-L1841 PolarHBondContact O-N 3.46Å; L1841-I1843 VanDerWaalsContact C-N 3.33Å; L1841-I1843 PolarHBondContact O-N 3.47Å; L1841-A1844 PolarHBondContact O-N 2.94Å; L1841-M1845 HydrophobicContact CB-CE 4.23Å; L1841-M1845 WeakPolarHBondContact O-CE 3.32Å; L1841-M1845 WeakPolarHBondContact O-CG 3.22Å; L1841-M1845 PolarHBondContact O-N 3.44Å; L1841-V1952 HydrophobicContact CD1-CG1 4.19Å; L1841-V1952 HydrophobicContact CD2-CG1 3.82Å; L1841-V1952 HydrophobicContact CG-CG1 4.44Å; L1841-D1954 HydrophobicContact CD1-CB 4.22Å
1842	R	62.5	Low	57.8	Low	108 Å²	108	71.6 Å²	71.6	41%	0.408	42%	0.416	S	S	.	.	H	α-helix	trans	-65.4	-32.7	173.4	-71.1	170.5	-159.2	-163.7	5.8	112.8	S1838 S1839 V1840 A1846 R1847 S1848	S1838-R1842 WeakPolarHBondContact O-CB 3.12Å; S1838-R1842 WeakPolarHBondContact O-CD 3.26Å; S1838-R1842 WeakPolarHBondContact O-CG 3.41Å; S1838-R1842 PolarHBondContact O-N 3.41Å; S1839-R1842 CarbonylContact O-C 3.57Å; S1839-R1842 PolarHBondContact O-N 3.47Å; V1840-R1842 VanDerWaalsContact C-N 3.34Å; V1840-R1842 PolarHBondContact O-N 3.48Å; R1842-A1846 PolarHBondContact O-N 3.3Å; R1842-R1847 HydrophobicContact CB-CB 3.94Å; R1842-R1847 HydrophobicContact CG-CB 4.21Å; R1842-R1847 CarbonylContact O-C 3.59Å; R1842-R1847 WeakPolarHBondContact O-CA 3.34Å; R1842-R1847 WeakPolarHBondContact O-CB 3.38Å; R1842-R1847 PolarHBondContact O-N 3.49Å; R1842-S1848 WeakPolarHBondContact CB-OG 3.48Å; R1842-S1848 PolarHBondContact O-N 2.87Å
1843	I	61.5	Low	56.7	Low	60 Å²	60	77.9 Å²	77.9	31%	0.308	43%	0.433	S	S	.	.	H	α-helix	trans	-68.3	-46.4	172.5	-68.5	161	0	0	0	110.4	S1839 V1840 L1841 M1845 A1846 S1848 A1850	S1839-I1843 VanDerWaalsContact O-CG1 3.24Å; S1839-I1843 WeakPolarHBondContact O-CG1 3.34Å; S1839-I1843 PolarHBondContact O-N 3.41Å; V1840-I1843 PolarHBondContact O-N 3.28Å; V1840-I1843 VanDerWaalsContact O-N 3.12Å; L1841-I1843 VanDerWaalsContact C-N 3.33Å; L1841-I1843 PolarHBondContact O-N 3.47Å; I1843-M1845 VanDerWaalsContact C-N 3.34Å; I1843-M1845 PolarHBondContact O-N 2.93Å; I1843-A1846 PolarHBondContact O-N 2.74Å; I1843-S1848 WeakPolarHBondContact CA-O 3.47Å; I1843-S1848 WeakPolarHBondContact CG1-O 3.46Å; I1843-S1848 PolarHBondContact N-OG 3.45Å; I1843-A1850 HydrophobicContact CD1-CB 4.49Å
1844	A	61	Low	55.7	Low	46 Å²	46	74.7 Å²	74.7	38%	0.38	43%	0.425	S	S	.	.	H	α-helix	trans	-59.2	-41.4	178.4	0	0	0	0	0	112.9	I1818 V1840 L1841 A1846	I1818-A1844 HydrophobicContact CD1-CB 3.63Å; V1840-A1844 WeakPolarHBondContact O-CB 3.4Å; V1840-A1844 PolarHBondContact O-N 3.46Å; L1841-A1844 PolarHBondContact O-N 2.94Å; A1844-A1846 PolarHBondContact O-N 3.34Å
1845	M	60	Low	54.6	Low	28 Å²	28	81.4 Å²	81.4	14%	0.138	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	12.3	175.7	-61.2	179.8	-75.6	0	0	114.4	L1841 I1843 R1847 Y1875 V1952	L1841-M1845 HydrophobicContact CB-CE 4.23Å; L1841-M1845 WeakPolarHBondContact O-CE 3.32Å; L1841-M1845 WeakPolarHBondContact O-CG 3.22Å; L1841-M1845 PolarHBondContact O-N 3.44Å; I1843-M1845 VanDerWaalsContact C-N 3.34Å; I1843-M1845 PolarHBondContact O-N 2.93Å; M1845-R1847 PolarHBondContact O-N 2.78Å; M1845-Y1875 HydrophobicContact CE-CD1 4.3Å; M1845-Y1875 HydrophobicContact CE-CD2 3.55Å; M1845-Y1875 HydrophobicContact CE-CE1 4.1Å; M1845-Y1875 HydrophobicContact CE-CE2 3.32Å; M1845-Y1875 HydrophobicContact CE-CG 4.01Å; M1845-Y1875 HydrophobicContact SD-CD1 4.03Å; M1845-Y1875 HydrophobicContact SD-CD2 3.27Å; M1845-Y1875 WeakPolarHBondContact SD-CD2 3.46Å; M1845-Y1875 HydrophobicContact SD-CE1 4.43Å; M1845-Y1875 HydrophobicContact SD-CE2 3.77Å; M1845-Y1875 HydrophobicContact SD-CG 3.38Å; M1845-V1952 HydrophobicContact SD-CG1 4.47Å
1846	A	52.9	Low	53.1	Low	53 Å²	53	80 Å²	80	44%	0.438	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	18	-173.8	0	0	0	0	0	115.9	R1842 I1843 A1844	R1842-A1846 PolarHBondContact O-N 3.3Å; I1843-A1846 PolarHBondContact O-N 2.74Å; A1844-A1846 PolarHBondContact O-N 3.34Å
1847	R	51.4	Low	51.7	Low	86 Å²	86	83.9 Å²	83.9	33%	0.325	44%	0.442	S	S	.	.	S	Bend	trans	-73.7	-23.9	173.4	-85.6	-168.2	154.1	101.8	2.4	113.7	S1629 L1630 R1842 M1845	S1629-R1847 PolarHBondContact O-NH2 3.02Å; S1629-R1847 PolarHBondContact OG-NE 3.12Å; S1629-R1847 VanDerWaalsContact OG-NE 3.17Å; S1629-R1847 PolarHBondContact OG-NH2 3.43Å; L1630-R1847 HydrophobicContact CD1-CG 3.48Å; L1630-R1847 VanDerWaalsContact CD1-CG 3.48Å; L1630-R1847 HydrophobicContact CG-CG 4.44Å; R1842-R1847 HydrophobicContact CB-CB 3.94Å; R1842-R1847 HydrophobicContact CG-CB 4.21Å; R1842-R1847 CarbonylContact O-C 3.59Å; R1842-R1847 WeakPolarHBondContact O-CA 3.34Å; R1842-R1847 WeakPolarHBondContact O-CB 3.38Å; R1842-R1847 PolarHBondContact O-N 3.49Å; M1845-R1847 PolarHBondContact O-N 2.78Å
1848	S	47.8	Very low	50.6	Low	43 Å²	43	87.4 Å²	87.4	30%	0.301	46%	0.457	S	S	.	.	S	Bend	trans	-144	140.2	176.9	54	0	0	0	0	112	R1842 I1843	R1842-S1848 WeakPolarHBondContact CB-OG 3.48Å; R1842-S1848 PolarHBondContact O-N 2.87Å; I1843-S1848 WeakPolarHBondContact CA-O 3.47Å; I1843-S1848 WeakPolarHBondContact CG1-O 3.46Å; I1843-S1848 PolarHBondContact N-OG 3.45Å
1849	R	42	Very low	49.3	Very low	170 Å²	170	90.9 Å²	90.9	64%	0.642	47%	0.469	S	S	*	.			trans	-73.6	139.7	176.4	-153.1	176.8	-165.4	160.4	6.9	110.1	S1851	R1849-S1851 PolarHBondContact O-N 3.22Å
1850	A	49.7	Very low	48	Very low	34 Å²	34	95.1 Å²	95.1	28%	0.281	48%	0.481	S	S	.	.			trans	-57.4	133.2	165.6	0	0	0	0	0	109.3	I1811 I1843 Y1852	I1811-A1850 HydrophobicContact CD1-CB 4.17Å; I1843-A1850 HydrophobicContact CD1-CB 4.49Å; A1850-Y1852 VanDerWaalsContact C-N 3.26Å; A1850-Y1852 PolarHBondContact O-N 3.47Å
1851	S	48.5	Very low	46.8	Very low	108 Å²	108	97.8 Å²	97.8	76%	0.755	49%	0.493	S	S	*	.	S	Bend	trans	-77.3	-5.5	-162.2	-43.3	0	0	0	0	115.3	R1849	R1849-S1851 PolarHBondContact O-N 3.22Å
1852	Y	45	Very low	45.7	Very low	168 Å²	168	101.9 Å²	101.9	66%	0.659	51%	0.51	S	S	*	.	S	Bend	trans	-139.9	141.7	-179.4	-70.4	-90.7	0	0	0	109.6	A1850	A1850-Y1852 VanDerWaalsContact C-N 3.26Å; A1850-Y1852 PolarHBondContact O-N 3.47Å
1853	F	34.3	Very low	44.7	Very low	190 Å²	190	104.1 Å²	104.1	83%	0.833	52%	0.523	S	S	*	.			trans	-84.5	132.4	-172.5	-96.6	-100.1	0	0	0	112.3
1854	G	34.4	Very low	43.5	Very low	40 Å²	40	108.3 Å²	108.3	41%	0.412	55%	0.546	S	S	.	.			trans	-139.1	139.8	160	0	0	0	0	0	108.7	M1856	G1854-M1856 PolarHBondContact O-N 3.43Å
1855	K	32.2	Very low	42.4	Very low	224 Å²	224	108.9 Å²	108.9	97%	0.974	55%	0.55	S	S	*	*			trans	-71.9	99.9	-178.3	-83.1	-179.2	175.9	176.1	0	110
1856	M	35.2	Very low	41.2	Very low	81 Å²	81	116 Å²	116	40%	0.399	58%	0.581	S	S	.	*			trans	-119.7	136.1	164.7	-129.8	-174	-60.3	0	0	110.4	K1812 G1854 F1858	K1812-M1856 HydrophobicContact CD-CE 4.34Å; K1812-M1856 HydrophobicContact CG-CE 3.43Å; K1812-M1856 VanDerWaalsContact CG-CE 3.43Å; K1812-M1856 HydrophobicContact CG-SD 4.17Å; G1854-M1856 PolarHBondContact O-N 3.43Å; M1856-F1858 PolarHBondContact O-N 2.79Å
1857	S	34.7	Very low	40.4	Very low	102 Å²	102	117.9 Å²	117.9	71%	0.713	59%	0.587	S	S	*	*			trans	-75.2	78.9	-173.1	45	0	0	0	0	112.6	K1859	S1857-K1859 PolarHBondContact O-N 3.32Å
1858	F	45.2	Very low	39.8	Very low	126 Å²	126	118 Å²	118	55%	0.553	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	0.4	165.4	-87.1	-85.1	0	0	0	114.1	M1856 E1860 L1861 F1862	M1856-F1858 PolarHBondContact O-N 2.79Å; F1858-E1860 PolarHBondContact O-N 3.33Å; F1858-E1860 VanDerWaalsContact O-N 3.13Å; F1858-L1861 PolarHBondContact O-N 3.47Å; F1858-F1862 AromaticContact CD1-CD2 3.89Å; F1858-F1862 HydrophobicContact CD1-CD2 3.89Å; F1858-F1862 AromaticContact CD1-CE2 3.81Å; F1858-F1862 HydrophobicContact CD1-CE2 3.81Å; F1858-F1862 HydrophobicContact CE1-CE2 4.13Å
1859	K	39.4	Very low	39.3	Very low	103 Å²	103	118.8 Å²	118.8	45%	0.448	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.8	-9.5	-176.4	-113	-179.5	-175.8	177.5	0	114.8	S1775 S1857 K1863	S1775-K1859 PolarHBondContact OG-NZ 2.8Å; S1857-K1859 PolarHBondContact O-N 3.32Å; K1859-K1863 WeakPolarHBondContact O-CB 3Å; K1859-K1863 WeakPolarHBondContact O-CD 3.46Å; K1859-K1863 WeakPolarHBondContact O-CG 3.18Å
1860	E	37.5	Very low	39.5	Very low	154 Å²	154	113.5 Å²	113.5	72%	0.72	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-42	174.9	-71.2	175.7	169.1	0	0	112.8	F1858 F1862	F1858-E1860 PolarHBondContact O-N 3.33Å; F1858-E1860 VanDerWaalsContact O-N 3.13Å; E1860-F1862 PolarHBondContact O-N 2.78Å; E1860-F1862 VanDerWaalsContact O-N 3.16Å
1861	L	41	Very low	39.3	Very low	101 Å²	101	118.6 Å²	118.6	53%	0.529	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.7	-18.2	-177.8	-111.1	158.2	0	0	0	114.2	F1858	F1858-L1861 PolarHBondContact O-N 3.47Å
1862	F	44.6	Very low	39.7	Very low	115 Å²	115	114 Å²	114	50%	0.504	59%	0.59	S	S	.	*	S	Bend	trans	-121	-5.2	-178.2	-79.9	-88.5	0	0	0	115.1	F1858 E1860 N1864 A1865	F1858-F1862 AromaticContact CD1-CD2 3.89Å; F1858-F1862 HydrophobicContact CD1-CD2 3.89Å; F1858-F1862 AromaticContact CD1-CE2 3.81Å; F1858-F1862 HydrophobicContact CD1-CE2 3.81Å; F1858-F1862 HydrophobicContact CE1-CE2 4.13Å; E1860-F1862 PolarHBondContact O-N 2.78Å; E1860-F1862 VanDerWaalsContact O-N 3.16Å; F1862-N1864 VanDerWaalsContact C-N 3.28Å; F1862-N1864 PolarHBondContact O-N 3.38Å; F1862-A1865 HydrophobicContact CD1-CB 4.17Å; F1862-A1865 PolarHBondContact O-N 3.07Å
1863	K	41.2	Very low	40.5	Very low	155 Å²	155	109.9 Å²	109.9	67%	0.674	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-28	-174.4	-111.3	-173.5	-172.2	-173	0	114	K1859	K1859-K1863 WeakPolarHBondContact O-CB 3Å; K1859-K1863 WeakPolarHBondContact O-CD 3.46Å; K1859-K1863 WeakPolarHBondContact O-CG 3.18Å
1864	N	34.7	Very low	42.3	Very low	148 Å²	148	101.1 Å²	101.1	79%	0.791	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	11.6	179.3	-62.3	5.8	0	0	0	112.4	F1862 F1866	F1862-N1864 VanDerWaalsContact C-N 3.28Å; F1862-N1864 PolarHBondContact O-N 3.38Å; N1864-F1866 PolarHBondContact O-N 2.73Å
1865	A	38.3	Very low	44.2	Very low	57 Å²	57	101 Å²	101	47%	0.471	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	16.1	-166.6	0	0	0	0	0	115.1	F1862	F1862-A1865 HydrophobicContact CD1-CB 4.17Å; F1862-A1865 PolarHBondContact O-N 3.07Å
1866	F	36.4	Very low	46.2	Very low	177 Å²	177	90.3 Å²	90.3	78%	0.776	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	3.2	-174.2	-95.1	-83.6	0	0	0	115.2	N1864	N1864-F1866 PolarHBondContact O-N 2.73Å
1867	T	35.6	Very low	47.8	Very low	94 Å²	94	88 Å²	88	58%	0.577	47%	0.47	S	S	*	.	S	Bend	trans	-113.4	150.9	175.6	38.2	0	0	0	0	112
1868	P	38.7	Very low	49.4	Very low	87 Å²	87	86.2 Å²	86.2	57%	0.565	45%	0.45	S	S	*	.	S	Bend	trans	-78.8	158.5	-150.7	31.7	-37.3	0	0	0	114	G1870	P1868-G1870 PolarHBondContact O-N 3.02Å
1869	M	36.9	Very low	50.3	Low	60 Å²	60	89.3 Å²	89.3	30%	0.296	46%	0.459	S	S	.	.	S	Bend	trans	61.5	-22	174.8	-105.2	-178.6	-175.4	0	0	118.3	C1335 V1337 N1871 Y1899 P1947	C1335-M1869 HydrophobicContact CB-CE 3.93Å; C1335-M1869 HydrophobicContact CB-SD 3.76Å; V1337-M1869 HydrophobicContact CG2-CE 3.19Å; V1337-M1869 HydrophobicContact CG2-CG 3.81Å; V1337-M1869 HydrophobicContact CG2-SD 3.59Å; V1337-M1869 VanDerWaalsContact CG2-SD 3.59Å; M1869-N1871 PolarHBondContact O-N 2.85Å; M1869-Y1899 WeakPolarHBondContact CE-O 3.45Å; M1869-P1947 HydrophobicContact CE-CG 3.63Å; M1869-P1947 HydrophobicContact CG-CG 4.08Å; M1869-P1947 HydrophobicContact SD-CG 3.71Å
1870	G	46.1	Very low	51.6	Low	60 Å²	60	86.7 Å²	86.7	62%	0.619	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	96.8	-167.3	0	0	0	0	0	115.4	P1868	P1868-G1870 PolarHBondContact O-N 3.02Å
1871	N	45.3	Very low	52.9	Low	141 Å²	141	81.5 Å²	81.5	75%	0.754	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.3	36.1	167	-50.8	-18.9	0	0	0	117.3	M1869 F1873 S1949	M1869-N1871 PolarHBondContact O-N 2.85Å; N1871-F1873 PolarHBondContact O-N 2.84Å; N1871-F1873 VanDerWaalsContact O-N 3.15Å; N1871-S1949 PolarHBondContact O-OG 2.78Å
1872	G	56.5	Low	54.4	Low	12 Å²	12	77.8 Å²	77.8	12%	0.124	41%	0.413	C	S	.	.				70	20.6	124.2	0	0	0	0	0	121	C1874 C1948 S1949 I1950	G1872-C1874 PolarHBondContact O-N 2.75Å; G1872-C1948 CarbonylContact O-C 3.48Å; G1872-C1948 VanDerWaalsContact O-CA 3.29Å; G1872-C1948 WeakPolarHBondContact O-CA 3.34Å; G1872-S1949 VanDerWaalsContact CA-OG 3.22Å; G1872-S1949 WeakPolarHBondContact CA-OG 3.41Å; G1872-S1949 PolarHBondContact O-N 3.03Å; G1872-S1949 PolarHBondContact O-OG 3.48Å; G1872-I1950 PolarHBondContact O-N 3.46Å
1873	F	63	Low	55.5	Low	80 Å²	80	73 Å²	73	35%	0.351	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	124.9	167.2	-84.2	-93.1	0	0	0	112.6	R1631 N1871 I1950 V1952	R1631-F1873 PolarHBondContact NH2-O 3.04Å; R1631-F1873 VanDerWaalsContact NH2-O 3.13Å; N1871-F1873 PolarHBondContact O-N 2.84Å; N1871-F1873 VanDerWaalsContact O-N 3.15Å; F1873-I1950 WeakPolarHBondContact CA-O 3.42Å; F1873-I1950 HydrophobicContact CD1-CB 3.93Å; F1873-I1950 HydrophobicContact CD1-CG2 3.78Å; F1873-I1950 HydrophobicContact CD2-CB 4.49Å; F1873-I1950 HydrophobicContact CD2-CD1 4.36Å; F1873-I1950 HydrophobicContact CE1-CB 3.86Å; F1873-I1950 HydrophobicContact CE1-CD1 4.06Å; F1873-I1950 HydrophobicContact CE1-CG2 3.43Å; F1873-I1950 VanDerWaalsContact CE1-CG2 3.43Å; F1873-I1950 HydrophobicContact CE2-CB 4.43Å; F1873-I1950 HydrophobicContact CE2-CD1 3.62Å; F1873-I1950 HydrophobicContact CG-CB 4.26Å; F1873-I1950 HydrophobicContact CZ-CB 4.13Å; F1873-I1950 HydrophobicContact CZ-CD1 3.44Å; F1873-I1950 VanDerWaalsContact CZ-CD1 3.44Å; F1873-I1950 HydrophobicContact CZ-CG1 4.36Å; F1873-I1950 HydrophobicContact CZ-CG2 3.98Å; F1873-V1952 HydrophobicContact CD1-CG2 3.97Å; F1873-V1952 HydrophobicContact CE1-CG2 4.18Å
1874	C	72.1	Confident	56.8	Low	7 Å²	7	70.6 Å²	70.6	5%	0.047	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	142	172.1	-70.1	0	0	0	0	110.6	G1872 A1943 C1948 I1950 L1951 V1952	G1872-C1874 PolarHBondContact O-N 2.75Å; C1874-A1943 WeakPolarHBondContact CB-O 3.33Å; C1874-C1948 HydrophobicContact CB-CB 3.79Å; C1874-C1948 WeakPolarHBondContact CB-SG 3.41Å; C1874-C1948 WeakPolarHBondContact SG-CA 3.46Å; C1874-C1948 WeakPolarHBondContact SG-CB 3.32Å; C1874-C1948 CovalentContact SG-SG 2.03Å; C1874-C1948 PolarHBondContact SG-SG 3.18Å; C1874-I1950 PolarHBondContact N-O 3.38Å; C1874-L1951 HydrophobicContact CB-CD1 3.83Å; C1874-V1952 PolarHBondContact O-N 2.99Å
1875	Y	72.9	Confident	58.3	Low	36 Å²	36	64.7 Å²	64.7	14%	0.141	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	128	-171.3	176.2	-115.3	0	0	0	114.2	M1845 P1877 V1952 D1954	M1845-Y1875 HydrophobicContact CE-CD1 4.3Å; M1845-Y1875 HydrophobicContact CE-CD2 3.55Å; M1845-Y1875 HydrophobicContact CE-CE1 4.1Å; M1845-Y1875 HydrophobicContact CE-CE2 3.32Å; M1845-Y1875 HydrophobicContact CE-CG 4.01Å; M1845-Y1875 HydrophobicContact SD-CD1 4.03Å; M1845-Y1875 HydrophobicContact SD-CD2 3.27Å; M1845-Y1875 WeakPolarHBondContact SD-CD2 3.46Å; M1845-Y1875 HydrophobicContact SD-CE1 4.43Å; M1845-Y1875 HydrophobicContact SD-CE2 3.77Å; M1845-Y1875 HydrophobicContact SD-CG 3.38Å; Y1875-P1877 HydrophobicContact CD1-CB 4.47Å; Y1875-P1877 HydrophobicContact CE1-CB 3.69Å; Y1875-P1877 HydrophobicContact CE1-CG 4.45Å; Y1875-V1952 CarbonylContact C-O 3.57Å; Y1875-V1952 VanDerWaalsContact CA-O 3.32Å; Y1875-V1952 WeakPolarHBondContact CA-O 3.41Å; Y1875-V1952 HydrophobicContact CD2-CB 4.03Å; Y1875-V1952 HydrophobicContact CD2-CG1 3.79Å; Y1875-V1952 HydrophobicContact CE2-CG1 4.15Å; Y1875-D1954 HydrophobicContact CE2-CB 3.96Å
1876	C	75.3	Confident	59.9	Low	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.3	166.2	-168.2	0	0	0	0	110.3	S1939 A1943 V1952 L1953 D1954	C1876-S1939 PolarHBondContact SG-OG 3.01Å; C1876-S1939 VanDerWaalsContact SG-OG 3.32Å; C1876-A1943 HydrophobicContact CB-CB 4.16Å; C1876-V1952 PolarHBondContact N-O 2.93Å; C1876-L1953 HydrophobicContact CB-CD2 3.47Å; C1876-L1953 VanDerWaalsContact CB-CD2 3.47Å; C1876-D1954 PolarHBondContact O-N 3.05Å
1877	P	68.7	Low	62.2	Low	34 Å²	34	54.3 Å²	54.3	22%	0.221	30%	0.3	C	S	.	.			trans	-68.7	162.5	179.7	26.7	-33.8	0	0	0	113.5	Y1875 W1879 A1881 R1936	Y1875-P1877 HydrophobicContact CD1-CB 4.47Å; Y1875-P1877 HydrophobicContact CE1-CB 3.69Å; Y1875-P1877 HydrophobicContact CE1-CG 4.45Å; P1877-W1879 VanDerWaalsContact C-N 3.27Å; P1877-W1879 WeakPolarHBondContact CG-O 3.44Å; P1877-W1879 PolarHBondContact O-N 2.69Å; P1877-A1881 HydrophobicContact CG-CB 4.23Å; P1877-R1936 VanDerWaalsContact O-CZ 3.25Å; P1877-R1936 PolarHBondContact O-NH1 3.19Å; P1877-R1936 PolarHBondContact O-NH2 3.42Å
1878	Q	67	Low	64.6	Low	64 Å²	64	49.9 Å²	49.9	30%	0.299	27%	0.272	S	S	.	.	S	Bend	trans	-58.7	-34.6	174.1	-171.3	-178.1	23.5	0	0	113.6	D1954 E1955	Q1878-D1954 WeakPolarHBondContact CA-O 3.44Å; Q1878-E1955 HydrophobicContact CG-CB 4.41Å; Q1878-E1955 HydrophobicContact CG-CG 4.44Å; Q1878-E1955 WeakPolarHBondContact CG-OE2 3.41Å; Q1878-E1955 VanDerWaalsContact NE2-CD 3.32Å; Q1878-E1955 PolarHBondContact NE2-OE2 3.14Å
1879	W	65.5	Low	66.9	Low	191 Å²	191	50.1 Å²	50.1	72%	0.723	26%	0.262	S	S	*	.	S	Bend	trans	-106.3	136	-179.9	-55.2	86.6	0	0	0	109.9	P1877 A1881	P1877-W1879 VanDerWaalsContact C-N 3.27Å; P1877-W1879 WeakPolarHBondContact CG-O 3.44Å; P1877-W1879 PolarHBondContact O-N 2.69Å; W1879-A1881 PolarHBondContact O-N 3.18Å
1880	D	65.7	Low	69.2	Low	48 Å²	48	49.4 Å²	49.4	26%	0.257	26%	0.258	S	S	.	.			trans	-68.9	97.1	-178.4	-58.1	-33.8	0	0	0	110.9	L1882 R1935 R1936	D1880-L1882 HydrophobicContact CB-CD1 4.39Å; D1880-L1882 HydrophobicContact CB-CG 4.37Å; D1880-L1882 PolarHBondContact O-N 3.02Å; D1880-R1935 HydrophobicContact CB-CB 4.21Å; D1880-R1935 WeakPolarHBondContact OD2-CB 3.38Å; D1880-R1936 WeakPolarHBondContact OD1-CD 3.26Å; D1880-R1936 IonicContact OD1-CZ 3.52Å; D1880-R1936 IonicContact OD1-NE 3.62Å; D1880-R1936 IonicContact OD1-NH1 2.64Å; D1880-R1936 PolarHBondContact OD1-NH1 2.9Å
1881	A	64.7	Low	71.1	Confident	44 Å²	44	46.7 Å²	46.7	36%	0.364	23%	0.229	S	C	.	.			trans	-78	43.4	-173.7	0	0	0	0	0	113.7	P1877 W1879	P1877-A1881 HydrophobicContact CG-CB 4.23Å; W1879-A1881 PolarHBondContact O-N 3.18Å
1882	L	73.3	Confident	73.1	Confident	24 Å²	24	40 Å²	40	13%	0.126	19%	0.193	C	C	.	.			trans	-93.4	143.2	-174	-56.6	177.2	0	0	0	111.8	D1880 E1884 T1891 R1935 L1938	D1880-L1882 HydrophobicContact CB-CD1 4.39Å; D1880-L1882 HydrophobicContact CB-CG 4.37Å; D1880-L1882 PolarHBondContact O-N 3.02Å; L1882-E1884 PolarHBondContact O-N 2.94Å; L1882-T1891 HydrophobicContact CD2-CG2 4.02Å; L1882-R1935 HydrophobicContact CD1-CB 3.93Å; L1882-R1935 HydrophobicContact CD1-CG 4.36Å; L1882-R1935 VanDerWaalsContact CD1-O 3.31Å; L1882-R1935 WeakPolarHBondContact CD1-O 3.38Å; L1882-L1938 HydrophobicContact CD1-CB 4.06Å; L1882-L1938 HydrophobicContact CD1-CD2 3.94Å; L1882-L1938 HydrophobicContact CD1-CG 3.99Å; L1882-L1938 HydrophobicContact CD2-CD2 4.46Å; L1882-L1938 HydrophobicContact CD2-CG 4.1Å
1883	D	66.8	Low	74.5	Confident	15 Å²	15	41.5 Å²	41.5	8%	0.08	20%	0.2	C	C	.	.			trans	-79.5	113.3	173.6	-154.9	-51.9	0	0	0	109.9	R1349 K1353 S1885 L1886 N1927	R1349-D1883 IonicContact CZ-OD2 3.57Å; R1349-D1883 IonicContact NE-OD2 3.94Å; R1349-D1883 PolarHBondContact NE-OD2 3.29Å; R1349-D1883 IonicContact NH2-OD2 3.94Å; R1349-D1883 PolarHBondContact NH2-OD2 2.86Å; K1353-D1883 IonicContact NZ-OD1 2.65Å; K1353-D1883 PolarHBondContact NZ-OD1 2.71Å; K1353-D1883 IonicContact NZ-OD2 2.76Å; K1353-D1883 PolarHBondContact NZ-OD2 3.47Å; D1883-S1885 PolarHBondContact O-N 3.37Å; D1883-S1885 PolarHBondContact OD1-N 2.9Å; D1883-S1885 PolarHBondContact OD1-OG 3.46Å; D1883-L1886 HydrophobicContact CB-CD1 4Å; D1883-L1886 HydrophobicContact CB-CG 4.1Å; D1883-L1886 PolarHBondContact O-N 3.13Å; D1883-N1927 WeakPolarHBondContact O-CB 3.27Å; D1883-N1927 PolarHBondContact O-ND2 3.48Å
1884	E	69.7	Low	75.5	Confident	103 Å²	103	38.4 Å²	38.4	48%	0.481	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17	-176.1	-66.4	-156.1	135.2	0	0	114.3	L1882 S1928 R1935	L1882-E1884 PolarHBondContact O-N 2.94Å; E1884-S1928 PolarHBondContact O-N 3.26Å; E1884-R1935 IonicContact OE1-CZ 2.74Å; E1884-R1935 VanDerWaalsContact OE1-CZ 3.23Å; E1884-R1935 IonicContact OE1-NH1 3.48Å; E1884-R1935 PolarHBondContact OE1-NH1 3.26Å; E1884-R1935 IonicContact OE1-NH2 2.67Å; E1884-R1935 PolarHBondContact OE1-NH2 3.3Å
1885	S	66.1	Low	75.9	Confident	25 Å²	25	39.8 Å²	39.8	18%	0.175	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-20.8	-179	67.9	0	0	0	0	115	R1356 D1883	R1356-S1885 PolarHBondContact NH1-O 3.49Å; D1883-S1885 PolarHBondContact O-N 3.37Å; D1883-S1885 PolarHBondContact OD1-N 2.9Å; D1883-S1885 PolarHBondContact OD1-OG 3.46Å
1886	L	72.6	Confident	76.4	Confident	5 Å²	5	38 Å²	38	3%	0.026	18%	0.184	C	C	.	.	S	Bend	trans	-86.2	159.1	-179.8	-63.7	179.1	0	0	0	111.7	R1349 L1352 D1883 E1890 K1926 N1927	R1349-L1886 HydrophobicContact CG-CD1 4.35Å; L1352-L1886 HydrophobicContact CB-CD2 4.3Å; L1352-L1886 HydrophobicContact CD1-CD2 4.21Å; D1883-L1886 HydrophobicContact CB-CD1 4Å; D1883-L1886 HydrophobicContact CB-CG 4.1Å; D1883-L1886 PolarHBondContact O-N 3.13Å; L1886-E1890 WeakPolarHBondContact CA-OE2 3.3Å; L1886-E1890 HydrophobicContact CB-CB 4.28Å; L1886-E1890 HydrophobicContact CD2-CB 4.34Å; L1886-K1926 WeakPolarHBondContact O-CA 3.33Å; L1886-N1927 PolarHBondContact O-N 2.86Å
1887	T	83.8	Confident	76.4	Confident	11 Å²	11	38.1 Å²	38.1	7%	0.067	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-82.9	165.7	167.1	66.9	0	0	0	0	111.8	R1889 E1890 T1891 D1924 T1925	T1887-R1889 VanDerWaalsContact C-N 3.31Å; T1887-R1889 PolarHBondContact O-N 2.77Å; T1887-E1890 PolarHBondContact N-OE2 3.43Å; T1887-E1890 PolarHBondContact O-N 2.7Å; T1887-E1890 WeakPolarHBondContact OG1-CB 3.49Å; T1887-E1890 WeakPolarHBondContact OG1-CG 3.48Å; T1887-E1890 PolarHBondContact OG1-N 3.42Å; T1887-E1890 PolarHBondContact OG1-OE2 3.42Å; T1887-T1891 WeakPolarHBondContact O-CB 3.09Å; T1887-T1891 PolarHBondContact O-N 3.33Å; T1887-T1891 PolarHBondContact O-OG1 3.26Å; T1887-D1924 WeakPolarHBondContact CG2-O 3.26Å; T1887-T1925 WeakPolarHBondContact CA-O 3.33Å; T1887-T1925 WeakPolarHBondContact CB-O 3.24Å
1888	V	85	Confident	76.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-54.8	-49.7	174.1	-177.3	0	0	0	0	110.1	T1891 L1892 L1914 M1919 I1922 A1923 T1925 L1930 L1938	V1888-T1891 WeakPolarHBondContact O-CB 3.41Å; V1888-T1891 PolarHBondContact O-N 3.44Å; V1888-L1892 HydrophobicContact CG1-CD1 4.48Å; V1888-L1892 WeakPolarHBondContact O-CG 3.23Å; V1888-L1892 PolarHBondContact O-N 3.16Å; V1888-L1914 HydrophobicContact CG1-CD2 3.76Å; V1888-M1919 HydrophobicContact CG1-CB 4.37Å; V1888-M1919 HydrophobicContact CG1-CE 4.32Å; V1888-M1919 HydrophobicContact CG1-SD 4.05Å; V1888-I1922 HydrophobicContact CG2-CG2 4.39Å; V1888-I1922 WeakPolarHBondContact CG2-O 3.33Å; V1888-A1923 WeakPolarHBondContact CB-O 3.44Å; V1888-A1923 PolarHBondContact N-O 3.5Å; V1888-T1925 PolarHBondContact N-O 2.83Å; V1888-L1930 HydrophobicContact CG2-CD1 3.88Å; V1888-L1930 HydrophobicContact CG2-CD2 3.84Å; V1888-L1930 HydrophobicContact CG2-CG 4.35Å; V1888-L1938 HydrophobicContact CB-CD2 4.33Å; V1888-L1938 HydrophobicContact CG1-CD1 3.92Å; V1888-L1938 HydrophobicContact CG1-CD2 4.14Å; V1888-L1938 HydrophobicContact CG2-CD2 4.31Å
1889	R	87.9	Confident	76.9	Confident	92 Å²	92	37.1 Å²	37.1	35%	0.347	18%	0.177	S	C	.	.	H	α-helix	trans	-59.6	-49	178.9	-168.4	-165.1	-57.6	-112	5.7	111.9	T1887 T1891 L1892 V1893 V1910 L1914 A1923 D1924	T1887-R1889 VanDerWaalsContact C-N 3.31Å; T1887-R1889 PolarHBondContact O-N 2.77Å; R1889-T1891 VanDerWaalsContact C-N 3.3Å; R1889-T1891 PolarHBondContact O-N 2.93Å; R1889-L1892 PolarHBondContact O-N 3.32Å; R1889-V1893 WeakPolarHBondContact O-CG2 3.41Å; R1889-V1893 PolarHBondContact O-N 3.43Å; R1889-V1910 HydrophobicContact CG-CG1 4.31Å; R1889-L1914 HydrophobicContact CG-CD1 4.33Å; R1889-A1923 HydrophobicContact CB-CB 4.39Å; R1889-A1923 WeakPolarHBondContact CB-O 3.32Å; R1889-A1923 PolarHBondContact N-O 3.41Å; R1889-D1924 IonicContact CZ-OD1 3.51Å; R1889-D1924 IonicContact CZ-OD2 2.72Å; R1889-D1924 IonicContact NE-OD1 3.03Å; R1889-D1924 PolarHBondContact NE-OD1 2.77Å; R1889-D1924 IonicContact NE-OD2 2.89Å; R1889-D1924 VanDerWaalsContact NH2-CG 3.33Å; R1889-D1924 IonicContact NH2-OD1 3.55Å; R1889-D1924 PolarHBondContact NH2-OD1 3.14Å; R1889-D1924 IonicContact NH2-OD2 3.31Å; R1889-D1924 PolarHBondContact NH2-OD2 2.97Å
1890	E	86.2	Confident	76.9	Confident	46 Å²	46	28.5 Å²	28.5	22%	0.215	15%	0.147	C	C	.	.	H	α-helix	trans	-63.2	-37	179.1	-74.3	161	-172.1	0	0	112.7	R1356 L1886 T1887 L1892 V1893 F1894	R1356-E1890 IonicContact CZ-OE1 2.66Å; R1356-E1890 IonicContact CZ-OE2 3.69Å; R1356-E1890 IonicContact NH1-OE1 3.17Å; R1356-E1890 PolarHBondContact NH1-OE1 3.17Å; R1356-E1890 IonicContact NH1-OE2 3.61Å; R1356-E1890 PolarHBondContact NH1-OE2 2.82Å; R1356-E1890 IonicContact NH2-OE1 3.14Å; R1356-E1890 PolarHBondContact NH2-OE1 3.33Å; R1356-E1890 IonicContact NH2-OE2 3.39Å; R1356-E1890 PolarHBondContact NH2-OE2 3.11Å; L1886-E1890 WeakPolarHBondContact CA-OE2 3.3Å; L1886-E1890 HydrophobicContact CB-CB 4.28Å; L1886-E1890 HydrophobicContact CD2-CB 4.34Å; T1887-E1890 PolarHBondContact N-OE2 3.43Å; T1887-E1890 PolarHBondContact O-N 2.7Å; T1887-E1890 WeakPolarHBondContact OG1-CB 3.49Å; T1887-E1890 WeakPolarHBondContact OG1-CG 3.48Å; T1887-E1890 PolarHBondContact OG1-N 3.42Å; T1887-E1890 PolarHBondContact OG1-OE2 3.42Å; E1890-L1892 VanDerWaalsContact C-N 3.34Å; E1890-V1893 PolarHBondContact O-N 3.39Å; E1890-F1894 VanDerWaalsContact O-CB 3.23Å; E1890-F1894 WeakPolarHBondContact O-CB 3.27Å; E1890-F1894 PolarHBondContact O-N 2.97Å
1891	T	85.4	Confident	77.3	Confident	2 Å²	2	27 Å²	27	1%	0.012	14%	0.14	C	C	.	.	H	α-helix	trans	-63.2	-44.8	176	-55.1	0	0	0	0	110	L1882 T1887 V1888 R1889 F1894 Y1895 N1927 L1938	L1882-T1891 HydrophobicContact CD2-CG2 4.02Å; T1887-T1891 WeakPolarHBondContact O-CB 3.09Å; T1887-T1891 PolarHBondContact O-N 3.33Å; T1887-T1891 PolarHBondContact O-OG1 3.26Å; V1888-T1891 WeakPolarHBondContact O-CB 3.41Å; V1888-T1891 PolarHBondContact O-N 3.44Å; R1889-T1891 VanDerWaalsContact C-N 3.3Å; R1889-T1891 PolarHBondContact O-N 2.93Å; T1891-F1894 PolarHBondContact O-N 3.44Å; T1891-Y1895 HydrophobicContact CG2-CD2 3.93Å; T1891-Y1895 HydrophobicContact CG2-CE2 3.95Å; T1891-Y1895 WeakPolarHBondContact O-CD2 3.42Å; T1891-Y1895 PolarHBondContact O-N 3.46Å; T1891-N1927 PolarHBondContact OG1-ND2 3.34Å; T1891-L1938 HydrophobicContact CG2-CD1 4.18Å; T1891-L1938 HydrophobicContact CG2-CD2 4.17Å; T1891-L1938 HydrophobicContact CG2-CG 4.22Å
1892	L	87.5	Confident	77.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.6	-44.7	176.1	-65	175.7	0	0	0	111.9	V1888 R1889 E1890 F1894 Y1895 A1896 V1910 L1914 L1938 A1941 M1945	V1888-L1892 HydrophobicContact CG1-CD1 4.48Å; V1888-L1892 WeakPolarHBondContact O-CG 3.23Å; V1888-L1892 PolarHBondContact O-N 3.16Å; R1889-L1892 PolarHBondContact O-N 3.32Å; E1890-L1892 VanDerWaalsContact C-N 3.34Å; L1892-F1894 VanDerWaalsContact C-N 3.31Å; L1892-F1894 PolarHBondContact O-N 3.31Å; L1892-Y1895 PolarHBondContact O-N 2.83Å; L1892-A1896 VanDerWaalsContact O-CB 3.28Å; L1892-A1896 WeakPolarHBondContact O-CB 3.22Å; L1892-A1896 PolarHBondContact O-N 3.36Å; L1892-V1910 HydrophobicContact CB-CB 4.4Å; L1892-V1910 HydrophobicContact CB-CG1 3.76Å; L1892-V1910 HydrophobicContact CB-CG2 3.92Å; L1892-V1910 HydrophobicContact CD1-CG1 4.27Å; L1892-L1914 HydrophobicContact CD1-CD2 3.58Å; L1892-L1914 HydrophobicContact CD1-CG 3.65Å; L1892-L1938 HydrophobicContact CD1-CD1 4.39Å; L1892-L1938 HydrophobicContact CD2-CD1 3.59Å; L1892-L1938 HydrophobicContact CG-CD1 3.73Å; L1892-A1941 HydrophobicContact CD2-CB 3.83Å; L1892-M1945 HydrophobicContact CB-CE 4.05Å; L1892-M1945 HydrophobicContact CB-SD 3.96Å; L1892-M1945 HydrophobicContact CD2-CE 3.52Å; L1892-M1945 HydrophobicContact CD2-SD 3.9Å; L1892-M1945 HydrophobicContact CG-CE 4.39Å; L1892-M1945 VanDerWaalsContact O-CE 3.25Å; L1892-M1945 WeakPolarHBondContact O-CE 3.44Å; L1892-M1945 VanDerWaalsContact O-SD 3.35Å
1893	V	86.2	Confident	77.5	Confident	44 Å²	44	32.6 Å²	32.6	27%	0.267	16%	0.162	S	C	.	.	H	α-helix	trans	-59.2	-40.5	175	171.7	0	0	0	0	111.9	R1889 E1890 A1897 V1910	R1889-V1893 WeakPolarHBondContact O-CG2 3.41Å; R1889-V1893 PolarHBondContact O-N 3.43Å; E1890-V1893 PolarHBondContact O-N 3.39Å; V1893-A1897 WeakPolarHBondContact O-CB 3.36Å; V1893-A1897 PolarHBondContact O-N 3.32Å; V1893-V1910 HydrophobicContact CG2-CB 4.48Å; V1893-V1910 HydrophobicContact CG2-CG1 4.22Å; V1893-V1910 HydrophobicContact CG2-CG2 3.97Å
1894	F	83.2	Confident	78	Confident	16 Å²	16	37.9 Å²	37.9	7%	0.07	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-50.2	177.8	170.7	-105.8	0	0	0	112.1	A1345 I1346 R1349 E1890 T1891 L1892 A1897 L1898	A1345-F1894 HydrophobicContact CB-CD2 4.19Å; A1345-F1894 HydrophobicContact CB-CE2 4.34Å; A1345-F1894 WeakPolarHBondContact O-CD2 3.36Å; A1345-F1894 WeakPolarHBondContact O-CE2 3.36Å; I1346-F1894 HydrophobicContact CG1-CE2 4.47Å; R1349-F1894 HydrophobicContact CB-CD2 3.81Å; R1349-F1894 HydrophobicContact CB-CE2 3.7Å; R1349-F1894 HydrophobicContact CB-CZ 4.46Å; R1349-F1894 VanDerWaalsContact CD-CZ 3.41Å; R1349-F1894 HydrophobicContact CG-CD2 4.44Å; R1349-F1894 HydrophobicContact CG-CE2 4.23Å; E1890-F1894 VanDerWaalsContact O-CB 3.23Å; E1890-F1894 WeakPolarHBondContact O-CB 3.27Å; E1890-F1894 PolarHBondContact O-N 2.97Å; T1891-F1894 PolarHBondContact O-N 3.44Å; L1892-F1894 VanDerWaalsContact C-N 3.31Å; L1892-F1894 PolarHBondContact O-N 3.31Å; F1894-A1897 PolarHBondContact O-N 2.91Å; F1894-L1898 HydrophobicContact CD1-CD1 4.14Å; F1894-L1898 HydrophobicContact CE1-CD1 3.46Å; F1894-L1898 VanDerWaalsContact CE1-CD1 3.46Å; F1894-L1898 HydrophobicContact CE1-CG 4.31Å; F1894-L1898 HydrophobicContact CE2-CD1 4.18Å; F1894-L1898 HydrophobicContact CE2-CG 4.25Å; F1894-L1898 HydrophobicContact CZ-CD1 3.48Å; F1894-L1898 VanDerWaalsContact CZ-CD1 3.48Å; F1894-L1898 HydrophobicContact CZ-CD2 4.44Å; F1894-L1898 HydrophobicContact CZ-CG 4.05Å; F1894-L1898 PolarHBondContact O-N 3.14Å
1895	Y	81.1	Confident	78.4	Confident	35 Å²	35	35.4 Å²	35.4	14%	0.137	19%	0.189	C	C	.	.	H	α-helix	trans	-69.5	-37.5	179.4	-82.2	-79.1	0	0	0	112.1	T1891 L1892 A1897 L1898 Y1899 M1945	T1891-Y1895 HydrophobicContact CG2-CD2 3.93Å; T1891-Y1895 HydrophobicContact CG2-CE2 3.95Å; T1891-Y1895 WeakPolarHBondContact O-CD2 3.42Å; T1891-Y1895 PolarHBondContact O-N 3.46Å; L1892-Y1895 PolarHBondContact O-N 2.83Å; Y1895-A1897 VanDerWaalsContact C-N 3.29Å; Y1895-A1897 PolarHBondContact O-N 3.32Å; Y1895-L1898 HydrophobicContact CD1-CD1 4.12Å; Y1895-L1898 HydrophobicContact CE1-CD1 4.44Å; Y1895-L1898 WeakPolarHBondContact O-CB 3.17Å; Y1895-L1898 PolarHBondContact O-N 2.85Å; Y1895-L1898 VanDerWaalsContact O-N 3.12Å; Y1895-Y1899 HydrophobicContact CD1-CE2 4.35Å; Y1895-Y1899 WeakPolarHBondContact O-CD2 3.37Å; Y1895-Y1899 PolarHBondContact O-N 2.79Å; Y1895-M1945 VanDerWaalsContact CB-CE 3.4Å
1896	A	81.8	Confident	79.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.5	-39.5	172.2	0	0	0	0	0	112.3	L1892 Y1899 G1900 V1901 R1906 V1910 M1945	L1892-A1896 VanDerWaalsContact O-CB 3.28Å; L1892-A1896 WeakPolarHBondContact O-CB 3.22Å; L1892-A1896 PolarHBondContact O-N 3.36Å; A1896-Y1899 PolarHBondContact O-N 3.21Å; A1896-G1900 PolarHBondContact O-N 3.44Å; A1896-V1901 HydrophobicContact CB-CB 4.25Å; A1896-V1901 HydrophobicContact CB-CG2 4.17Å; A1896-V1901 WeakPolarHBondContact O-CB 3.3Å; A1896-V1901 WeakPolarHBondContact O-CG2 3.37Å; A1896-V1901 PolarHBondContact O-N 2.7Å; A1896-R1906 HydrophobicContact CB-CG 3.82Å; A1896-V1910 HydrophobicContact CB-CG2 4.2Å; A1896-M1945 HydrophobicContact CB-SD 3.86Å
1897	A	77.1	Confident	79.7	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	21%	0.212	C	C	.	.	H	α-helix	trans	-67.1	-38.3	173.2	0	0	0	0	0	112.5	A1345 V1893 F1894 Y1895 Y1899 G1900	A1345-A1897 HydrophobicContact CB-CB 3.6Å; V1893-A1897 WeakPolarHBondContact O-CB 3.36Å; V1893-A1897 PolarHBondContact O-N 3.32Å; F1894-A1897 PolarHBondContact O-N 2.91Å; Y1895-A1897 VanDerWaalsContact C-N 3.29Å; Y1895-A1897 PolarHBondContact O-N 3.32Å; A1897-Y1899 VanDerWaalsContact C-N 3.35Å; A1897-Y1899 PolarHBondContact O-N 3.43Å; A1897-G1900 PolarHBondContact O-N 3.48Å; A1897-G1900 VanDerWaalsContact O-N 3.12Å
1898	L	72.3	Confident	79.7	Confident	35 Å²	35	43.3 Å²	43.3	18%	0.183	23%	0.232	C	C	.	.	H	α-helix	trans	-63.3	-36.4	172.9	-75.6	179.3	0	0	0	113	Q1342 I1346 F1894 Y1895 G1900	Q1342-L1898 HydrophobicContact CB-CD2 4.33Å; Q1342-L1898 PolarHBondContact NE2-O 2.84Å; I1346-L1898 HydrophobicContact CD1-CD2 4.25Å; I1346-L1898 HydrophobicContact CG1-CD2 4.05Å; F1894-L1898 HydrophobicContact CD1-CD1 4.14Å; F1894-L1898 HydrophobicContact CE1-CD1 3.46Å; F1894-L1898 VanDerWaalsContact CE1-CD1 3.46Å; F1894-L1898 HydrophobicContact CE1-CG 4.31Å; F1894-L1898 HydrophobicContact CE2-CD1 4.18Å; F1894-L1898 HydrophobicContact CE2-CG 4.25Å; F1894-L1898 HydrophobicContact CZ-CD1 3.48Å; F1894-L1898 VanDerWaalsContact CZ-CD1 3.48Å; F1894-L1898 HydrophobicContact CZ-CD2 4.44Å; F1894-L1898 HydrophobicContact CZ-CG 4.05Å; F1894-L1898 PolarHBondContact O-N 3.14Å; Y1895-L1898 HydrophobicContact CD1-CD1 4.12Å; Y1895-L1898 HydrophobicContact CE1-CD1 4.44Å; Y1895-L1898 WeakPolarHBondContact O-CB 3.17Å; Y1895-L1898 PolarHBondContact O-N 2.85Å; Y1895-L1898 VanDerWaalsContact O-N 3.12Å; L1898-G1900 PolarHBondContact O-N 3.19Å
1899	Y	72.2	Confident	79.6	Confident	41 Å²	41	45.2 Å²	45.2	16%	0.161	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	5.1	174.2	-61.1	-64.2	0	0	0	113.8	M1869 Y1895 A1896 A1897 S1942 M1945 G1946	M1869-Y1899 WeakPolarHBondContact CE-O 3.45Å; Y1895-Y1899 HydrophobicContact CD1-CE2 4.35Å; Y1895-Y1899 WeakPolarHBondContact O-CD2 3.37Å; Y1895-Y1899 PolarHBondContact O-N 2.79Å; A1896-Y1899 PolarHBondContact O-N 3.21Å; A1897-Y1899 VanDerWaalsContact C-N 3.35Å; A1897-Y1899 PolarHBondContact O-N 3.43Å; Y1899-S1942 WeakPolarHBondContact CE2-O 3.28Å; Y1899-S1942 PolarHBondContact OH-O 3.29Å; Y1899-M1945 HydrophobicContact CD2-CB 3.87Å; Y1899-M1945 HydrophobicContact CE2-CB 4.14Å; Y1899-G1946 VanDerWaalsContact CG-CA 3.49Å
1900	G	66.8	Low	79.6	Confident	10 Å²	10	41 Å²	41	10%	0.103	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	17.9	175.7	0	0	0	0	0	115.2	A1896 A1897 L1898 S1902	A1896-G1900 PolarHBondContact O-N 3.44Å; A1897-G1900 PolarHBondContact O-N 3.48Å; A1897-G1900 VanDerWaalsContact O-N 3.12Å; L1898-G1900 PolarHBondContact O-N 3.19Å; G1900-S1902 PolarHBondContact O-N 3.05Å
1901	V	72.7	Confident	79.6	Confident	18 Å²	18	42 Å²	42	11%	0.109	24%	0.24	C	C	.	.			trans	-64.5	127.1	173.8	-176.1	0	0	0	0	109.6	A1896 R1906 V1909	A1896-V1901 HydrophobicContact CB-CB 4.25Å; A1896-V1901 HydrophobicContact CB-CG2 4.17Å; A1896-V1901 WeakPolarHBondContact O-CB 3.3Å; A1896-V1901 WeakPolarHBondContact O-CG2 3.37Å; A1896-V1901 PolarHBondContact O-N 2.7Å; V1901-R1906 HydrophobicContact CG1-CB 4.33Å; V1901-R1906 PolarHBondContact O-NE 3.47Å; V1901-R1906 PolarHBondContact O-NH2 3.29Å; V1901-V1909 HydrophobicContact CG1-CB 4.37Å; V1901-V1909 HydrophobicContact CG1-CG2 4.05Å
1902	S	70.4	Confident	79.7	Confident	54 Å²	54	48.4 Å²	48.4	38%	0.378	27%	0.265	S	S	.	.			trans	-53.1	147.5	-177.4	67.1	0	0	0	0	112.2	G1900 T1904 S1905 R1906	G1900-S1902 PolarHBondContact O-N 3.05Å; S1902-T1904 PolarHBondContact O-N 3.26Å; S1902-T1904 VanDerWaalsContact O-N 3.17Å; S1902-T1904 PolarHBondContact OG-OG1 3.38Å; S1902-S1905 PolarHBondContact O-N 2.77Å; S1902-S1905 VanDerWaalsContact OG-CB 3.29Å; S1902-S1905 WeakPolarHBondContact OG-CB 3.28Å; S1902-S1905 PolarHBondContact OG-N 3.1Å; S1902-S1905 PolarHBondContact OG-OG 3.28Å; S1902-S1905 VanDerWaalsContact OG-OG 3.14Å; S1902-R1906 VanDerWaalsContact O-CB 3.31Å; S1902-R1906 WeakPolarHBondContact O-CB 3.37Å; S1902-R1906 PolarHBondContact O-N 2.82Å
1903	K	73.5	Confident	79.7	Confident	130 Å²	130	50.7 Å²	50.7	57%	0.565	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-30.4	-176	-168.8	169.1	179.1	169.4	0	112.3	E1303	E1303-K1903 IonicContact OE1-NZ 2.61Å
1904	T	75.9	Confident	79.7	Confident	126 Å²	126	49.1 Å²	49.1	77%	0.773	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-52.3	174.1	44.4	0	0	0	0	112.6	S1902 R1906	S1902-T1904 PolarHBondContact O-N 3.26Å; S1902-T1904 VanDerWaalsContact O-N 3.17Å; S1902-T1904 PolarHBondContact OG-OG1 3.38Å; T1904-R1906 VanDerWaalsContact C-N 3.34Å; T1904-R1906 PolarHBondContact O-N 3.37Å
1905	S	79.5	Confident	79.7	Confident	51 Å²	51	55.2 Å²	55.2	36%	0.357	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-12.1	-177	-51.2	0	0	0	0	113.9	S1902 L1907 S1908 V1909	S1902-S1905 PolarHBondContact O-N 2.77Å; S1902-S1905 VanDerWaalsContact OG-CB 3.29Å; S1902-S1905 WeakPolarHBondContact OG-CB 3.28Å; S1902-S1905 PolarHBondContact OG-N 3.1Å; S1902-S1905 PolarHBondContact OG-OG 3.28Å; S1902-S1905 VanDerWaalsContact OG-OG 3.14Å; S1905-L1907 VanDerWaalsContact C-N 3.31Å; S1905-L1907 PolarHBondContact O-N 3.34Å; S1905-S1908 PolarHBondContact O-N 3.17Å; S1905-S1908 PolarHBondContact O-OG 2.88Å; S1905-V1909 WeakPolarHBondContact O-CB 3.44Å; S1905-V1909 WeakPolarHBondContact O-CG2 3.2Å; S1905-V1909 PolarHBondContact O-N 3.47Å
1906	R	81.2	Confident	79.6	Confident	22 Å²	22	57.8 Å²	57.8	8%	0.083	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-40.8	-177	-163.6	173.8	-60.5	159.6	2.6	113	A1896 V1901 S1902 T1904 V1910	A1896-R1906 HydrophobicContact CB-CG 3.82Å; V1901-R1906 HydrophobicContact CG1-CB 4.33Å; V1901-R1906 PolarHBondContact O-NE 3.47Å; V1901-R1906 PolarHBondContact O-NH2 3.29Å; S1902-R1906 VanDerWaalsContact O-CB 3.31Å; S1902-R1906 WeakPolarHBondContact O-CB 3.37Å; S1902-R1906 PolarHBondContact O-N 2.82Å; T1904-R1906 VanDerWaalsContact C-N 3.34Å; T1904-R1906 PolarHBondContact O-N 3.37Å; R1906-V1910 WeakPolarHBondContact O-CB 3.19Å; R1906-V1910 WeakPolarHBondContact O-CG2 3.41Å; R1906-V1910 PolarHBondContact O-N 2.87Å
1907	L	83.5	Confident	79.5	Confident	118 Å²	118	59 Å²	59	62%	0.618	31%	0.307	S	S	*	.	H	α-helix	trans	-72.1	-38.7	-179.6	-71.7	173.6	0	0	0	112.2	S1905 V1910 S1911	S1905-L1907 VanDerWaalsContact C-N 3.31Å; S1905-L1907 PolarHBondContact O-N 3.34Å; L1907-V1910 PolarHBondContact O-N 2.76Å; L1907-S1911 PolarHBondContact O-N 3.47Å; L1907-S1911 PolarHBondContact O-OG 3.34Å; L1907-S1911 VanDerWaalsContact O-OG 3.13Å
1908	S	83.3	Confident	79.4	Confident	68 Å²	68	63.7 Å²	63.7	48%	0.476	33%	0.332	S	S	.	.	H	α-helix	trans	-69.7	-40.7	178	55.8	0	0	0	0	112.3	S1905 S1911 Y1912	S1905-S1908 PolarHBondContact O-N 3.17Å; S1905-S1908 PolarHBondContact O-OG 2.88Å; S1908-S1911 WeakPolarHBondContact CA-OG 3.38Å; S1908-S1911 PolarHBondContact O-N 3.12Å; S1908-S1911 PolarHBondContact O-OG 2.71Å; S1908-Y1912 WeakPolarHBondContact O-CB 3.49Å; S1908-Y1912 PolarHBondContact O-N 2.82Å
1909	V	84.4	Confident	79.7	Confident	39 Å²	39	62.4 Å²	62.4	24%	0.236	33%	0.325	C	S	.	.	H	α-helix	trans	-62.4	-43.8	172.8	173.9	0	0	0	0	111	V1901 S1905 Y1912 Y1913	V1901-V1909 HydrophobicContact CG1-CB 4.37Å; V1901-V1909 HydrophobicContact CG1-CG2 4.05Å; S1905-V1909 WeakPolarHBondContact O-CB 3.44Å; S1905-V1909 WeakPolarHBondContact O-CG2 3.2Å; S1905-V1909 PolarHBondContact O-N 3.47Å; V1909-Y1912 WeakPolarHBondContact O-CB 3.22Å; V1909-Y1912 PolarHBondContact O-N 2.8Å; V1909-Y1913 HydrophobicContact CG1-CD2 3.85Å; V1909-Y1913 HydrophobicContact CG1-CE2 3.67Å; V1909-Y1913 VanDerWaalsContact O-CD2 3.23Å; V1909-Y1913 WeakPolarHBondContact O-CD2 3.49Å; V1909-Y1913 PolarHBondContact O-N 2.85Å; V1909-Y1913 VanDerWaalsContact O-N 3.07Å
1910	V	87.3	Confident	80.1	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.018	34%	0.338	C	S	.	.	H	α-helix	trans	-65.7	-41.7	176.9	168.8	0	0	0	0	111.9	R1889 L1892 V1893 A1896 R1906 L1907 Y1912 Y1913 L1914 M1945	R1889-V1910 HydrophobicContact CG-CG1 4.31Å; L1892-V1910 HydrophobicContact CB-CB 4.4Å; L1892-V1910 HydrophobicContact CB-CG1 3.76Å; L1892-V1910 HydrophobicContact CB-CG2 3.92Å; L1892-V1910 HydrophobicContact CD1-CG1 4.27Å; V1893-V1910 HydrophobicContact CG2-CB 4.48Å; V1893-V1910 HydrophobicContact CG2-CG1 4.22Å; V1893-V1910 HydrophobicContact CG2-CG2 3.97Å; A1896-V1910 HydrophobicContact CB-CG2 4.2Å; R1906-V1910 WeakPolarHBondContact O-CB 3.19Å; R1906-V1910 WeakPolarHBondContact O-CG2 3.41Å; R1906-V1910 PolarHBondContact O-N 2.87Å; L1907-V1910 PolarHBondContact O-N 2.76Å; V1910-Y1912 VanDerWaalsContact C-N 3.34Å; V1910-Y1913 PolarHBondContact O-N 3.38Å; V1910-L1914 HydrophobicContact CG1-CD1 3.92Å; V1910-L1914 HydrophobicContact CG1-CG 4.35Å; V1910-L1914 WeakPolarHBondContact O-CB 3.42Å; V1910-L1914 VanDerWaalsContact O-CG 3.3Å; V1910-L1914 WeakPolarHBondContact O-CG 3.47Å; V1910-L1914 PolarHBondContact O-N 3.15Å; V1910-M1945 HydrophobicContact CG2-SD 4.34Å
1911	S	86.6	Confident	80.5	Confident	68 Å²	68	70.5 Å²	70.5	48%	0.476	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-37.1	175.2	55.5	0	0	0	0	112.4	L1907 S1908 L1914 H1915	L1907-S1911 PolarHBondContact O-N 3.47Å; L1907-S1911 PolarHBondContact O-OG 3.34Å; L1907-S1911 VanDerWaalsContact O-OG 3.13Å; S1908-S1911 WeakPolarHBondContact CA-OG 3.38Å; S1908-S1911 PolarHBondContact O-N 3.12Å; S1908-S1911 PolarHBondContact O-OG 2.71Å; S1911-L1914 PolarHBondContact O-N 3Å; S1911-H1915 WeakPolarHBondContact O-CB 3.25Å; S1911-H1915 PolarHBondContact O-N 3.42Å
1912	Y	86.8	Confident	80.9	Confident	137 Å²	137	71.7 Å²	71.7	54%	0.537	38%	0.379	S	S	.	.	H	α-helix	trans	-58.9	-50.9	174.9	175.7	-101.5	0	0	0	111.3	S1908 V1909 V1910 H1915 R1916	S1908-Y1912 WeakPolarHBondContact O-CB 3.49Å; S1908-Y1912 PolarHBondContact O-N 2.82Å; V1909-Y1912 WeakPolarHBondContact O-CB 3.22Å; V1909-Y1912 PolarHBondContact O-N 2.8Å; V1910-Y1912 VanDerWaalsContact C-N 3.34Å; Y1912-H1915 PolarHBondContact O-N 3.41Å; Y1912-R1916 WeakPolarHBondContact O-CB 3.34Å; Y1912-R1916 PolarHBondContact O-N 3.46Å
1913	Y	86.8	Confident	81.4	Confident	47 Å²	47	69.2 Å²	69.2	18%	0.184	36%	0.362	C	S	.	.	H	α-helix	trans	-68.8	-34.6	176.9	-73.2	-67.3	0	0	0	113.4	V1909 V1910 H1915 R1916 F1917 L1944 M1945	V1909-Y1913 HydrophobicContact CG1-CD2 3.85Å; V1909-Y1913 HydrophobicContact CG1-CE2 3.67Å; V1909-Y1913 VanDerWaalsContact O-CD2 3.23Å; V1909-Y1913 WeakPolarHBondContact O-CD2 3.49Å; V1909-Y1913 PolarHBondContact O-N 2.85Å; V1909-Y1913 VanDerWaalsContact O-N 3.07Å; V1910-Y1913 PolarHBondContact O-N 3.38Å; Y1913-H1915 VanDerWaalsContact C-N 3.3Å; Y1913-H1915 PolarHBondContact O-N 3.2Å; Y1913-R1916 PolarHBondContact O-N 3.37Å; Y1913-F1917 HydrophobicContact CD1-CD2 4.29Å; Y1913-F1917 AromaticContact CD1-CE2 3.94Å; Y1913-F1917 HydrophobicContact CD1-CE2 3.94Å; Y1913-F1917 WeakPolarHBondContact O-CB 3.42Å; Y1913-F1917 WeakPolarHBondContact O-CD2 3.39Å; Y1913-F1917 PolarHBondContact O-N 3.09Å; Y1913-F1917 VanDerWaalsContact O-N 3.1Å; Y1913-L1944 HydrophobicContact CE1-CB 4.02Å; Y1913-L1944 PolarHBondContact OH-O 3.41Å; Y1913-M1945 HydrophobicContact CD2-CG 3.48Å; Y1913-M1945 VanDerWaalsContact CD2-CG 3.48Å; Y1913-M1945 HydrophobicContact CD2-SD 4.34Å; Y1913-M1945 HydrophobicContact CE2-CB 4.33Å; Y1913-M1945 HydrophobicContact CE2-CG 3.58Å; Y1913-M1945 HydrophobicContact CG-CG 4.27Å
1914	L	86.4	Confident	81.7	Confident	11 Å²	11	68 Å²	68	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-38.3	173	-78	171.3	0	0	0	112.2	V1888 R1889 L1892 V1910 S1911 M1919 S1920 A1923	V1888-L1914 HydrophobicContact CG1-CD2 3.76Å; R1889-L1914 HydrophobicContact CG-CD1 4.33Å; L1892-L1914 HydrophobicContact CD1-CD2 3.58Å; L1892-L1914 HydrophobicContact CD1-CG 3.65Å; V1910-L1914 HydrophobicContact CG1-CD1 3.92Å; V1910-L1914 HydrophobicContact CG1-CG 4.35Å; V1910-L1914 WeakPolarHBondContact O-CB 3.42Å; V1910-L1914 VanDerWaalsContact O-CG 3.3Å; V1910-L1914 WeakPolarHBondContact O-CG 3.47Å; V1910-L1914 PolarHBondContact O-N 3.15Å; S1911-L1914 PolarHBondContact O-N 3Å; L1914-M1919 HydrophobicContact CD2-CB 3.93Å; L1914-M1919 PolarHBondContact O-N 2.99Å; L1914-S1920 PolarHBondContact O-N 3.02Å; L1914-A1923 HydrophobicContact CD1-CB 3.97Å; L1914-A1923 HydrophobicContact CD2-CB 4.03Å
1915	H	84.4	Confident	81.9	Confident	145 Å²	145	63.6 Å²	63.6	67%	0.671	34%	0.335	S	S	*	.	H	α-helix	trans	-73.7	-47.7	175.6	-167.8	-94.2	0	0	0	111.5	S1911 Y1912 Y1913 F1917 D1918	S1911-H1915 WeakPolarHBondContact O-CB 3.25Å; S1911-H1915 PolarHBondContact O-N 3.42Å; Y1912-H1915 PolarHBondContact O-N 3.41Å; Y1913-H1915 VanDerWaalsContact C-N 3.3Å; Y1913-H1915 PolarHBondContact O-N 3.2Å; H1915-F1917 VanDerWaalsContact C-N 3.26Å; H1915-F1917 PolarHBondContact O-N 3.31Å; H1915-D1918 PolarHBondContact O-N 3.29Å; H1915-D1918 VanDerWaalsContact O-N 3.15Å
1916	R	79.4	Confident	81.8	Confident	89 Å²	89	65.6 Å²	65.6	34%	0.336	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-28.7	-178.4	-174.9	60.5	170.4	-168.6	-8.2	113.9	Y1912 Y1913 K1969 N1972	Y1912-R1916 WeakPolarHBondContact O-CB 3.34Å; Y1912-R1916 PolarHBondContact O-N 3.46Å; Y1913-R1916 PolarHBondContact O-N 3.37Å; R1916-K1969 PolarHBondContact NE-O 3.34Å; R1916-K1969 PolarHBondContact NH2-O 3.26Å; R1916-N1972 PolarHBondContact NH2-OXT 3.41Å
1917	F	78.1	Confident	81.5	Confident	25 Å²	25	64.6 Å²	64.6	11%	0.11	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	8.2	178.7	-78.6	-78	0	0	0	115.1	Y1913 H1915 M1919 R1937 I1940 A1941 L1944	Y1913-F1917 HydrophobicContact CD1-CD2 4.29Å; Y1913-F1917 AromaticContact CD1-CE2 3.94Å; Y1913-F1917 HydrophobicContact CD1-CE2 3.94Å; Y1913-F1917 WeakPolarHBondContact O-CB 3.42Å; Y1913-F1917 WeakPolarHBondContact O-CD2 3.39Å; Y1913-F1917 PolarHBondContact O-N 3.09Å; Y1913-F1917 VanDerWaalsContact O-N 3.1Å; H1915-F1917 VanDerWaalsContact C-N 3.26Å; H1915-F1917 PolarHBondContact O-N 3.31Å; F1917-M1919 VanDerWaalsContact C-N 3.27Å; F1917-M1919 HydrophobicContact CB-CE 3.67Å; F1917-M1919 HydrophobicContact CB-CG 4.1Å; F1917-M1919 HydrophobicContact CG-CE 4.24Å; F1917-M1919 PolarHBondContact O-N 3.48Å; F1917-R1937 HydrophobicContact CD1-CB 4.42Å; F1917-R1937 PolarHBondContact O-NH1 3.11Å; F1917-R1937 VanDerWaalsContact O-NH1 3.07Å; F1917-I1940 HydrophobicContact CE1-CG2 4.2Å; F1917-I1940 HydrophobicContact CZ-CG2 3.99Å; F1917-A1941 HydrophobicContact CD2-CB 3.64Å; F1917-A1941 HydrophobicContact CE2-CB 3.61Å; F1917-A1941 HydrophobicContact CG-CB 4.31Å; F1917-A1941 HydrophobicContact CZ-CB 4.26Å; F1917-L1944 HydrophobicContact CE2-CD1 4.2Å; F1917-L1944 HydrophobicContact CZ-CD1 3.81Å
1918	D	75.2	Confident	80.7	Confident	101 Å²	101	61.7 Å²	61.7	54%	0.54	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	35.2	-175.1	-52.2	-46.7	0	0	0	113.8	H1915 R1937	H1915-D1918 PolarHBondContact O-N 3.29Å; H1915-D1918 VanDerWaalsContact O-N 3.15Å; D1918-R1937 IonicContact OD2-NH1 3.64Å
1919	M	78.5	Confident	80	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.039	33%	0.325	C	S	.	.			trans	-103.3	0.6	-177	-66.2	-164.2	-70.8	0	0	114.1	V1888 L1914 F1917 N1921 I1922 A1923 R1937 L1938 A1941	V1888-M1919 HydrophobicContact CG1-CB 4.37Å; V1888-M1919 HydrophobicContact CG1-CE 4.32Å; V1888-M1919 HydrophobicContact CG1-SD 4.05Å; L1914-M1919 HydrophobicContact CD2-CB 3.93Å; L1914-M1919 PolarHBondContact O-N 2.99Å; F1917-M1919 VanDerWaalsContact C-N 3.27Å; F1917-M1919 HydrophobicContact CB-CE 3.67Å; F1917-M1919 HydrophobicContact CB-CG 4.1Å; F1917-M1919 HydrophobicContact CG-CE 4.24Å; F1917-M1919 PolarHBondContact O-N 3.48Å; M1919-N1921 PolarHBondContact O-N 2.95Å; M1919-I1922 CarbonylContact O-C 3.59Å; M1919-I1922 PolarHBondContact O-N 2.75Å; M1919-A1923 PolarHBondContact O-N 3.38Å; M1919-R1937 HydrophobicContact SD-CB 4.16Å; M1919-L1938 HydrophobicContact CE-CB 4.41Å; M1919-L1938 HydrophobicContact CE-CD1 4.38Å; M1919-L1938 HydrophobicContact SD-CB 4.26Å; M1919-A1941 HydrophobicContact CE-CB 4.04Å
1920	S	80.5	Confident	79.2	Confident	62 Å²	62	60.7 Å²	60.7	43%	0.434	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-50.7	-50.4	179.4	52.8	0	0	0	0	113.3	L1914 I1922 A1923	L1914-S1920 PolarHBondContact O-N 3.02Å; S1920-I1922 PolarHBondContact O-N 3.12Å; S1920-A1923 WeakPolarHBondContact O-CB 3.21Å; S1920-A1923 PolarHBondContact O-N 3.01Å
1921	N	76.8	Confident	78	Confident	158 Å²	158	61.8 Å²	61.8	85%	0.845	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-63.4	-13.6	179.3	-66.3	-19.3	0	0	0	114.4	M1919	M1919-N1921 PolarHBondContact O-N 2.95Å
1922	I	80.5	Confident	76.9	Confident	43 Å²	43	62.8 Å²	62.8	22%	0.221	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-120.5	-1.4	-169.7	-57.4	-178	0	0	0	110.5	V1888 M1919 S1920 D1924 T1925 L1930 M1934	V1888-I1922 HydrophobicContact CG2-CG2 4.39Å; V1888-I1922 WeakPolarHBondContact CG2-O 3.33Å; M1919-I1922 CarbonylContact O-C 3.59Å; M1919-I1922 PolarHBondContact O-N 2.75Å; S1920-I1922 PolarHBondContact O-N 3.12Å; I1922-D1924 VanDerWaalsContact C-N 3.27Å; I1922-D1924 PolarHBondContact O-N 3.08Å; I1922-D1924 VanDerWaalsContact O-N 3.08Å; I1922-T1925 HydrophobicContact CG2-CG2 4.08Å; I1922-T1925 WeakPolarHBondContact CG2-OG1 3.43Å; I1922-T1925 WeakPolarHBondContact O-CB 3.31Å; I1922-T1925 PolarHBondContact O-N 2.92Å; I1922-T1925 PolarHBondContact O-OG1 3.15Å; I1922-L1930 HydrophobicContact CG2-CD2 3.53Å; I1922-M1934 HydrophobicContact CD1-CE 3.34Å; I1922-M1934 HydrophobicContact CD1-SD 3.78Å
1923	A	80.1	Confident	75.8	Confident	2 Å²	2	56.9 Å²	56.9	2%	0.017	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-38.8	-170.9	0	0	0	0	0	114.6	V1888 R1889 L1914 M1919 S1920	V1888-A1923 WeakPolarHBondContact CB-O 3.44Å; V1888-A1923 PolarHBondContact N-O 3.5Å; R1889-A1923 HydrophobicContact CB-CB 4.39Å; R1889-A1923 WeakPolarHBondContact CB-O 3.32Å; R1889-A1923 PolarHBondContact N-O 3.41Å; L1914-A1923 HydrophobicContact CD1-CB 3.97Å; L1914-A1923 HydrophobicContact CD2-CB 4.03Å; M1919-A1923 PolarHBondContact O-N 3.38Å; S1920-A1923 WeakPolarHBondContact O-CB 3.21Å; S1920-A1923 PolarHBondContact O-N 3.01Å
1924	D	81.6	Confident	75.2	Confident	104 Å²	104	56.5 Å²	56.5	56%	0.556	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	8.6	-175.1	-54.8	-45	0	0	0	113.2	T1887 R1889 I1922	T1887-D1924 WeakPolarHBondContact CG2-O 3.26Å; R1889-D1924 IonicContact CZ-OD1 3.51Å; R1889-D1924 IonicContact CZ-OD2 2.72Å; R1889-D1924 IonicContact NE-OD1 3.03Å; R1889-D1924 PolarHBondContact NE-OD1 2.77Å; R1889-D1924 IonicContact NE-OD2 2.89Å; R1889-D1924 VanDerWaalsContact NH2-CG 3.33Å; R1889-D1924 IonicContact NH2-OD1 3.55Å; R1889-D1924 PolarHBondContact NH2-OD1 3.14Å; R1889-D1924 IonicContact NH2-OD2 3.31Å; R1889-D1924 PolarHBondContact NH2-OD2 2.97Å; I1922-D1924 VanDerWaalsContact C-N 3.27Å; I1922-D1924 PolarHBondContact O-N 3.08Å; I1922-D1924 VanDerWaalsContact O-N 3.08Å
1925	T	79	Confident	74.6	Confident	35 Å²	35	58.7 Å²	58.7	22%	0.215	31%	0.308	C	S	.	.	S	Bend	trans	-81.5	149.5	171.1	70.8	0	0	0	0	111.3	T1887 V1888 I1922	T1887-T1925 WeakPolarHBondContact CA-O 3.33Å; T1887-T1925 WeakPolarHBondContact CB-O 3.24Å; V1888-T1925 PolarHBondContact N-O 2.83Å; I1922-T1925 HydrophobicContact CG2-CG2 4.08Å; I1922-T1925 WeakPolarHBondContact CG2-OG1 3.43Å; I1922-T1925 WeakPolarHBondContact O-CB 3.31Å; I1922-T1925 PolarHBondContact O-N 2.92Å; I1922-T1925 PolarHBondContact O-OG1 3.15Å
1926	K	76.9	Confident	74.1	Confident	92 Å²	92	52.2 Å²	52.2	40%	0.4	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-73.7	142.5	177	-69.7	-172.8	176.3	-175.1	0	111.5	L1886 S1928 S1929	L1886-K1926 WeakPolarHBondContact O-CA 3.33Å; K1926-S1928 PolarHBondContact O-N 3.25Å; K1926-S1928 VanDerWaalsContact O-N 3.11Å; K1926-S1929 PolarHBondContact O-N 3.35Å; K1926-S1929 PolarHBondContact O-OG 3.08Å
1927	N	75.9	Confident	74.1	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-53.1	-33.3	176	-69.1	-14.3	0	0	0	113.3	D1883 L1886 T1891 S1929 L1930 R1935 L1938	D1883-N1927 WeakPolarHBondContact O-CB 3.27Å; D1883-N1927 PolarHBondContact O-ND2 3.48Å; L1886-N1927 PolarHBondContact O-N 2.86Å; T1891-N1927 PolarHBondContact OG1-ND2 3.34Å; N1927-S1929 PolarHBondContact O-N 3.24Å; N1927-L1930 HydrophobicContact CB-CD1 4.41Å; N1927-L1930 WeakPolarHBondContact O-CB 3.49Å; N1927-L1930 PolarHBondContact O-N 3.28Å; N1927-R1935 PolarHBondContact O-NE 2.87Å; N1927-R1935 PolarHBondContact O-NH2 2.88Å; N1927-L1938 WeakPolarHBondContact OD1-CD2 3.31Å
1928	S	66.2	Low	74.4	Confident	58 Å²	58	50.1 Å²	50.1	41%	0.406	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-56.8	-35.9	173.7	60.6	0	0	0	0	113.8	E1884 K1926 R1935	E1884-S1928 PolarHBondContact O-N 3.26Å; K1926-S1928 PolarHBondContact O-N 3.25Å; K1926-S1928 VanDerWaalsContact O-N 3.11Å; S1928-R1935 PolarHBondContact O-NH2 3.49Å
1929	S	68.7	Low	74.7	Confident	76 Å²	76	45.5 Å²	45.5	53%	0.531	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-87.1	-8.7	-177.3	65.7	0	0	0	0	114.8	K1926 N1927	K1926-S1929 PolarHBondContact O-N 3.35Å; K1926-S1929 PolarHBondContact O-OG 3.08Å; N1927-S1929 PolarHBondContact O-N 3.24Å
1930	L	66.6	Low	74.8	Confident	10 Å²	10	46 Å²	46	5%	0.052	25%	0.247	C	C	.	.	S	Bend	trans	-70.3	140.4	174	-59.7	178.3	0	0	0	110.6	V1888 I1922 N1927 M1934 R1935 L1938	V1888-L1930 HydrophobicContact CG2-CD1 3.88Å; V1888-L1930 HydrophobicContact CG2-CD2 3.84Å; V1888-L1930 HydrophobicContact CG2-CG 4.35Å; I1922-L1930 HydrophobicContact CG2-CD2 3.53Å; N1927-L1930 HydrophobicContact CB-CD1 4.41Å; N1927-L1930 WeakPolarHBondContact O-CB 3.49Å; N1927-L1930 PolarHBondContact O-N 3.28Å; L1930-M1934 HydrophobicContact CB-CB 3.92Å; L1930-M1934 HydrophobicContact CD2-CB 4.11Å; L1930-M1934 HydrophobicContact CD2-SD 4.43Å; L1930-M1934 HydrophobicContact CG-CB 4.41Å; L1930-R1935 HydrophobicContact CB-CG 3.74Å; L1930-R1935 HydrophobicContact CD1-CG 4.34Å; L1930-R1935 PolarHBondContact O-NE 3.14Å; L1930-L1938 HydrophobicContact CD1-CD2 3.89Å
1931	S	63.7	Low	75	Confident	26 Å²	26	43 Å²	43	18%	0.182	23%	0.227	C	C	.	.			trans	-63.3	160.1	164.6	65	0	0	0	0	110.5	H981 D1933 M1934 R1935	H981-S1931 PolarHBondContact CE1-OG 3.05Å; H981-S1931 WeakPolarHBondContact NE2-CB 3.28Å; H981-S1931 PolarHBondContact NE2-OG 3.27Å; S1931-D1933 PolarHBondContact O-N 2.89Å; S1931-M1934 PolarHBondContact O-N 3.31Å; S1931-M1934 PolarHBondContact OG-N 3.49Å; S1931-R1935 WeakPolarHBondContact O-CG 3.29Å; S1931-R1935 PolarHBondContact O-N 3.18Å
1932	M	63.5	Low	75.3	Confident	89 Å²	89	35.8 Å²	35.8	44%	0.438	19%	0.189	S	C	.	.	H	α-helix	trans	-56.7	-33.6	178.9	-77.5	171.6	-103.3	0	0	112.8	R1935 R1936 R1959	M1932-R1935 PolarHBondContact O-N 3.44Å; M1932-R1936 WeakPolarHBondContact O-CB 3.42Å; M1932-R1936 PolarHBondContact O-N 2.97Å; M1932-R1959 VanDerWaalsContact SD-CZ 3.55Å; M1932-R1959 PolarHBondContact SD-NH2 2.78Å
1933	D	63.3	Low	75.2	Confident	13 Å²	13	33.9 Å²	33.9	7%	0.07	18%	0.179	C	C	.	.	H	α-helix	trans	-71.2	-34.9	175.4	-78.4	6.2	0	0	0	113.7	S1931 R1936 R1937 S1958 R1959	S1931-D1933 PolarHBondContact O-N 2.89Å; D1933-R1936 PolarHBondContact O-N 3.23Å; D1933-R1937 WeakPolarHBondContact O-CG 3.47Å; D1933-R1937 PolarHBondContact O-N 2.83Å; D1933-S1958 WeakPolarHBondContact OD1-CB 3.14Å; D1933-S1958 VanDerWaalsContact OD1-O 3.08Å; D1933-S1958 PolarHBondContact OD1-OG 2.63Å; D1933-R1959 VanDerWaalsContact OD1-CB 3.25Å; D1933-R1959 WeakPolarHBondContact OD1-CB 3.37Å; D1933-R1959 WeakPolarHBondContact OD1-CD 3.13Å; D1933-R1959 WeakPolarHBondContact OD1-CG 3.47Å
1934	M	73.8	Confident	75.2	Confident	39 Å²	39	35.3 Å²	35.3	19%	0.192	19%	0.186	C	C	.	.	H	α-helix	trans	-71.4	-36.2	173.2	-71.5	171.9	174.1	0	0	111.5	H981 I1922 L1930 S1931 R1936 R1937 L1938	H981-M1934 PolarHBondContact NE2-SD 3.03Å; I1922-M1934 HydrophobicContact CD1-CE 3.34Å; I1922-M1934 HydrophobicContact CD1-SD 3.78Å; L1930-M1934 HydrophobicContact CB-CB 3.92Å; L1930-M1934 HydrophobicContact CD2-CB 4.11Å; L1930-M1934 HydrophobicContact CD2-SD 4.43Å; L1930-M1934 HydrophobicContact CG-CB 4.41Å; S1931-M1934 PolarHBondContact O-N 3.31Å; S1931-M1934 PolarHBondContact OG-N 3.49Å; M1934-R1936 VanDerWaalsContact C-N 3.31Å; M1934-R1937 PolarHBondContact O-N 2.92Å; M1934-L1938 WeakPolarHBondContact O-CB 3.41Å; M1934-L1938 PolarHBondContact O-N 3.39Å
1935	R	74	Confident	75.1	Confident	57 Å²	57	30.7 Å²	30.7	22%	0.215	16%	0.161	C	C	.	.	H	α-helix	trans	-60.2	-42.5	168.9	-66.4	179.5	-175.7	-144.1	1.9	110.7	D1880 L1882 E1884 N1927 S1928 L1930 S1931 M1932 L1938 S1939	D1880-R1935 HydrophobicContact CB-CB 4.21Å; D1880-R1935 WeakPolarHBondContact OD2-CB 3.38Å; L1882-R1935 HydrophobicContact CD1-CB 3.93Å; L1882-R1935 HydrophobicContact CD1-CG 4.36Å; L1882-R1935 VanDerWaalsContact CD1-O 3.31Å; L1882-R1935 WeakPolarHBondContact CD1-O 3.38Å; E1884-R1935 IonicContact OE1-CZ 2.74Å; E1884-R1935 VanDerWaalsContact OE1-CZ 3.23Å; E1884-R1935 IonicContact OE1-NH1 3.48Å; E1884-R1935 PolarHBondContact OE1-NH1 3.26Å; E1884-R1935 IonicContact OE1-NH2 2.67Å; E1884-R1935 PolarHBondContact OE1-NH2 3.3Å; N1927-R1935 PolarHBondContact O-NE 2.87Å; N1927-R1935 PolarHBondContact O-NH2 2.88Å; S1928-R1935 PolarHBondContact O-NH2 3.49Å; L1930-R1935 HydrophobicContact CB-CG 3.74Å; L1930-R1935 HydrophobicContact CD1-CG 4.34Å; L1930-R1935 PolarHBondContact O-NE 3.14Å; S1931-R1935 WeakPolarHBondContact O-CG 3.29Å; S1931-R1935 PolarHBondContact O-N 3.18Å; M1932-R1935 PolarHBondContact O-N 3.44Å; R1935-L1938 PolarHBondContact O-N 3.4Å; R1935-S1939 WeakPolarHBondContact O-CB 3.33Å; R1935-S1939 PolarHBondContact O-N 3.43Å
1936	R	74.3	Confident	74.5	Confident	8 Å²	8	29.4 Å²	29.4	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-65.1	-46	177.6	-165.3	66.5	179.9	158.2	0.1	113.2	P1877 D1880 M1932 D1933 M1934 L1938 S1939 I1940 D1954 E1955 P1956 S1958	P1877-R1936 VanDerWaalsContact O-CZ 3.25Å; P1877-R1936 PolarHBondContact O-NH1 3.19Å; P1877-R1936 PolarHBondContact O-NH2 3.42Å; D1880-R1936 WeakPolarHBondContact OD1-CD 3.26Å; D1880-R1936 IonicContact OD1-CZ 3.52Å; D1880-R1936 IonicContact OD1-NE 3.62Å; D1880-R1936 IonicContact OD1-NH1 2.64Å; D1880-R1936 PolarHBondContact OD1-NH1 2.9Å; M1932-R1936 WeakPolarHBondContact O-CB 3.42Å; M1932-R1936 PolarHBondContact O-N 2.97Å; D1933-R1936 PolarHBondContact O-N 3.23Å; M1934-R1936 VanDerWaalsContact C-N 3.31Å; R1936-L1938 VanDerWaalsContact C-N 3.3Å; R1936-L1938 PolarHBondContact O-N 3.07Å; R1936-S1939 WeakPolarHBondContact O-CB 3.47Å; R1936-S1939 PolarHBondContact O-N 2.89Å; R1936-S1939 VanDerWaalsContact O-N 3.13Å; R1936-I1940 HydrophobicContact CG-CD1 4.26Å; R1936-I1940 WeakPolarHBondContact O-CG1 3.27Å; R1936-I1940 PolarHBondContact O-N 3.48Å; R1936-D1954 PolarHBondContact NH2-O 3.48Å; R1936-E1955 PolarHBondContact NE-O 3.19Å; R1936-E1955 PolarHBondContact NH2-O 2.9Å; R1936-P1956 WeakPolarHBondContact CG-O 3.27Å; R1936-P1956 PolarHBondContact NE-O 3.23Å; R1936-S1958 WeakPolarHBondContact CB-OG 3.3Å; R1936-S1958 WeakPolarHBondContact CG-OG 3.28Å
1937	R	79.1	Confident	73.9	Confident	71 Å²	71	28.3 Å²	28.3	27%	0.268	16%	0.157	S	C	.	.	H	α-helix	trans	-55.6	-45.7	172.9	-75.7	-179.4	175	-147.7	-4.2	111.3	F1917 D1918 M1919 D1933 M1934 I1940 A1941 D1966	F1917-R1937 HydrophobicContact CD1-CB 4.42Å; F1917-R1937 PolarHBondContact O-NH1 3.11Å; F1917-R1937 VanDerWaalsContact O-NH1 3.07Å; D1918-R1937 IonicContact OD2-NH1 3.64Å; M1919-R1937 HydrophobicContact SD-CB 4.16Å; D1933-R1937 WeakPolarHBondContact O-CG 3.47Å; D1933-R1937 PolarHBondContact O-N 2.83Å; M1934-R1937 PolarHBondContact O-N 2.92Å; R1937-I1940 PolarHBondContact O-N 2.57Å; R1937-A1941 WeakPolarHBondContact O-CB 3.44Å; R1937-A1941 PolarHBondContact O-N 3.12Å; R1937-D1966 IonicContact NH2-OD2 3.79Å
1938	L	84.3	Confident	73.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-37.7	175.9	-179.8	54.5	0	0	0	112.6	L1882 V1888 T1891 L1892 M1919 N1927 L1930 M1934 R1935 R1936 A1941 S1942	L1882-L1938 HydrophobicContact CD1-CB 4.06Å; L1882-L1938 HydrophobicContact CD1-CD2 3.94Å; L1882-L1938 HydrophobicContact CD1-CG 3.99Å; L1882-L1938 HydrophobicContact CD2-CD2 4.46Å; L1882-L1938 HydrophobicContact CD2-CG 4.1Å; V1888-L1938 HydrophobicContact CB-CD2 4.33Å; V1888-L1938 HydrophobicContact CG1-CD1 3.92Å; V1888-L1938 HydrophobicContact CG1-CD2 4.14Å; V1888-L1938 HydrophobicContact CG2-CD2 4.31Å; T1891-L1938 HydrophobicContact CG2-CD1 4.18Å; T1891-L1938 HydrophobicContact CG2-CD2 4.17Å; T1891-L1938 HydrophobicContact CG2-CG 4.22Å; L1892-L1938 HydrophobicContact CD1-CD1 4.39Å; L1892-L1938 HydrophobicContact CD2-CD1 3.59Å; L1892-L1938 HydrophobicContact CG-CD1 3.73Å; M1919-L1938 HydrophobicContact CE-CB 4.41Å; M1919-L1938 HydrophobicContact CE-CD1 4.38Å; M1919-L1938 HydrophobicContact SD-CB 4.26Å; N1927-L1938 WeakPolarHBondContact OD1-CD2 3.31Å; L1930-L1938 HydrophobicContact CD1-CD2 3.89Å; M1934-L1938 WeakPolarHBondContact O-CB 3.41Å; M1934-L1938 PolarHBondContact O-N 3.39Å; R1935-L1938 PolarHBondContact O-N 3.4Å; R1936-L1938 VanDerWaalsContact C-N 3.3Å; R1936-L1938 PolarHBondContact O-N 3.07Å; L1938-A1941 PolarHBondContact O-N 2.89Å; L1938-S1942 VanDerWaalsContact O-CB 3.29Å; L1938-S1942 WeakPolarHBondContact O-CB 3.44Å; L1938-S1942 PolarHBondContact O-N 3.45Å; L1938-S1942 PolarHBondContact O-OG 3.2Å
1939	S	81.8	Confident	73.5	Confident	4 Å²	4	31.5 Å²	31.5	3%	0.028	18%	0.18	C	C	.	.	H	α-helix	trans	-63.7	-41.8	174.3	-168.5	0	0	0	0	111.9	C1876 R1935 R1936 S1942 A1943	C1876-S1939 PolarHBondContact SG-OG 3.01Å; C1876-S1939 VanDerWaalsContact SG-OG 3.32Å; R1935-S1939 WeakPolarHBondContact O-CB 3.33Å; R1935-S1939 PolarHBondContact O-N 3.43Å; R1936-S1939 WeakPolarHBondContact O-CB 3.47Å; R1936-S1939 PolarHBondContact O-N 2.89Å; R1936-S1939 VanDerWaalsContact O-N 3.13Å; S1939-S1942 WeakPolarHBondContact CA-OG 3.48Å; S1939-S1942 PolarHBondContact O-N 2.8Å; S1939-S1942 PolarHBondContact O-OG 2.99Å; S1939-A1943 PolarHBondContact O-N 3.25Å
1940	I	81.1	Confident	73.6	Confident	17 Å²	17	30.5 Å²	30.5	9%	0.087	17%	0.167	C	C	.	.	H	α-helix	trans	-68.2	-46	176.2	-64.5	167.6	0	0	0	110.6	F1917 R1936 R1937 S1942 A1943 L1944	F1917-I1940 HydrophobicContact CE1-CG2 4.2Å; F1917-I1940 HydrophobicContact CZ-CG2 3.99Å; R1936-I1940 HydrophobicContact CG-CD1 4.26Å; R1936-I1940 WeakPolarHBondContact O-CG1 3.27Å; R1936-I1940 PolarHBondContact O-N 3.48Å; R1937-I1940 PolarHBondContact O-N 2.57Å; I1940-S1942 VanDerWaalsContact C-N 3.25Å; I1940-S1942 PolarHBondContact O-N 2.82Å; I1940-A1943 WeakPolarHBondContact O-CB 3.32Å; I1940-A1943 PolarHBondContact O-N 2.87Å; I1940-L1944 HydrophobicContact CG2-CD1 3.91Å; I1940-L1944 WeakPolarHBondContact O-CG 3.36Å; I1940-L1944 PolarHBondContact O-N 3.39Å; I1940-L1944 VanDerWaalsContact O-N 3.1Å
1941	A	84.7	Confident	74.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57	-39.9	173.5	0	0	0	0	0	111.7	L1892 F1917 M1919 R1937 L1938 A1943 L1944 M1945	L1892-A1941 HydrophobicContact CD2-CB 3.83Å; F1917-A1941 HydrophobicContact CD2-CB 3.64Å; F1917-A1941 HydrophobicContact CE2-CB 3.61Å; F1917-A1941 HydrophobicContact CG-CB 4.31Å; F1917-A1941 HydrophobicContact CZ-CB 4.26Å; M1919-A1941 HydrophobicContact CE-CB 4.04Å; R1937-A1941 WeakPolarHBondContact O-CB 3.44Å; R1937-A1941 PolarHBondContact O-N 3.12Å; L1938-A1941 PolarHBondContact O-N 2.89Å; A1941-A1943 VanDerWaalsContact C-N 3.3Å; A1941-A1943 PolarHBondContact O-N 2.81Å; A1941-L1944 PolarHBondContact O-N 3.43Å; A1941-M1945 PolarHBondContact O-N 3.01Å
1942	S	82.9	Confident	74.7	Confident	7 Å²	7	32.6 Å²	32.6	5%	0.049	18%	0.177	C	C	.	.	H	α-helix	trans	-71.2	-17.8	175	76	0	0	0	0	115	Y1899 L1938 S1939 I1940	Y1899-S1942 WeakPolarHBondContact CE2-O 3.28Å; Y1899-S1942 PolarHBondContact OH-O 3.29Å; L1938-S1942 VanDerWaalsContact O-CB 3.29Å; L1938-S1942 WeakPolarHBondContact O-CB 3.44Å; L1938-S1942 PolarHBondContact O-N 3.45Å; L1938-S1942 PolarHBondContact O-OG 3.2Å; S1939-S1942 WeakPolarHBondContact CA-OG 3.48Å; S1939-S1942 PolarHBondContact O-N 2.8Å; S1939-S1942 PolarHBondContact O-OG 2.99Å; I1940-S1942 VanDerWaalsContact C-N 3.25Å; I1940-S1942 PolarHBondContact O-N 2.82Å
1943	A	78.3	Confident	75.3	Confident	2 Å²	2	30.7 Å²	30.7	2%	0.017	17%	0.168	C	C	.	.	H	α-helix	trans	-83.3	-29.4	170.9	0	0	0	0	0	112	C1874 C1876 S1939 I1940 A1941	C1874-A1943 WeakPolarHBondContact CB-O 3.33Å; C1876-A1943 HydrophobicContact CB-CB 4.16Å; S1939-A1943 PolarHBondContact O-N 3.25Å; I1940-A1943 WeakPolarHBondContact O-CB 3.32Å; I1940-A1943 PolarHBondContact O-N 2.87Å; A1941-A1943 VanDerWaalsContact C-N 3.3Å; A1941-A1943 PolarHBondContact O-N 2.81Å
1944	L	80.6	Confident	75.7	Confident	32 Å²	32	30.5 Å²	30.5	17%	0.168	17%	0.167	C	C	.	.	H	α-helix	trans	-88.1	-12.6	-173.3	-74.3	169.2	0	0	0	115.7	Y1913 F1917 I1940 A1941 G1946 L1951	Y1913-L1944 HydrophobicContact CE1-CB 4.02Å; Y1913-L1944 PolarHBondContact OH-O 3.41Å; F1917-L1944 HydrophobicContact CE2-CD1 4.2Å; F1917-L1944 HydrophobicContact CZ-CD1 3.81Å; I1940-L1944 HydrophobicContact CG2-CD1 3.91Å; I1940-L1944 WeakPolarHBondContact O-CG 3.36Å; I1940-L1944 PolarHBondContact O-N 3.39Å; I1940-L1944 VanDerWaalsContact O-N 3.1Å; A1941-L1944 PolarHBondContact O-N 3.43Å; L1944-G1946 PolarHBondContact O-N 3.01Å; L1944-L1951 HydrophobicContact CD2-CD1 3.85Å; L1944-L1951 HydrophobicContact CD2-CD2 3.81Å; L1944-L1951 HydrophobicContact CD2-CG 4.43Å; L1944-L1951 HydrophobicContact CG-CD1 4.47Å
1945	M	78.2	Confident	75.4	Confident	7 Å²	7	33 Å²	33	3%	0.034	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-4.4	-178.6	-77.4	-173.5	-65.5	0	0	115.4	L1892 Y1895 A1896 Y1899 V1910 Y1913 A1941	L1892-M1945 HydrophobicContact CB-CE 4.05Å; L1892-M1945 HydrophobicContact CB-SD 3.96Å; L1892-M1945 HydrophobicContact CD2-CE 3.52Å; L1892-M1945 HydrophobicContact CD2-SD 3.9Å; L1892-M1945 HydrophobicContact CG-CE 4.39Å; L1892-M1945 VanDerWaalsContact O-CE 3.25Å; L1892-M1945 WeakPolarHBondContact O-CE 3.44Å; L1892-M1945 VanDerWaalsContact O-SD 3.35Å; Y1895-M1945 VanDerWaalsContact CB-CE 3.4Å; A1896-M1945 HydrophobicContact CB-SD 3.86Å; Y1899-M1945 HydrophobicContact CD2-CB 3.87Å; Y1899-M1945 HydrophobicContact CE2-CB 4.14Å; V1910-M1945 HydrophobicContact CG2-SD 4.34Å; Y1913-M1945 HydrophobicContact CD2-CG 3.48Å; Y1913-M1945 VanDerWaalsContact CD2-CG 3.48Å; Y1913-M1945 HydrophobicContact CD2-SD 4.34Å; Y1913-M1945 HydrophobicContact CE2-CB 4.33Å; Y1913-M1945 HydrophobicContact CE2-CG 3.58Å; Y1913-M1945 HydrophobicContact CG-CG 4.27Å; A1941-M1945 PolarHBondContact O-N 3.01Å
1946	G	67.3	Low	74.9	Confident	9 Å²	9	32.1 Å²	32.1	9%	0.093	18%	0.181	C	C	.	.	S	Bend	trans	-97.5	164	170.1	0	0	0	0	0	111.3	Y1899 L1944 C1948	Y1899-G1946 VanDerWaalsContact CG-CA 3.49Å; L1944-G1946 PolarHBondContact O-N 3.01Å; G1946-C1948 PolarHBondContact O-N 2.95Å; G1946-C1948 VanDerWaalsContact O-N 3.16Å; G1946-C1948 PolarHBondContact O-SG 3.45Å
1947	P	64.1	Low	74.1	Confident	68 Å²	68	35.5 Å²	35.5	44%	0.442	20%	0.202	S	C	.	.			trans	-64.1	116.6	169.9	26	-32.2	0	0	0	109.9	M1869	M1869-P1947 HydrophobicContact CE-CG 3.63Å; M1869-P1947 HydrophobicContact CG-CG 4.08Å; M1869-P1947 HydrophobicContact SD-CG 3.71Å
1948	C	65.2	Low	72.7	Confident	51 Å²	51	33.6 Å²	33.6	35%	0.345	20%	0.199	S	C	.	.			trans	-115.4	120.5	-177.7	-52	0	0	0	0	110.7	G1872 C1874 G1946	G1872-C1948 CarbonylContact O-C 3.48Å; G1872-C1948 VanDerWaalsContact O-CA 3.29Å; G1872-C1948 WeakPolarHBondContact O-CA 3.34Å; C1874-C1948 HydrophobicContact CB-CB 3.79Å; C1874-C1948 WeakPolarHBondContact CB-SG 3.41Å; C1874-C1948 WeakPolarHBondContact SG-CA 3.46Å; C1874-C1948 WeakPolarHBondContact SG-CB 3.32Å; C1874-C1948 CovalentContact SG-SG 2.03Å; C1874-C1948 PolarHBondContact SG-SG 3.18Å; G1946-C1948 PolarHBondContact O-N 2.95Å; G1946-C1948 VanDerWaalsContact O-N 3.16Å; G1946-C1948 PolarHBondContact O-SG 3.45Å
1949	S	68.4	Low	71	Confident	76 Å²	76	37.1 Å²	37.1	53%	0.531	21%	0.213	S	C	.	.	S	Bend	trans	-96.1	-28.8	163.1	61.9	0	0	0	0	112.1	N1871 G1872	N1871-S1949 PolarHBondContact O-OG 2.78Å; G1872-S1949 VanDerWaalsContact CA-OG 3.22Å; G1872-S1949 WeakPolarHBondContact CA-OG 3.41Å; G1872-S1949 PolarHBondContact O-N 3.03Å; G1872-S1949 PolarHBondContact O-OG 3.48Å
1950	I	71.2	Confident	69	Low	54 Å²	54	40.8 Å²	40.8	28%	0.277	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	113.6	178.9	-60.1	172	0	0	0	109.3	G1872 F1873 C1874 V1952	G1872-I1950 PolarHBondContact O-N 3.46Å; F1873-I1950 WeakPolarHBondContact CA-O 3.42Å; F1873-I1950 HydrophobicContact CD1-CB 3.93Å; F1873-I1950 HydrophobicContact CD1-CG2 3.78Å; F1873-I1950 HydrophobicContact CD2-CB 4.49Å; F1873-I1950 HydrophobicContact CD2-CD1 4.36Å; F1873-I1950 HydrophobicContact CE1-CB 3.86Å; F1873-I1950 HydrophobicContact CE1-CD1 4.06Å; F1873-I1950 HydrophobicContact CE1-CG2 3.43Å; F1873-I1950 VanDerWaalsContact CE1-CG2 3.43Å; F1873-I1950 HydrophobicContact CE2-CB 4.43Å; F1873-I1950 HydrophobicContact CE2-CD1 3.62Å; F1873-I1950 HydrophobicContact CG-CB 4.26Å; F1873-I1950 HydrophobicContact CZ-CB 4.13Å; F1873-I1950 HydrophobicContact CZ-CD1 3.44Å; F1873-I1950 VanDerWaalsContact CZ-CD1 3.44Å; F1873-I1950 HydrophobicContact CZ-CG1 4.36Å; F1873-I1950 HydrophobicContact CZ-CG2 3.98Å; C1874-I1950 PolarHBondContact N-O 3.38Å; I1950-V1952 HydrophobicContact CG2-CG2 4.33Å
1951	L	76.6	Confident	67.1	Low	60 Å²	60	46.6 Å²	46.6	31%	0.314	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	116.3	179	-176.8	66.9	0	0	0	111.1	C1874 L1944 L1953 V1970	C1874-L1951 HydrophobicContact CB-CD1 3.83Å; L1944-L1951 HydrophobicContact CD2-CD1 3.85Å; L1944-L1951 HydrophobicContact CD2-CD2 3.81Å; L1944-L1951 HydrophobicContact CD2-CG 4.43Å; L1944-L1951 HydrophobicContact CG-CD1 4.47Å; L1951-L1953 HydrophobicContact CD1-CD2 3.95Å; L1951-L1953 HydrophobicContact CD2-CD1 4.06Å; L1951-L1953 HydrophobicContact CD2-CD2 4.14Å; L1951-L1953 HydrophobicContact CD2-CG 4.19Å; L1951-L1953 HydrophobicContact CG-CD1 4.44Å; L1951-L1953 HydrophobicContact CG-CD2 3.9Å; L1951-L1953 HydrophobicContact CG-CG 4.02Å; L1951-V1970 HydrophobicContact CD2-CG1 4.27Å
1952	V	75.8	Confident	65	Low	20 Å²	20	49.4 Å²	49.4	12%	0.121	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	116.4	177	-178.4	0	0	0	0	110	L1841 M1845 F1873 C1874 Y1875 C1876 I1950	L1841-V1952 HydrophobicContact CD1-CG1 4.19Å; L1841-V1952 HydrophobicContact CD2-CG1 3.82Å; L1841-V1952 HydrophobicContact CG-CG1 4.44Å; M1845-V1952 HydrophobicContact SD-CG1 4.47Å; F1873-V1952 HydrophobicContact CD1-CG2 3.97Å; F1873-V1952 HydrophobicContact CE1-CG2 4.18Å; C1874-V1952 PolarHBondContact O-N 2.99Å; Y1875-V1952 CarbonylContact C-O 3.57Å; Y1875-V1952 VanDerWaalsContact CA-O 3.32Å; Y1875-V1952 WeakPolarHBondContact CA-O 3.41Å; Y1875-V1952 HydrophobicContact CD2-CB 4.03Å; Y1875-V1952 HydrophobicContact CD2-CG1 3.79Å; Y1875-V1952 HydrophobicContact CE2-CG1 4.15Å; C1876-V1952 PolarHBondContact N-O 2.93Å; I1950-V1952 HydrophobicContact CG2-CG2 4.33Å
1953	L	77.3	Confident	63	Low	49 Å²	49	53 Å²	53	26%	0.257	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	109.8	177.1	-52.3	174.9	0	0	0	109.7	C1876 L1951 P1956	C1876-L1953 HydrophobicContact CB-CD2 3.47Å; C1876-L1953 VanDerWaalsContact CB-CD2 3.47Å; L1951-L1953 HydrophobicContact CD1-CD2 3.95Å; L1951-L1953 HydrophobicContact CD2-CD1 4.06Å; L1951-L1953 HydrophobicContact CD2-CD2 4.14Å; L1951-L1953 HydrophobicContact CD2-CG 4.19Å; L1951-L1953 HydrophobicContact CG-CD1 4.44Å; L1951-L1953 HydrophobicContact CG-CD2 3.9Å; L1951-L1953 HydrophobicContact CG-CG 4.02Å; L1953-P1956 HydrophobicContact CB-CB 3.79Å; L1953-P1956 HydrophobicContact CB-CG 4.01Å; L1953-P1956 HydrophobicContact CD1-CB 3.9Å; L1953-P1956 HydrophobicContact CD1-CG 4.49Å; L1953-P1956 HydrophobicContact CG-CB 4.44Å; L1953-P1956 WeakPolarHBondContact O-CD 3.29Å
1954	D	71.6	Confident	60.9	Low	9 Å²	9	60.9 Å²	60.9	5%	0.048	32%	0.32	C	S	.	.	S	Bend	trans	-88	108.7	175.1	-166.4	17.4	0	0	0	108.8	S1838 L1841 Y1875 C1876 Q1878 R1936	S1838-D1954 VanDerWaalsContact CB-OD2 3.27Å; S1838-D1954 WeakPolarHBondContact CB-OD2 3.11Å; S1838-D1954 PolarHBondContact OG-OD1 3.14Å; S1838-D1954 PolarHBondContact OG-OD2 2.75Å; S1838-D1954 VanDerWaalsContact OG-OD2 3.1Å; L1841-D1954 HydrophobicContact CD1-CB 4.22Å; Y1875-D1954 HydrophobicContact CE2-CB 3.96Å; C1876-D1954 PolarHBondContact O-N 3.05Å; Q1878-D1954 WeakPolarHBondContact CA-O 3.44Å; R1936-D1954 PolarHBondContact NH2-O 3.48Å
1955	E	67	Low	58.9	Low	92 Å²	92	64.5 Å²	64.5	43%	0.43	34%	0.339	S	S	.	.	S	Bend	trans	50.4	66.7	-167.9	-63.5	-171.9	158.3	0	0	113.3	Q1878 R1936 T1957	Q1878-E1955 HydrophobicContact CG-CB 4.41Å; Q1878-E1955 HydrophobicContact CG-CG 4.44Å; Q1878-E1955 WeakPolarHBondContact CG-OE2 3.41Å; Q1878-E1955 VanDerWaalsContact NE2-CD 3.32Å; Q1878-E1955 PolarHBondContact NE2-OE2 3.14Å; R1936-E1955 PolarHBondContact NE-O 3.19Å; R1936-E1955 PolarHBondContact NH2-O 2.9Å; E1955-T1957 PolarHBondContact O-N 3.44Å
1956	P	62.4	Low	57.3	Low	39 Å²	39	65.6 Å²	65.6	25%	0.253	35%	0.345	S	S	.	.			trans	-56.3	-37.4	-179.6	18.1	-29.6	0	0	0	113.1	R1936 L1953 S1958	R1936-P1956 WeakPolarHBondContact CG-O 3.27Å; R1936-P1956 PolarHBondContact NE-O 3.23Å; L1953-P1956 HydrophobicContact CB-CB 3.79Å; L1953-P1956 HydrophobicContact CB-CG 4.01Å; L1953-P1956 HydrophobicContact CD1-CB 3.9Å; L1953-P1956 HydrophobicContact CD1-CG 4.49Å; L1953-P1956 HydrophobicContact CG-CB 4.44Å; L1953-P1956 WeakPolarHBondContact O-CD 3.29Å; P1956-S1958 PolarHBondContact O-N 2.92Å; P1956-S1958 VanDerWaalsContact O-N 3.14Å
1957	T	58.5	Low	56.2	Low	79 Å²	79	68.6 Å²	68.6	49%	0.485	36%	0.362	S	S	.	.			trans	-80.1	91	-178.2	55.4	0	0	0	0	111.6	E1955 R1959 R1960 I1962	E1955-T1957 PolarHBondContact O-N 3.44Å; T1957-R1959 PolarHBondContact O-N 3.32Å; T1957-R1960 WeakPolarHBondContact CB-O 3.23Å; T1957-R1960 WeakPolarHBondContact CG2-O 3.26Å; T1957-I1962 HydrophobicContact CG2-CD1 4.1Å; T1957-I1962 HydrophobicContact CG2-CG1 4.16Å
1958	S	49.2	Very low	55.1	Low	30 Å²	30	68.4 Å²	68.4	21%	0.21	36%	0.359	C	S	.	.	S	Bend	trans	-70.6	120	145.6	72.9	0	0	0	0	107.4	D1933 R1936 P1956 R1960	D1933-S1958 WeakPolarHBondContact OD1-CB 3.14Å; D1933-S1958 VanDerWaalsContact OD1-O 3.08Å; D1933-S1958 PolarHBondContact OD1-OG 2.63Å; R1936-S1958 WeakPolarHBondContact CB-OG 3.3Å; R1936-S1958 WeakPolarHBondContact CG-OG 3.28Å; P1956-S1958 PolarHBondContact O-N 2.92Å; P1956-S1958 VanDerWaalsContact O-N 3.14Å; S1958-R1960 PolarHBondContact O-N 2.99Å
1959	R	50	Low	54.2	Low	75 Å²	75	69.7 Å²	69.7	28%	0.283	36%	0.359	S	S	.	.	S	Bend	trans	61.2	-20.6	156.8	-44	170.8	164.7	-133.3	-21.3	119.7	E980 E1024 M1932 D1933 T1957	E980-R1959 IonicContact OE1-NH1 3.69Å; E1024-R1959 IonicContact OE1-CZ 3.37Å; E1024-R1959 IonicContact OE1-NH1 3.81Å; E1024-R1959 PolarHBondContact OE1-NH1 2.77Å; E1024-R1959 IonicContact OE1-NH2 3.99Å; E1024-R1959 PolarHBondContact OE1-NH2 3.05Å; M1932-R1959 VanDerWaalsContact SD-CZ 3.55Å; M1932-R1959 PolarHBondContact SD-NH2 2.78Å; D1933-R1959 VanDerWaalsContact OD1-CB 3.25Å; D1933-R1959 WeakPolarHBondContact OD1-CB 3.37Å; D1933-R1959 WeakPolarHBondContact OD1-CD 3.13Å; D1933-R1959 WeakPolarHBondContact OD1-CG 3.47Å; T1957-R1959 PolarHBondContact O-N 3.32Å
1960	R	37.8	Very low	53.2	Low	81 Å²	81	68.8 Å²	68.8	31%	0.306	35%	0.35	S	S	.	.	S	Bend	trans	-113.6	144.3	174.3	-86.8	-169.3	169.6	-172.1	-4.5	112.7	E979 T1957 S1958 I1962	E979-R1960 IonicContact OE2-CZ 3.51Å; E979-R1960 IonicContact OE2-NH1 2.75Å; E979-R1960 PolarHBondContact OE2-NH1 3.29Å; E979-R1960 IonicContact OE2-NH2 3.58Å; E979-R1960 PolarHBondContact OE2-NH2 3.34Å; T1957-R1960 WeakPolarHBondContact CB-O 3.23Å; T1957-R1960 WeakPolarHBondContact CG2-O 3.26Å; S1958-R1960 PolarHBondContact O-N 2.99Å; R1960-I1962 PolarHBondContact O-N 3.07Å
1961	K	41.6	Very low	51.9	Low	138 Å²	138	69.4 Å²	69.4	60%	0.6	36%	0.363	S	S	*	.			trans	-61.6	114.8	143.8	-77.5	-174.1	179.6	-177.2	0	105	Y1132 N1963	Y1132-K1961 HydrophobicContact CE1-CD 4.38Å; Y1132-K1961 PolarHBondContact OH-NZ 3.49Å; K1961-N1963 PolarHBondContact O-N 2.97Å
1962	I	41.1	Very low	50.1	Low	60 Å²	60	74 Å²	74	31%	0.308	39%	0.388	S	S	.	.			trans	-53.9	129	168.5	-61	166.9	0	0	0	105.7	T1957 R1960 D1966 V1967	T1957-I1962 HydrophobicContact CG2-CD1 4.1Å; T1957-I1962 HydrophobicContact CG2-CG1 4.16Å; R1960-I1962 PolarHBondContact O-N 3.07Å; I1962-D1966 VanDerWaalsContact CG2-C 3.43Å; I1962-D1966 HydrophobicContact CG2-CB 3.32Å; I1962-V1967 HydrophobicContact CB-CG2 3.56Å; I1962-V1967 HydrophobicContact CD1-CG2 4.44Å; I1962-V1967 HydrophobicContact CG2-CB 4.31Å; I1962-V1967 HydrophobicContact CG2-CG2 3.43Å; I1962-V1967 VanDerWaalsContact CG2-CG2 3.43Å; I1962-V1967 VanDerWaalsContact CG2-N 3.3Å
1963	N	41.6	Very low	48.8	Very low	82 Å²	82	76.7 Å²	76.7	44%	0.439	40%	0.401	S	S	.	.			trans	-50.6	147.4	178.1	-86.2	-7.1	0	0	0	108.4	K1961 N1965 D1966 V1967	K1961-N1963 PolarHBondContact O-N 2.97Å; N1963-N1965 PolarHBondContact O-N 3.48Å; N1963-D1966 HydrophobicContact CB-CB 4.21Å; N1963-D1966 WeakPolarHBondContact O-CA 3.38Å; N1963-D1966 PolarHBondContact O-N 3.31Å; N1963-V1967 PolarHBondContact O-N 3Å
1964	H	34.3	Very low	47.3	Very low	167 Å²	167	78.1 Å²	78.1	77%	0.773	41%	0.409	S	S	*	.	H	α-helix	trans	-52.6	-38.1	177.7	-110.7	-68.1	0	0	0	110.9	D1966 V1967 T1968	H1964-D1966 PolarHBondContact O-N 3.23Å; H1964-V1967 PolarHBondContact O-N 3.18Å; H1964-T1968 WeakPolarHBondContact O-CG2 3.35Å; H1964-T1968 PolarHBondContact O-N 3.35Å; H1964-T1968 PolarHBondContact O-OG1 3.02Å
1965	N	37.8	Very low	45.9	Very low	108 Å²	108	81.9 Å²	81.9	58%	0.578	43%	0.429	S	S	*	.	H	α-helix	trans	-63.2	-32.3	172.1	-67.2	-2.3	0	0	0	114.6	N1963 T1968 K1969	N1963-N1965 PolarHBondContact O-N 3.48Å; N1965-T1968 VanDerWaalsContact CA-OG1 3.3Å; N1965-T1968 WeakPolarHBondContact CA-OG1 3.46Å; N1965-T1968 PolarHBondContact O-OG1 3.23Å; N1965-K1969 WeakPolarHBondContact O-CB 3.34Å; N1965-K1969 WeakPolarHBondContact O-CD 3.45Å; N1965-K1969 WeakPolarHBondContact O-CG 3.32Å; N1965-K1969 PolarHBondContact O-N 3.37Å
1966	D	44.4	Very low	44.7	Very low	30 Å²	30	81.4 Å²	81.4	16%	0.16	43%	0.429	C	S	.	.	H	α-helix	trans	-84.3	-27.2	-179.7	-70.3	-11.2	0	0	0	111.7	R1937 I1962 N1963 H1964 K1969 V1970	R1937-D1966 IonicContact NH2-OD2 3.79Å; I1962-D1966 VanDerWaalsContact CG2-C 3.43Å; I1962-D1966 HydrophobicContact CG2-CB 3.32Å; N1963-D1966 HydrophobicContact CB-CB 4.21Å; N1963-D1966 WeakPolarHBondContact O-CA 3.38Å; N1963-D1966 PolarHBondContact O-N 3.31Å; H1964-D1966 PolarHBondContact O-N 3.23Å; D1966-K1969 IonicContact OD1-NZ 3.36Å; D1966-K1969 PolarHBondContact OD1-NZ 3.38Å; D1966-V1970 WeakPolarHBondContact O-CG2 3.09Å; D1966-V1970 PolarHBondContact O-N 3.38Å
1967	V	44.1	Very low	43.6	Very low	73 Å²	73	84 Å²	84	44%	0.442	44%	0.44	S	S	.	.	H	α-helix	trans	-71	-44.6	167.7	-175.7	0	0	0	0	109.2	I1962 N1963 H1964 K1969 V1970 A1971	I1962-V1967 HydrophobicContact CB-CG2 3.56Å; I1962-V1967 HydrophobicContact CD1-CG2 4.44Å; I1962-V1967 HydrophobicContact CG2-CB 4.31Å; I1962-V1967 HydrophobicContact CG2-CG2 3.43Å; I1962-V1967 VanDerWaalsContact CG2-CG2 3.43Å; I1962-V1967 VanDerWaalsContact CG2-N 3.3Å; N1963-V1967 PolarHBondContact O-N 3Å; H1964-V1967 PolarHBondContact O-N 3.18Å; V1967-K1969 VanDerWaalsContact C-N 3.3Å; V1967-K1969 PolarHBondContact O-N 3.47Å; V1967-V1970 PolarHBondContact O-N 3.14Å; V1967-V1970 VanDerWaalsContact O-N 3.1Å; V1967-A1971 WeakPolarHBondContact O-CB 3.35Å; V1967-A1971 PolarHBondContact O-N 3.15Å
1968	T	41.3	Very low	42.6	Very low	63 Å²	63	84.3 Å²	84.3	39%	0.387	44%	0.437	S	S	.	.	H	α-helix	trans	-68.3	-24.7	174.3	57.5	0	0	0	0	112.9	H1964 N1965 V1970 N1972	H1964-T1968 WeakPolarHBondContact O-CG2 3.35Å; H1964-T1968 PolarHBondContact O-N 3.35Å; H1964-T1968 PolarHBondContact O-OG1 3.02Å; N1965-T1968 VanDerWaalsContact CA-OG1 3.3Å; N1965-T1968 WeakPolarHBondContact CA-OG1 3.46Å; N1965-T1968 PolarHBondContact O-OG1 3.23Å; T1968-V1970 VanDerWaalsContact C-N 3.31Å; T1968-N1972 WeakPolarHBondContact O-CA 3.28Å; T1968-N1972 WeakPolarHBondContact O-CB 3.42Å; T1968-N1972 PolarHBondContact O-N 3.34Å; T1968-N1972 PolarHBondContact O-OD1 3.19Å
1969	K	45.8	Very low	42.1	Very low	78 Å²	78	88.2 Å²	88.2	34%	0.339	45%	0.453	S	S	.	.	H	α-helix	trans	-79.1	-5.5	169.1	-77.1	167.7	-173	172.1	0	115.2	R1916 N1965 D1966 V1967	R1916-K1969 PolarHBondContact NE-O 3.34Å; R1916-K1969 PolarHBondContact NH2-O 3.26Å; N1965-K1969 WeakPolarHBondContact O-CB 3.34Å; N1965-K1969 WeakPolarHBondContact O-CD 3.45Å; N1965-K1969 WeakPolarHBondContact O-CG 3.32Å; N1965-K1969 PolarHBondContact O-N 3.37Å; D1966-K1969 IonicContact OD1-NZ 3.36Å; D1966-K1969 PolarHBondContact OD1-NZ 3.38Å; V1967-K1969 VanDerWaalsContact C-N 3.3Å; V1967-K1969 PolarHBondContact O-N 3.47Å
1970	V	47.2	Very low	41.5	Very low	58 Å²	58	89.2 Å²	89.2	35%	0.352	47%	0.466	S	S	.	.	H	α-helix	trans	-106.1	-26.1	172.2	170.8	0	0	0	0	110.6	L1951 D1966 V1967 T1968	L1951-V1970 HydrophobicContact CD2-CG1 4.27Å; D1966-V1970 WeakPolarHBondContact O-CG2 3.09Å; D1966-V1970 PolarHBondContact O-N 3.38Å; V1967-V1970 PolarHBondContact O-N 3.14Å; V1967-V1970 VanDerWaalsContact O-N 3.1Å; T1968-V1970 VanDerWaalsContact C-N 3.31Å
1971	A	44.3	Very low	41.8	Very low	66 Å²	66	89.9 Å²	89.9	55%	0.545	48%	0.48	S	S	.	.	H	α-helix	trans	-80.8	-31.6	168	0	0	0	0	0	112.9	V1967	V1967-A1971 WeakPolarHBondContact O-CB 3.35Å; V1967-A1971 PolarHBondContact O-N 3.15Å
1972	N	38.5	Very low	41.9	Very low	156 Å²	156	85.5 Å²	85.5	83%	0.834	47%	0.469	S	S	*	.			trans	-99.3	0	167.7	-48.5	2.2	0	0	0	110.4	R1916 T1968	R1916-N1972 PolarHBondContact NH2-OXT 3.41Å; T1968-N1972 WeakPolarHBondContact O-CA 3.28Å; T1968-N1972 WeakPolarHBondContact O-CB 3.42Å; T1968-N1972 PolarHBondContact O-N 3.34Å; T1968-N1972 PolarHBondContact O-OD1 3.19Å

Retrieved 1,972 of 1,972 residues in 1191.1 ms (Link to these results)

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