A0A087XVL6_POEFO Loading...

Ubinuclein 2a

AlphaFold DB , UniProt , Accession A0A087XVL6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,188 aa.

						>A0A087XVL6_POEFO|A0A087XVL6
MAEPRKVQFVTLSAFAAGTAAESRKRRLDEETDFNFDRAGEDEAGGGAGGSASNGRLGKTGDRDKAAAERRATVRLNLSLSEPDERTSAEFNYGELIQNLQTKSNLPSLTSSVNRFNDDDEEERERLEVEALAKKFENKYGNTGMKKRKDRMQDLIDIGFGYDETDPFIDNSEAYDELVPASLTTKLGGFYINTGTLQFRAASDSEGEEDKVRQVKHKVRGVKLSFILGQIKKLDVLKGLFVSECTVNKVTKQGVTALNLHRPEKKKRKKLMKDSLYLAAMLRRFTREKEEMKKRNPSGDHLRLAAGTASKPPNPGNATHLPLASNSTHLQGGGASTGNLSLTDLTSDPAVMSLLGSANEKELQDLLGDLDFSLLDTDQQHAMATARENGILGIGVPSQKAVGGSGQGRSLGSSGGLFPPPPLPDGLPAPLIKRIEDLRTASRQFDQEGRKKFFTLDMNNILLDIELQVQEQPPEIRSDIYSHMEAFVPCNKEALLKRLKKLSLNIQDDRLRAPLLKLKLAVCSVMPEQIAKYNMECMAKVAKQQSEEGDRNGSEEEDDEKPGKRVMGPRKKFIWDDKLRTLLCNLVSVKLSCYEMENQCTLSVEDYLKAFLENEVKPLWPKGWMQTRILFKESLAVHGHLTGNLVRRRVVPGPKAKAKDGLWINKLPLTMTSNPAVTSARQPPLMASPPEPICLSDSLDEDLTAPSLDSISHALALLSNASKGLGLADSPMSQLATSAASTLQQHSLVKAEPAPLPPAASVGNLSGTSSSTSSSSSTSPVVSSMAHLHTPGLSLASRTADCHYGQVKGCLAQTQRHVTMVTPSHRPQAAMGKMHPHPSPSPPKQRPPPTASPLLPPHQKGFTCPAGILGTLGGVSKTAVKPSGISSSNGGGALSGPVQPPSSSSPSTQPRSNSTSHHVPQSFHPPSPAPSSSPSPTSQSKPQSHHHHQANFITPMQATLTKSSHSSNSSPIIKLTPRPPAPTPPPSSSPSPSSSPSHQLSHQQHQYASKTPKTFRTPFSVSGGGPVKPAPPAGCSFVQKPQPPPSSSANNKGDKTPPSSTASALANQRQRVSVGGAIQSSKAGNGWAPSGTLATSATTSHLSQVSAAGSPLLTNHSALPLGFGMLGGLVPVSLPFQFPPLLNFSAPGAASAASMGSTPSSNSGYPLAQSDLMDSNQSQSGDMKRKTH
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.9	Very low	37.5	Very low	166 Å²	166	158.9 Å²	158.9	82%	0.818	81%	0.806	S	S	*	*				0	145.4	0	-79.3	-178.7	75.9	0	0	108	P322 L323	M1-P322 WeakPolarHBondContact CE-O 3.46Å; M1-L323 HydrophobicContact CB-CB 4.37Å; M1-L323 HydrophobicContact CB-CD1 3.84Å; M1-L323 HydrophobicContact CE-CD1 4.29Å; M1-L323 HydrophobicContact CG-CB 3.9Å; M1-L323 HydrophobicContact CG-CD1 4.07Å
2	A	37.3	Very low	37	Very low	69 Å²	69	158.6 Å²	158.6	57%	0.57	81%	0.806	S	S	*	*			trans	-74.9	158.5	167.2	0	0	0	0	0	110.6	L323	A2-L323 HydrophobicContact CB-CD1 3.96Å; A2-L323 HydrophobicContact CB-CD2 3.84Å; A2-L323 HydrophobicContact CB-CG 4.5Å
3	E	33.8	Very low	36.5	Very low	177 Å²	177	155.3 Å²	155.3	83%	0.827	81%	0.807	S	S	*	*			trans	-128.6	140	-161.9	-173.2	172	-138.8	0	0	110.6
4	P	46.9	Very low	36.2	Very low	119 Å²	119	151.3 Å²	151.3	77%	0.773	81%	0.807	S	S	*	*			trans	-80	125.1	-178.2	30.9	-33.3	0	0	0	111.9
5	R	46.2	Very low	35.8	Very low	247 Å²	247	155.4 Å²	155.4	93%	0.932	82%	0.816	S	S	*	*			trans	-57.4	144.1	173	-58.1	175.6	-177.9	125.3	-1.8	111.4
6	K	41.3	Very low	35.5	Very low	209 Å²	209	152.1 Å²	152.1	91%	0.909	82%	0.818	S	S	*	*			trans	-131.4	145.3	156.3	-83.1	-168.8	173.9	-178.5	0	111.4
7	V	35.9	Very low	35.1	Very low	128 Å²	128	148.8 Å²	148.8	78%	0.776	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-92.8	140.7	-174	-177	0	0	0	0	109.5
8	Q	36.3	Very low	34.8	Very low	182 Å²	182	145.1 Å²	145.1	85%	0.85	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-90.1	134.7	167.4	-69.8	-175.3	-6.2	0	0	110
9	F	29	Very low	34.5	Very low	200 Å²	200	144.8 Å²	144.8	88%	0.877	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-85.9	134	167.7	-75.8	-95.4	0	0	0	109.3
10	V	35.9	Very low	34.2	Very low	120 Å²	120	142.9 Å²	142.9	73%	0.727	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-102.3	120.1	173.2	175.8	0	0	0	0	108.4	L12	V10-L12 HydrophobicContact CG1-CD2 4.19Å
11	T	35	Very low	34	Very low	131 Å²	131	141 Å²	141	80%	0.804	83%	0.825	S	S	*	*			trans	-91	115.3	170.3	-54.1	0	0	0	0	108.9
12	L	31.9	Very low	33.5	Very low	155 Å²	155	142.2 Å²	142.2	81%	0.812	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.1	125.5	169.8	-61.1	173.5	0	0	0	108.9	V10	V10-L12 HydrophobicContact CG1-CD2 4.19Å
13	S	29.5	Very low	33.1	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-81.8	124.7	165.6	-68.2	0	0	0	0	109.4
14	A	32.3	Very low	33	Very low	99 Å²	99	144.1 Å²	144.1	82%	0.818	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-79.7	140.2	176.8	0	0	0	0	0	111.4
15	F	30.8	Very low	32.2	Very low	213 Å²	213	145.8 Å²	145.8	93%	0.934	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-74.3	138.4	159.3	-86.9	-112	0	0	0	108.9
16	A	30.6	Very low	31.5	Very low	102 Å²	102	143.9 Å²	143.9	84%	0.843	81%	0.813	S	S	*	*			trans	-112	117	161.2	0	0	0	0	0	107.8
17	A	29.9	Very low	30.8	Very low	97 Å²	97	145 Å²	145	80%	0.802	81%	0.811	S	S	*	*			trans	-94.5	126.4	172.5	0	0	0	0	0	108.9
18	G	28.4	Very low	30.6	Very low	82 Å²	82	144.3 Å²	144.3	85%	0.845	80%	0.803	S	S	*	*			trans	-106.9	98.4	173.2	0	0	0	0	0	110.2
19	T	29.6	Very low	30.2	Very low	139 Å²	139	143.8 Å²	143.8	85%	0.853	81%	0.805	S	S	*	*			trans	-92	118.3	172.4	48	0	0	0	0	110.1
20	A	27.7	Very low	30.3	Very low	106 Å²	106	142.1 Å²	142.1	88%	0.876	80%	0.8	S	S	*	*			trans	-119	117.1	163.1	0	0	0	0	0	107.8
21	A	30.5	Very low	30	Very low	105 Å²	105	144.6 Å²	144.6	87%	0.868	80%	0.804	S	S	*	*			trans	-118.3	126.6	175.9	0	0	0	0	0	108.4
22	E	25.6	Very low	29.7	Very low	191 Å²	191	143.7 Å²	143.7	89%	0.893	80%	0.799	S	S	*	*			trans	-110.6	132.7	-179.7	-167.7	175.1	167.3	0	0	109.7
23	S	27.5	Very low	29.4	Very low	74 Å²	74	142.7 Å²	142.7	52%	0.517	79%	0.794	S	S	.	*			trans	-161.3	101.3	178.4	-95.1	0	0	0	0	115.5
24	R	31.4	Very low	29.1	Very low	211 Å²	211	146.2 Å²	146.2	80%	0.796	80%	0.795	S	S	*	*			trans	74.3	164.7	143.9	-48.6	169.7	-140.1	-130.7	6.3	113.9
25	K	30.9	Very low	28.7	Very low	155 Å²	155	149 Å²	149	67%	0.674	80%	0.796	S	S	*	*			cis	-156.6	136.6	9.3	-147.7	167.3	-169.9	-178.8	0	113.1
26	R	31.3	Very low	28.5	Very low	207 Å²	207	147.3 Å²	147.3	78%	0.781	79%	0.789	S	S	*	*			trans	15.3	138.6	147.2	-47.3	-179.5	-145.1	146.1	-8.8	121.5
27	R	27	Very low	28.2	Very low	232 Å²	232	148.6 Å²	148.6	88%	0.875	78%	0.781	S	S	*	*				-147.1	137.1	94	-91.7	-174.3	167.8	97.9	-7.1	107
28	L	31.1	Very low	28	Very low	114 Å²	114	154.9 Å²	154.9	60%	0.597	78%	0.784	S	S	*	*			cis	70.7	107.2	47.8	-171.7	76.3	0	0	0	112.8	E30	L28-E30 HydrophobicContact CD1-CB 4.29Å
29	D	28.5	Very low	28	Very low	170 Å²	170	155.8 Å²	155.8	91%	0.909	78%	0.784	S	S	*	*				-138.3	158.8	127.1	-84.7	-42.7	0	0	0	107.6
30	E	31.1	Very low	27.8	Very low	165 Å²	165	152.3 Å²	152.3	77%	0.771	78%	0.775	S	S	*	*			trans	-150.9	130.5	-165.8	169.9	-179.7	-171.5	0	0	108.2	L28	L28-E30 HydrophobicContact CD1-CB 4.29Å
31	E	29.8	Very low	27.8	Very low	173 Å²	173	156 Å²	156	81%	0.808	78%	0.775	S	S	*	*			trans	-175.2	132.1	145.2	-107.9	-177	149.3	0	0	112
32	T	29.1	Very low	27.7	Very low	112 Å²	112	158 Å²	158	69%	0.687	77%	0.771	S	S	*	*			trans	54.3	156.5	144.6	57	0	0	0	0	122
33	D	24.4	Very low	27.8	Very low	134 Å²	134	157.6 Å²	157.6	72%	0.717	77%	0.769	S	S	*	*			cis	-140.8	175.8	10.2	-138	-46.8	0	0	0	113.9
34	F	24.8	Very low	27.8	Very low	189 Å²	189	157.8 Å²	157.8	83%	0.829	78%	0.775	S	S	*	*			trans	-73.8	155.5	179.6	-70.1	-111	0	0	0	112.8
35	N	23.7	Very low	27.6	Very low	157 Å²	157	151.7 Å²	151.7	84%	0.84	78%	0.778	S	S	*	*				175.9	175.2	95.2	-156.5	9.7	0	0	0	112.7
36	F	25.6	Very low	27.3	Very low	179 Å²	179	148.5 Å²	148.5	79%	0.785	79%	0.789	S	S	*	*			trans	-110.2	172.7	177.8	-147.6	-100.3	0	0	0	111.6
37	D	24.7	Very low	27	Very low	128 Å²	128	142.1 Å²	142.1	68%	0.684	79%	0.787	S	S	*	*			trans	85.9	145.1	154.9	-134.1	-41.4	0	0	0	121.1
38	R	25.9	Very low	27.1	Very low	230 Å²	230	136.6 Å²	136.6	87%	0.868	79%	0.791	S	S	*	*			trans	75.3	153.4	154.3	-126.7	169.6	179.3	97.6	-2	122
39	A	27.1	Very low	26.8	Very low	100 Å²	100	134.7 Å²	134.7	83%	0.826	80%	0.8	S	S	*	*			trans	-116.7	159.6	-178.1	0	0	0	0	0	111.1
40	G	26.1	Very low	26.6	Very low	66 Å²	66	130.4 Å²	130.4	68%	0.68	80%	0.796	S	S	*	*			trans	158	100.5	172	0	0	0	0	0	113.5
41	E	28.1	Very low	26.5	Very low	185 Å²	185	128.7 Å²	128.7	86%	0.864	80%	0.801	S	S	*	*			trans	45.7	141.1	134.2	-66.8	164	149.8	0	0	123.1
42	D	28.5	Very low	26.4	Very low	147 Å²	147	124.9 Å²	124.9	79%	0.786	80%	0.8	S	S	*	*			trans	76.3	105.2	142	-66.3	3	0	0	0	125
43	E	27.4	Very low	26.4	Very low	181 Å²	181	125.4 Å²	125.4	85%	0.846	81%	0.808	S	S	*	*				74.9	157.3	121.2	-109.2	-72.1	82.6	0	0	123.9
44	A	28.6	Very low	26.6	Very low	79 Å²	79	127.2 Å²	127.2	65%	0.653	82%	0.818	S	S	*	*			trans	75.8	87.7	153.7	0	0	0	0	0	121.1
45	G	26.2	Very low	26.7	Very low	83 Å²	83	121.2 Å²	121.2	86%	0.856	81%	0.809	S	S	*	*				92	103.5	101.5	0	0	0	0	0	122.4
46	G	25	Very low	26.9	Very low	87 Å²	87	124.9 Å²	124.9	90%	0.897	81%	0.811	S	S	*	*			trans	81.4	162.2	149.9	0	0	0	0	0	118.1
47	G	24.7	Very low	27.2	Very low	73 Å²	73	122.5 Å²	122.5	75%	0.753	81%	0.806	S	S	*	*			cis	168.2	135.7	-10.3	0	0	0	0	0	114
48	A	28.1	Very low	27.3	Very low	116 Å²	116	119.5 Å²	119.5	96%	0.959	81%	0.805	S	S	*	*			trans	62.6	158.3	173.9	0	0	0	0	0	118.1
49	G	25	Very low	27.6	Very low	75 Å²	75	117.3 Å²	117.3	77%	0.773	80%	0.802	S	S	*	*			cis	164.4	135.6	-14.6	0	0	0	0	0	115.4
50	G	26.1	Very low	27.8	Very low	80 Å²	80	118.6 Å²	118.6	83%	0.825	80%	0.8	S	S	*	*			trans	75.4	175.7	165.2	0	0	0	0	0	117.6
51	S	27.9	Very low	28	Very low	128 Å²	128	119.2 Å²	119.2	90%	0.895	81%	0.806	S	S	*	*			cis	-160.5	168	-24.9	-160.5	0	0	0	0	111.7
52	A	28.2	Very low	28	Very low	93 Å²	93	117.6 Å²	117.6	77%	0.769	80%	0.803	S	S	*	*			trans	-61.1	165.9	-169.7	0	0	0	0	0	118.6
53	S	29.3	Very low	28.2	Very low	124 Å²	124	120.5 Å²	120.5	87%	0.867	80%	0.804	S	S	*	*			trans	-161.3	173.4	134.4	50.6	0	0	0	0	112.4
54	N	27.7	Very low	28.6	Very low	172 Å²	172	119.7 Å²	119.7	92%	0.92	81%	0.805	S	S	*	*			trans	-143	154.3	-150.5	-129.3	-21.3	0	0	0	113.8
55	G	26.6	Very low	29	Very low	62 Å²	62	125.9 Å²	125.9	64%	0.639	82%	0.817	S	S	*	*			trans	174.1	107.2	164.2	0	0	0	0	0	112.8
56	R	29.1	Very low	29.5	Very low	234 Å²	234	127 Å²	127	88%	0.883	82%	0.818	S	S	*	*				64	136.1	78.5	-82.2	-162.5	156.7	-136.3	2.3	115
57	L	31.6	Very low	30	Very low	129 Å²	129	127.5 Å²	127.5	68%	0.675	81%	0.814	S	S	*	*			cis	-170.6	139.5	-8.7	172.2	62.4	0	0	0	112.2
58	G	26.6	Very low	30.6	Very low	66 Å²	66	128.2 Å²	128.2	68%	0.68	81%	0.812	S	S	*	*			trans	156.1	113.5	159.2	0	0	0	0	0	111.8
59	K	32.8	Very low	31.1	Very low	183 Å²	183	132.1 Å²	132.1	80%	0.796	81%	0.811	S	S	*	*				71.3	126.4	50.1	-74.5	-161.9	163.7	-172.4	0	114
60	T	31.5	Very low	31.9	Very low	128 Å²	128	139.4 Å²	139.4	79%	0.785	82%	0.815	S	S	*	*			cis	-161.8	148.9	2.4	22.6	0	0	0	0	113.8
61	G	29.6	Very low	32.9	Very low	79 Å²	79	147.2 Å²	147.2	81%	0.814	82%	0.82	S	S	*	*			trans	84.7	152.2	143.4	0	0	0	0	0	118.2
62	D	28.3	Very low	34.6	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	81%	0.813	S	S	*	*			cis	-158.3	160.5	-6.6	179.8	34	0	0	0	109.9
63	R	32.3	Very low	36.8	Very low	209 Å²	209	147.7 Å²	147.7	79%	0.789	82%	0.817	S	S	*	*			trans	59.8	108.7	179.9	-53.9	174.7	66.4	171.1	1.6	115
64	D	35.7	Very low	39.1	Very low	163 Å²	163	145.4 Å²	145.4	87%	0.872	80%	0.798	S	S	*	*				-141.9	152.5	61.9	-95.3	-36.4	0	0	0	114.4
65	K	37.7	Very low	41.6	Very low	210 Å²	210	147.6 Å²	147.6	91%	0.913	79%	0.793	S	S	*	*			trans	-128.3	71.2	-167.1	-166	-164.5	176.8	-174	0	113.5
66	A	35.7	Very low	44.3	Very low	106 Å²	106	147.1 Å²	147.1	88%	0.876	78%	0.776	S	S	*	*			trans	-158.1	58.5	169	0	0	0	0	0	112.8
67	A	36.3	Very low	46.8	Very low	97 Å²	97	142.8 Å²	142.8	80%	0.802	77%	0.77	S	S	*	*			trans	-116.6	130.7	178.5	0	0	0	0	0	112.4
68	A	37.2	Very low	49.3	Very low	88 Å²	88	140.3 Å²	140.3	73%	0.727	76%	0.757	S	S	*	*			trans	51.4	75.6	164.2	0	0	0	0	0	117.7	R70	A68-R70 PolarHBondContact O-N 2.77Å
69	E	38.7	Very low	51.7	Low	198 Å²	198	142.2 Å²	142.2	93%	0.925	76%	0.76	S	S	*	*			trans	-69.2	108.8	151.4	-169.6	166.8	-113.3	0	0	108.4	R71	E69-R71 PolarHBondContact O-N 2.7Å
70	R	41.1	Very low	54.1	Low	229 Å²	229	139.7 Å²	139.7	86%	0.864	76%	0.755	S	S	*	*			trans	-73.9	121.8	-173.6	-54.8	-178.1	-161.6	135	1.3	109.9	A68 A72	A68-R70 PolarHBondContact O-N 2.77Å; R70-A72 PolarHBondContact O-N 2.58Å
71	R	46.7	Very low	56.1	Low	243 Å²	243	137.5 Å²	137.5	92%	0.917	75%	0.745	S	S	*	*			trans	-65	105.2	162.6	-72.6	-177.1	175.9	175.1	-2.2	108.7	E69 T73	E69-R71 PolarHBondContact O-N 2.7Å; R71-T73 PolarHBondContact O-N 3.3Å
72	A	63.4	Low	57.8	Low	92 Å²	92	142.7 Å²	142.7	76%	0.76	75%	0.748	S	S	*	*			trans	-75	102.1	177.4	0	0	0	0	0	110	R70 V74	R70-A72 PolarHBondContact O-N 2.58Å; A72-V74 PolarHBondContact O-N 2.87Å
73	T	74.4	Confident	59.8	Low	139 Å²	139	140.2 Å²	140.2	85%	0.853	74%	0.74	S	S	*	*			trans	-77.6	114.2	177.1	-52.8	0	0	0	0	110.2	R71	R71-T73 PolarHBondContact O-N 3.3Å
74	V	77.7	Confident	61.5	Low	76 Å²	76	136.4 Å²	136.4	46%	0.461	74%	0.735	S	S	.	*			trans	-94.4	130.7	174.3	-177.6	0	0	0	0	109.3	A72 L76 I97 L100	A72-V74 PolarHBondContact O-N 2.87Å; V74-L76 HydrophobicContact CG1-CD2 3.85Å; V74-L76 HydrophobicContact CG1-CG 4.47Å; V74-I97 HydrophobicContact CB-CD1 4.18Å; V74-I97 HydrophobicContact CG1-CD1 3.86Å; V74-I97 HydrophobicContact CG2-CD1 4.36Å; V74-L100 HydrophobicContact CG1-CD1 3.57Å
75	R	81.3	Confident	62.9	Low	218 Å²	218	138.4 Å²	138.4	82%	0.823	74%	0.739	S	S	*	*			trans	-104.9	114.1	176.9	-172.1	172.9	-177.7	162.4	1.5	109.7
76	L	82.6	Confident	64.2	Low	52 Å²	52	139.8 Å²	139.8	27%	0.272	74%	0.739	S	S	.	*			trans	-97.8	135.4	177.6	-55.1	179.9	0	0	0	109.5	V74 Y93 L96 I97 L100	V74-L76 HydrophobicContact CG1-CD2 3.85Å; V74-L76 HydrophobicContact CG1-CG 4.47Å; L76-Y93 HydrophobicContact CD1-CD2 3.83Å; L76-Y93 HydrophobicContact CD1-CE2 3.74Å; L76-L96 HydrophobicContact CD1-CB 4.25Å; L76-L96 HydrophobicContact CD1-CD1 4.23Å; L76-I97 HydrophobicContact CD2-CD1 4.32Å; L76-L100 HydrophobicContact CD2-CD1 3.43Å; L76-L100 VanDerWaalsContact CD2-CD1 3.43Å
77	N	82.1	Confident	65.7	Low	143 Å²	143	139.5 Å²	139.5	77%	0.765	73%	0.726	S	S	*	*			trans	-113.2	120.2	169.5	-64.9	-37	0	0	0	107.4
78	L	83.6	Confident	67.5	Low	77 Å²	77	138.2 Å²	138.2	40%	0.403	71%	0.711	S	S	.	*			trans	-121.2	127.7	-178.3	-56.1	179.1	0	0	0	109.6	F91 L96	L78-F91 HydrophobicContact CD1-CB 4.34Å; L78-F91 HydrophobicContact CD1-CD2 4.35Å; L78-F91 HydrophobicContact CD1-CG 4.21Å; L78-F91 HydrophobicContact CD2-CD1 4.06Å; L78-F91 HydrophobicContact CD2-CE1 4.37Å; L78-F91 HydrophobicContact CD2-CG 4.41Å; L78-L96 HydrophobicContact CD1-CD1 3.96Å; L78-L96 HydrophobicContact CD2-CD1 3.62Å; L78-L96 HydrophobicContact CD2-CD2 3.59Å; L78-L96 HydrophobicContact CD2-CG 4.27Å; L78-L96 HydrophobicContact CG-CD1 4.41Å
79	S	77.1	Confident	69.4	Low	106 Å²	106	135.8 Å²	135.8	74%	0.741	69%	0.691	S	S	*	*			trans	-89.6	104.7	175.2	52.1	0	0	0	0	109.7
80	L	82.7	Confident	71.4	Confident	131 Å²	131	134 Å²	134	69%	0.686	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-83.1	124.3	175.1	-50.9	-175.3	0	0	0	109.4	F91	L80-F91 HydrophobicContact CD2-CD2 4.26Å; L80-F91 HydrophobicContact CD2-CE2 3.6Å; L80-F91 HydrophobicContact CD2-CZ 4.46Å
81	S	73.8	Confident	73.4	Confident	82 Å²	82	127.4 Å²	127.4	57%	0.573	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-81.4	158.2	164.7	57.5	0	0	0	0	110.4
82	E	65.9	Low	75.1	Confident	187 Å²	187	119.9 Å²	119.9	87%	0.874	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-63.2	136	171	-61.1	-170	144.2	0	0	109.8
83	P	69.4	Low	75.9	Confident	99 Å²	99	122.8 Å²	122.8	64%	0.643	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-83.6	128.8	-176.9	31.7	-33.5	0	0	0	111.8
84	D	68.8	Low	76.3	Confident	128 Å²	128	118.1 Å²	118.1	68%	0.684	61%	0.61	S	S	*	*	B	Isolated β-bridge	trans	-92.1	163.2	172.4	-102.2	-35.2	0	0	0	111.1	R86 T87	D84-R86 PolarHBondContact O-N 3.18Å; D84-T87 PolarHBondContact N-O 3.05Å; D84-T87 VanDerWaalsContact N-O 3.12Å; D84-T87 PolarHBondContact O-N 3.44Å
85	E	65.3	Low	76.4	Confident	205 Å²	205	119.6 Å²	119.6	96%	0.958	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-6.5	-176.9	-65.8	-169.2	145.2	0	0	115.7
86	R	63.9	Low	76.4	Confident	240 Å²	240	111.1 Å²	111.1	91%	0.906	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	-7.4	177.5	-71.7	-177.9	172.4	160.3	-1.5	115.2	D84	D84-R86 PolarHBondContact O-N 3.18Å
87	T	68.1	Low	76.4	Confident	99 Å²	99	110.2 Å²	110.2	61%	0.607	58%	0.578	S	S	*	*	B	Isolated β-bridge	trans	-152.3	123.3	-173.1	48	0	0	0	0	112.8	D84	D84-T87 PolarHBondContact N-O 3.05Å; D84-T87 VanDerWaalsContact N-O 3.12Å; D84-T87 PolarHBondContact O-N 3.44Å
88	S	73.2	Confident	76.2	Confident	71 Å²	71	109.1 Å²	109.1	50%	0.497	57%	0.568	S	S	.	*			trans	-106.4	154.9	169.3	35.2	0	0	0	0	112	E90	S88-E90 PolarHBondContact O-N 3.23Å; S88-E90 VanDerWaalsContact O-N 3.11Å; S88-E90 PolarHBondContact OG-OE1 3.28Å
89	A	77.3	Confident	75.6	Confident	36 Å²	36	110.2 Å²	110.2	30%	0.298	57%	0.574	S	S	.	*			trans	-75.4	96.5	174.7	0	0	0	0	0	111	F91	A89-F91 HydrophobicContact CB-CE2 3.9Å; A89-F91 HydrophobicContact CB-CZ 4.47Å
90	E	80.4	Confident	75.3	Confident	160 Å²	160	109.3 Å²	109.3	75%	0.748	56%	0.561	S	S	*	*			trans	-98.8	140.7	-178.5	-71.4	172.2	-143.4	0	0	112	S88	S88-E90 PolarHBondContact O-N 3.23Å; S88-E90 VanDerWaalsContact O-N 3.11Å; S88-E90 PolarHBondContact OG-OE1 3.28Å
91	F	83.9	Confident	74.4	Confident	92 Å²	92	108.8 Å²	108.8	40%	0.404	56%	0.555	S	S	.	*			trans	-140.7	125.7	-178.5	-60.8	-89.3	0	0	0	111.7	L78 L80 A89 L96	L78-F91 HydrophobicContact CD1-CB 4.34Å; L78-F91 HydrophobicContact CD1-CD2 4.35Å; L78-F91 HydrophobicContact CD1-CG 4.21Å; L78-F91 HydrophobicContact CD2-CD1 4.06Å; L78-F91 HydrophobicContact CD2-CE1 4.37Å; L78-F91 HydrophobicContact CD2-CG 4.41Å; L80-F91 HydrophobicContact CD2-CD2 4.26Å; L80-F91 HydrophobicContact CD2-CE2 3.6Å; L80-F91 HydrophobicContact CD2-CZ 4.46Å; A89-F91 HydrophobicContact CB-CE2 3.9Å; A89-F91 HydrophobicContact CB-CZ 4.47Å; F91-L96 HydrophobicContact CB-CD1 3.96Å
92	N	83.1	Confident	73.5	Confident	84 Å²	84	108.8 Å²	108.8	45%	0.449	55%	0.551	S	S	.	*			trans	-85.1	116.9	175.2	-177.2	-12.6	0	0	0	110.8	G94 E95 L96	N92-G94 VanDerWaalsContact C-N 3.26Å; N92-G94 PolarHBondContact O-N 3.46Å; N92-G94 PolarHBondContact OD1-N 3.47Å; N92-E95 HydrophobicContact CB-CB 4.06Å; N92-E95 HydrophobicContact CB-CG 3.99Å; N92-E95 WeakPolarHBondContact CB-OE1 2.92Å; N92-E95 PolarHBondContact ND2-OE1 3.46Å; N92-E95 PolarHBondContact O-N 3.47Å; N92-L96 WeakPolarHBondContact O-CG 3.17Å; N92-L96 PolarHBondContact O-N 3.23Å
93	Y	79.3	Confident	72.8	Confident	154 Å²	154	109 Å²	109	60%	0.604	55%	0.549	S	S	*	.	H	α-helix	trans	-59.2	-34.7	178.5	-179.9	-100.6	0	0	0	113.1	L76 L96 I97	L76-Y93 HydrophobicContact CD1-CD2 3.83Å; L76-Y93 HydrophobicContact CD1-CE2 3.74Å; Y93-L96 PolarHBondContact O-N 3.13Å; Y93-I97 HydrophobicContact CD1-CG1 4.26Å; Y93-I97 HydrophobicContact CD2-CG1 4.36Å; Y93-I97 HydrophobicContact CE1-CG1 3.8Å; Y93-I97 HydrophobicContact CE2-CD1 4.03Å; Y93-I97 HydrophobicContact CE2-CG1 3.92Å; Y93-I97 WeakPolarHBondContact O-CG1 3.44Å; Y93-I97 PolarHBondContact O-N 2.97Å
94	G	82.4	Confident	71.8	Confident	40 Å²	40	108.1 Å²	108.1	41%	0.412	55%	0.545	S	S	.	.	H	α-helix	trans	-62.7	-47.2	175.9	0	0	0	0	0	111.9	N92 I97 Q98	N92-G94 VanDerWaalsContact C-N 3.26Å; N92-G94 PolarHBondContact O-N 3.46Å; N92-G94 PolarHBondContact OD1-N 3.47Å; G94-I97 PolarHBondContact O-N 3.44Å; G94-Q98 VanDerWaalsContact O-CB 3.25Å; G94-Q98 WeakPolarHBondContact O-CB 3.33Å; G94-Q98 PolarHBondContact O-N 3.39Å
95	E	80.6	Confident	70.6	Confident	107 Å²	107	107.9 Å²	107.9	50%	0.5	54%	0.544	S	S	.	.	H	α-helix	trans	-67.1	-35.5	176.8	-68.5	164	-145	0	0	112.3	N92 Q98 N99	N92-E95 HydrophobicContact CB-CB 4.06Å; N92-E95 HydrophobicContact CB-CG 3.99Å; N92-E95 WeakPolarHBondContact CB-OE1 2.92Å; N92-E95 PolarHBondContact ND2-OE1 3.46Å; N92-E95 PolarHBondContact O-N 3.47Å; E95-Q98 PolarHBondContact O-N 3.45Å; E95-N99 VanDerWaalsContact O-CB 3.26Å; E95-N99 WeakPolarHBondContact O-CB 3.46Å; E95-N99 PolarHBondContact O-N 3.35Å; E95-N99 PolarHBondContact O-ND2 3.38Å
96	L	81.9	Confident	69	Low	41 Å²	41	106 Å²	106	22%	0.215	54%	0.54	C	S	.	.	H	α-helix	trans	-64.7	-43.8	175.9	-73	170.2	0	0	0	112.2	L76 L78 F91 N92 Y93 L100	L76-L96 HydrophobicContact CD1-CB 4.25Å; L76-L96 HydrophobicContact CD1-CD1 4.23Å; L78-L96 HydrophobicContact CD1-CD1 3.96Å; L78-L96 HydrophobicContact CD2-CD1 3.62Å; L78-L96 HydrophobicContact CD2-CD2 3.59Å; L78-L96 HydrophobicContact CD2-CG 4.27Å; L78-L96 HydrophobicContact CG-CD1 4.41Å; F91-L96 HydrophobicContact CB-CD1 3.96Å; N92-L96 WeakPolarHBondContact O-CG 3.17Å; N92-L96 PolarHBondContact O-N 3.23Å; Y93-L96 PolarHBondContact O-N 3.13Å; L96-L100 PolarHBondContact O-N 2.91Å
97	I	82.4	Confident	67.9	Low	32 Å²	32	100 Å²	100	16%	0.164	53%	0.532	C	S	.	.	H	α-helix	trans	-69.2	-41.2	175.1	-64.6	-63	0	0	0	110.8	V74 L76 Y93 G94 L100 Q101	V74-I97 HydrophobicContact CB-CD1 4.18Å; V74-I97 HydrophobicContact CG1-CD1 3.86Å; V74-I97 HydrophobicContact CG2-CD1 4.36Å; L76-I97 HydrophobicContact CD2-CD1 4.32Å; Y93-I97 HydrophobicContact CD1-CG1 4.26Å; Y93-I97 HydrophobicContact CD2-CG1 4.36Å; Y93-I97 HydrophobicContact CE1-CG1 3.8Å; Y93-I97 HydrophobicContact CE2-CD1 4.03Å; Y93-I97 HydrophobicContact CE2-CG1 3.92Å; Y93-I97 WeakPolarHBondContact O-CG1 3.44Å; Y93-I97 PolarHBondContact O-N 2.97Å; G94-I97 PolarHBondContact O-N 3.44Å; I97-L100 PolarHBondContact O-N 2.95Å; I97-Q101 WeakPolarHBondContact O-CG 3.31Å; I97-Q101 PolarHBondContact O-N 3.21Å; I97-Q101 VanDerWaalsContact O-N 3.1Å
98	Q	77.6	Confident	65.9	Low	121 Å²	121	100.9 Å²	100.9	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-65.6	-38.9	178.3	-168.7	171.6	67	0	0	112	G94 E95 L100 Q101 T102	G94-Q98 VanDerWaalsContact O-CB 3.25Å; G94-Q98 WeakPolarHBondContact O-CB 3.33Å; G94-Q98 PolarHBondContact O-N 3.39Å; E95-Q98 PolarHBondContact O-N 3.45Å; Q98-L100 VanDerWaalsContact C-N 3.3Å; Q98-L100 PolarHBondContact O-N 3.45Å; Q98-Q101 CarbonylContact O-C 3.55Å; Q98-Q101 WeakPolarHBondContact O-CA 3.4Å; Q98-Q101 WeakPolarHBondContact O-CB 3.5Å; Q98-Q101 PolarHBondContact O-N 3.29Å; Q98-T102 HydrophobicContact CG-CG2 4.39Å; Q98-T102 WeakPolarHBondContact O-CG2 3.33Å; Q98-T102 PolarHBondContact O-N 3.38Å; Q98-T102 PolarHBondContact O-OG1 3.5Å
99	N	70.6	Confident	64.1	Low	99 Å²	99	104.7 Å²	104.7	53%	0.529	56%	0.556	S	S	.	*	H	α-helix	trans	-66.3	-27.9	175.4	-85	-66.6	0	0	0	113.7	E95 T102 K103	E95-N99 VanDerWaalsContact O-CB 3.26Å; E95-N99 WeakPolarHBondContact O-CB 3.46Å; E95-N99 PolarHBondContact O-N 3.35Å; E95-N99 PolarHBondContact O-ND2 3.38Å; N99-T102 WeakPolarHBondContact CA-OG1 3.36Å; N99-T102 PolarHBondContact O-OG1 3.43Å; N99-K103 WeakPolarHBondContact O-CB 3.37Å; N99-K103 PolarHBondContact O-N 3.37Å
100	L	70.8	Confident	61.7	Low	88 Å²	88	109.8 Å²	109.8	46%	0.461	58%	0.584	S	S	.	*	H	α-helix	trans	-74.2	-31.5	170	-72.9	171.6	0	0	0	112.2	V74 L76 L96 I97 Q98	V74-L100 HydrophobicContact CG1-CD1 3.57Å; L76-L100 HydrophobicContact CD2-CD1 3.43Å; L76-L100 VanDerWaalsContact CD2-CD1 3.43Å; L96-L100 PolarHBondContact O-N 2.91Å; I97-L100 PolarHBondContact O-N 2.95Å; Q98-L100 VanDerWaalsContact C-N 3.3Å; Q98-L100 PolarHBondContact O-N 3.45Å
101	Q	64.3	Low	59.3	Low	120 Å²	120	107.5 Å²	107.5	56%	0.561	59%	0.585	S	S	*	*	H	α-helix	trans	-74.8	-43.9	175.1	-68.3	171.8	1	0	0	111.8	I97 Q98 K103 S104	I97-Q101 WeakPolarHBondContact O-CG 3.31Å; I97-Q101 PolarHBondContact O-N 3.21Å; I97-Q101 VanDerWaalsContact O-N 3.1Å; Q98-Q101 CarbonylContact O-C 3.55Å; Q98-Q101 WeakPolarHBondContact O-CA 3.4Å; Q98-Q101 WeakPolarHBondContact O-CB 3.5Å; Q98-Q101 PolarHBondContact O-N 3.29Å; Q101-K103 PolarHBondContact O-N 3.27Å; Q101-S104 WeakPolarHBondContact O-CB 3.43Å; Q101-S104 PolarHBondContact O-N 3.38Å; Q101-S104 PolarHBondContact O-OG 3.43Å
102	T	55	Low	56.7	Low	81 Å²	81	107.7 Å²	107.7	50%	0.497	60%	0.598	S	S	.	*	H	α-helix	trans	-67.6	-35.5	178.4	56.1	0	0	0	0	112.4	Q98 N99 S104 N105	Q98-T102 HydrophobicContact CG-CG2 4.39Å; Q98-T102 WeakPolarHBondContact O-CG2 3.33Å; Q98-T102 PolarHBondContact O-N 3.38Å; Q98-T102 PolarHBondContact O-OG1 3.5Å; N99-T102 WeakPolarHBondContact CA-OG1 3.36Å; N99-T102 PolarHBondContact O-OG1 3.43Å; T102-S104 PolarHBondContact O-N 3.06Å; T102-N105 PolarHBondContact O-N 3.16Å
103	K	51.7	Low	54.4	Low	191 Å²	191	109.6 Å²	109.6	83%	0.83	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-11.8	169.2	-94.7	-176.5	171.9	176.3	0	114.7	N99 Q101	N99-K103 WeakPolarHBondContact O-CB 3.37Å; N99-K103 PolarHBondContact O-N 3.37Å; Q101-K103 PolarHBondContact O-N 3.27Å
104	S	48.2	Very low	52.1	Low	81 Å²	81	110 Å²	110	57%	0.566	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-11.1	174.5	77.5	0	0	0	0	114.6	Q101 T102	Q101-S104 WeakPolarHBondContact O-CB 3.43Å; Q101-S104 PolarHBondContact O-N 3.38Å; Q101-S104 PolarHBondContact O-OG 3.43Å; T102-S104 PolarHBondContact O-N 3.06Å
105	N	42.3	Very low	50.2	Low	123 Å²	123	116.9 Å²	116.9	66%	0.658	64%	0.639	S	S	*	*			trans	-147.1	89.8	-168	-87.7	-83.6	0	0	0	114.7	T102	T102-N105 PolarHBondContact O-N 3.16Å
106	L	31.3	Very low	48.2	Very low	165 Å²	165	119.2 Å²	119.2	86%	0.864	65%	0.648	S	S	*	*			trans	-163.1	151.7	150.1	-139.3	53	0	0	0	107.6
107	P	41.6	Very low	46.3	Very low	116 Å²	116	124.6 Å²	124.6	75%	0.753	68%	0.677	S	S	*	*			cis	-129.5	158.5	10.1	41.3	-26.4	0	0	0	116.9
108	S	26.3	Very low	44.6	Very low	116 Å²	116	127.5 Å²	127.5	81%	0.811	69%	0.692	S	S	*	*			trans	-155.8	154	134.9	-166.3	0	0	0	0	109.6
109	L	34.9	Very low	43.2	Very low	152 Å²	152	128.4 Å²	128.4	80%	0.796	70%	0.701	S	S	*	*			trans	-100	153.2	-178.4	-56.3	93.8	0	0	0	111.4
110	T	27.2	Very low	42.5	Very low	143 Å²	143	130.1 Å²	130.1	88%	0.877	71%	0.711	S	S	*	*				179.6	156.2	121.9	24	0	0	0	0	111.9
111	S	29.5	Very low	41.8	Very low	111 Å²	111	132.7 Å²	132.7	78%	0.776	72%	0.72	S	S	*	*			trans	36.4	115.2	168.7	-127	0	0	0	0	119.3
112	S	29.1	Very low	41.8	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	72%	0.724	S	S	*	*				57	103.1	53.9	-167.1	0	0	0	0	114.4
113	V	35.8	Very low	42.4	Very low	124 Å²	124	135.8 Å²	135.8	75%	0.752	73%	0.729	S	S	*	*			trans	51.8	106	146.5	-173.4	0	0	0	0	117.7
114	N	30.7	Very low	43.3	Very low	162 Å²	162	134.5 Å²	134.5	87%	0.866	72%	0.719	S	S	*	*				-147.5	146.3	107.1	-115.7	-19	0	0	0	111.8
115	R	42.6	Very low	44.5	Very low	184 Å²	184	136.8 Å²	136.8	69%	0.694	72%	0.72	S	S	*	*			trans	-119	163.4	175	178.6	-174.3	-75	154.1	-4.4	107.3
116	F	38.4	Very low	46.2	Very low	157 Å²	157	137.7 Å²	137.7	69%	0.689	72%	0.715	S	S	*	*			trans	80	84.2	174.7	-50.6	-70.1	0	0	0	114.4	D118	F116-D118 WeakPolarHBondContact CA-OD2 3.5Å; F116-D118 PolarHBondContact N-OD2 2.65Å
117	N	42.4	Very low	48.5	Very low	154 Å²	154	134.5 Å²	134.5	82%	0.824	70%	0.698	S	S	*	*				-158.1	50	129	-85.6	-36.3	0	0	0	107.7
118	D	47.1	Very low	50.2	Low	92 Å²	92	136 Å²	136	49%	0.492	70%	0.695	S	S	.	*	H	α-helix	trans	-71.5	-36.9	-164.2	-61.5	-91	0	0	0	113.5	F116 D120 E121 E122	F116-D118 WeakPolarHBondContact CA-OD2 3.5Å; F116-D118 PolarHBondContact N-OD2 2.65Å; D118-D120 PolarHBondContact O-N 3.18Å; D118-E121 PolarHBondContact O-N 3.49Å; D118-E122 WeakPolarHBondContact O-CB 3.49Å; D118-E122 PolarHBondContact O-N 3.31Å
119	D	47.3	Very low	52.7	Low	141 Å²	141	134.3 Å²	134.3	75%	0.754	68%	0.68	S	S	*	*	H	α-helix	trans	-64.1	-44.4	-167.3	-58.9	-89.9	0	0	0	115.3	E123	D119-E123 PolarHBondContact O-N 3.1Å
120	D	55.7	Low	54.7	Low	135 Å²	135	131 Å²	131	72%	0.722	66%	0.66	S	S	*	*	H	α-helix	trans	-77.8	-21.1	-177.4	-88.2	-57.2	0	0	0	113.7	D118	D118-D120 PolarHBondContact O-N 3.18Å
121	E	56.9	Low	57.3	Low	142 Å²	142	126.1 Å²	126.1	66%	0.664	63%	0.634	S	S	*	*	H	α-helix	trans	-91.9	-37.2	176.3	-164.4	152.3	-125.9	0	0	110.8	D118 R124 E125	D118-E121 PolarHBondContact O-N 3.49Å; E121-R124 PolarHBondContact O-N 3.07Å; E121-E125 WeakPolarHBondContact O-CB 3.31Å; E121-E125 PolarHBondContact O-N 3.13Å
122	E	64.6	Low	59.6	Low	136 Å²	136	125.1 Å²	125.1	64%	0.636	62%	0.62	S	S	*	*	H	α-helix	trans	-63.1	-44.3	172	-173.8	175	-162.8	0	0	111.7	D118 R124 E125 R126	D118-E122 WeakPolarHBondContact O-CB 3.49Å; D118-E122 PolarHBondContact O-N 3.31Å; E122-R124 PolarHBondContact O-N 2.71Å; E122-E125 PolarHBondContact O-N 2.99Å; E122-R126 WeakPolarHBondContact O-CB 3.25Å; E122-R126 PolarHBondContact O-N 2.78Å
123	E	67.6	Low	61.9	Low	130 Å²	130	123.2 Å²	123.2	61%	0.607	61%	0.61	S	S	*	*	H	α-helix	trans	-64.9	-31.3	177	-175.8	162.1	-126.9	0	0	112	D119 L127	D119-E123 PolarHBondContact O-N 3.1Å; E123-L127 HydrophobicContact CG-CD1 4.34Å; E123-L127 WeakPolarHBondContact O-CB 3.49Å; E123-L127 PolarHBondContact O-N 2.88Å
124	R	69.6	Low	64	Low	164 Å²	164	122.6 Å²	122.6	62%	0.619	60%	0.597	S	S	*	*	H	α-helix	trans	-71.9	-48.1	176	-173.7	-178.9	-53.8	-78.2	-13.5	112.2	E121 E122 R126 L127 E128	E121-R124 PolarHBondContact O-N 3.07Å; E122-R124 PolarHBondContact O-N 2.71Å; R124-R126 VanDerWaalsContact C-N 3.33Å; R124-L127 WeakPolarHBondContact O-CB 3.29Å; R124-L127 PolarHBondContact O-N 3.49Å; R124-E128 PolarHBondContact O-N 2.9Å
125	E	74.7	Confident	66.2	Low	128 Å²	128	121.5 Å²	121.5	60%	0.598	59%	0.585	S	S	*	*	H	α-helix	trans	-60.9	-44.9	174.4	-177.8	173.1	-166.3	0	0	110	E121 E122 L127 E128 V129	E121-E125 WeakPolarHBondContact O-CB 3.31Å; E121-E125 PolarHBondContact O-N 3.13Å; E122-E125 PolarHBondContact O-N 2.99Å; E125-L127 VanDerWaalsContact C-N 3.28Å; E125-L127 PolarHBondContact O-N 3.19Å; E125-E128 PolarHBondContact O-N 3.43Å; E125-E128 VanDerWaalsContact O-N 3.12Å; E125-V129 HydrophobicContact CG-CG2 4.11Å; E125-V129 WeakPolarHBondContact O-CB 3.31Å; E125-V129 VanDerWaalsContact O-CG2 3.28Å; E125-V129 WeakPolarHBondContact O-CG2 3.33Å; E125-V129 PolarHBondContact O-N 3.12Å
126	R	78	Confident	67.5	Low	142 Å²	142	118.2 Å²	118.2	54%	0.536	58%	0.576	S	S	.	*	H	α-helix	trans	-56.4	-40.4	173.6	-172	-158.8	173.2	-64.8	-8.6	111.9	E122 R124 E130	E122-R126 WeakPolarHBondContact O-CB 3.25Å; E122-R126 PolarHBondContact O-N 2.78Å; R124-R126 VanDerWaalsContact C-N 3.33Å; R126-E130 IonicContact CZ-OE2 2.64Å; R126-E130 IonicContact NH1-OE2 3.4Å; R126-E130 PolarHBondContact NH1-OE2 2.95Å; R126-E130 IonicContact NH2-OE2 2.83Å; R126-E130 VanDerWaalsContact O-CB 3.23Å; R126-E130 WeakPolarHBondContact O-CB 3.5Å; R126-E130 PolarHBondContact O-N 2.82Å
127	L	78.4	Confident	69.1	Low	99 Å²	99	117 Å²	117	52%	0.518	57%	0.572	S	S	.	*	H	α-helix	trans	-69.9	-38.4	175.2	-95	162	0	0	0	113.1	E123 R124 E125 A131	E123-L127 HydrophobicContact CG-CD1 4.34Å; E123-L127 WeakPolarHBondContact O-CB 3.49Å; E123-L127 PolarHBondContact O-N 2.88Å; R124-L127 WeakPolarHBondContact O-CB 3.29Å; R124-L127 PolarHBondContact O-N 3.49Å; E125-L127 VanDerWaalsContact C-N 3.28Å; E125-L127 PolarHBondContact O-N 3.19Å; L127-A131 WeakPolarHBondContact O-CB 3.44Å; L127-A131 PolarHBondContact O-N 3.45Å
128	E	78.1	Confident	70.3	Confident	146 Å²	146	115.9 Å²	115.9	68%	0.682	57%	0.566	S	S	*	*	H	α-helix	trans	-70.3	-39.9	174.6	-68.7	-140	127.1	0	0	112.1	R124 E125 A131 L132	R124-E128 PolarHBondContact O-N 2.9Å; E125-E128 PolarHBondContact O-N 3.43Å; E125-E128 VanDerWaalsContact O-N 3.12Å; E128-A131 CarbonylContact O-C 3.58Å; E128-A131 PolarHBondContact O-N 3.35Å; E128-L132 WeakPolarHBondContact O-CB 3.32Å; E128-L132 PolarHBondContact O-N 3.13Å
129	V	78.9	Confident	71.3	Confident	82 Å²	82	118.6 Å²	118.6	50%	0.497	57%	0.574	S	S	.	*	H	α-helix	trans	-65.4	-42.3	173.1	171.2	0	0	0	0	110.8	E125 L132 A133	E125-V129 HydrophobicContact CG-CG2 4.11Å; E125-V129 WeakPolarHBondContact O-CB 3.31Å; E125-V129 VanDerWaalsContact O-CG2 3.28Å; E125-V129 WeakPolarHBondContact O-CG2 3.33Å; E125-V129 PolarHBondContact O-N 3.12Å; V129-L132 PolarHBondContact O-N 2.96Å; V129-A133 VanDerWaalsContact O-CB 3.25Å; V129-A133 WeakPolarHBondContact O-CB 3.41Å; V129-A133 PolarHBondContact O-N 3.1Å
130	E	75.4	Confident	71.8	Confident	81 Å²	81	119.5 Å²	119.5	38%	0.379	57%	0.568	S	S	.	*	H	α-helix	trans	-63.6	-43.6	173	-168.3	-176.7	135.2	0	0	110.7	R126 L132 K134	R126-E130 IonicContact CZ-OE2 2.64Å; R126-E130 IonicContact NH1-OE2 3.4Å; R126-E130 PolarHBondContact NH1-OE2 2.95Å; R126-E130 IonicContact NH2-OE2 2.83Å; R126-E130 VanDerWaalsContact O-CB 3.23Å; R126-E130 WeakPolarHBondContact O-CB 3.5Å; R126-E130 PolarHBondContact O-N 2.82Å; E130-L132 VanDerWaalsContact C-N 3.33Å; E130-L132 PolarHBondContact O-N 3.27Å; E130-K134 WeakPolarHBondContact O-CB 3.5Å; E130-K134 PolarHBondContact O-N 3.46Å; E130-K134 IonicContact OE1-NZ 2.67Å
131	A	81.6	Confident	71.7	Confident	41 Å²	41	115 Å²	115	34%	0.339	55%	0.553	S	S	.	*	H	α-helix	trans	-66.3	-32.3	176.1	0	0	0	0	0	113	L127 E128 K135	L127-A131 WeakPolarHBondContact O-CB 3.44Å; L127-A131 PolarHBondContact O-N 3.45Å; E128-A131 CarbonylContact O-C 3.58Å; E128-A131 PolarHBondContact O-N 3.35Å; A131-K135 WeakPolarHBondContact O-CB 3.12Å; A131-K135 WeakPolarHBondContact O-CD 3.19Å; A131-K135 WeakPolarHBondContact O-CG 3.42Å; A131-K135 PolarHBondContact O-N 3.07Å
132	L	78.4	Confident	71.2	Confident	91 Å²	91	114.7 Å²	114.7	48%	0.476	56%	0.556	S	S	.	*	H	α-helix	trans	-74.2	-48.4	176.6	-174.6	61.4	0	0	0	110.8	E128 V129 E130 K134 K135 F136	E128-L132 WeakPolarHBondContact O-CB 3.32Å; E128-L132 PolarHBondContact O-N 3.13Å; V129-L132 PolarHBondContact O-N 2.96Å; E130-L132 VanDerWaalsContact C-N 3.33Å; E130-L132 PolarHBondContact O-N 3.27Å; L132-K134 VanDerWaalsContact C-N 3.28Å; L132-K134 PolarHBondContact O-N 2.79Å; L132-K135 WeakPolarHBondContact O-CA 3.17Å; L132-K135 WeakPolarHBondContact O-CB 3.37Å; L132-K135 PolarHBondContact O-N 2.81Å; L132-F136 HydrophobicContact CD1-CD2 4.18Å; L132-F136 HydrophobicContact CD1-CE2 3.76Å; L132-F136 HydrophobicContact CG-CD2 4.11Å; L132-F136 HydrophobicContact CG-CE2 3.9Å; L132-F136 VanDerWaalsContact O-CD2 3.28Å; L132-F136 WeakPolarHBondContact O-CD2 3.42Å; L132-F136 PolarHBondContact O-N 2.95Å
133	A	77.4	Confident	70.3	Confident	57 Å²	57	114.5 Å²	114.5	47%	0.471	57%	0.565	S	S	.	*	H	α-helix	trans	-55.2	-45	172.1	0	0	0	0	0	111	V129 K135 F136 E137	V129-A133 VanDerWaalsContact O-CB 3.25Å; V129-A133 WeakPolarHBondContact O-CB 3.41Å; V129-A133 PolarHBondContact O-N 3.1Å; A133-K135 VanDerWaalsContact C-N 3.34Å; A133-K135 PolarHBondContact O-N 3.35Å; A133-F136 CarbonylContact O-C 3.55Å; A133-F136 PolarHBondContact O-N 2.87Å; A133-F136 VanDerWaalsContact O-N 3.11Å; A133-E137 WeakPolarHBondContact O-CB 3.19Å; A133-E137 PolarHBondContact O-N 3.33Å
134	K	79.9	Confident	69.2	Low	110 Å²	110	111.6 Å²	111.6	48%	0.478	57%	0.569	S	S	.	*	H	α-helix	trans	-67.3	-27.9	175.9	-163	176.5	-143.9	151.3	0	113.3	E130 L132 N138	E130-K134 WeakPolarHBondContact O-CB 3.5Å; E130-K134 PolarHBondContact O-N 3.46Å; E130-K134 IonicContact OE1-NZ 2.67Å; L132-K134 VanDerWaalsContact C-N 3.28Å; L132-K134 PolarHBondContact O-N 2.79Å; K134-N138 VanDerWaalsContact O-CB 3.24Å; K134-N138 WeakPolarHBondContact O-CB 3.42Å; K134-N138 PolarHBondContact O-N 3.09Å; K134-N138 PolarHBondContact O-ND2 3.42Å
135	K	76.2	Confident	68.3	Low	140 Å²	140	112.6 Å²	112.6	61%	0.609	58%	0.583	S	S	*	*	H	α-helix	trans	-71.3	-38.1	168.5	-77.8	162.2	-175.3	166.9	0	111.6	A131 L132 A133 K139	A131-K135 WeakPolarHBondContact O-CB 3.12Å; A131-K135 WeakPolarHBondContact O-CD 3.19Å; A131-K135 WeakPolarHBondContact O-CG 3.42Å; A131-K135 PolarHBondContact O-N 3.07Å; L132-K135 WeakPolarHBondContact O-CA 3.17Å; L132-K135 WeakPolarHBondContact O-CB 3.37Å; L132-K135 PolarHBondContact O-N 2.81Å; A133-K135 VanDerWaalsContact C-N 3.34Å; A133-K135 PolarHBondContact O-N 3.35Å; K135-K139 VanDerWaalsContact O-CB 3.25Å; K135-K139 WeakPolarHBondContact O-CB 3.5Å; K135-K139 PolarHBondContact O-N 3.37Å
136	F	71.4	Confident	66.9	Low	115 Å²	115	115.1 Å²	115.1	50%	0.504	59%	0.592	S	S	.	*	H	α-helix	trans	-69.7	-42.9	173.3	-80.2	-75.4	0	0	0	112	L132 A133 K139 Y140	L132-F136 HydrophobicContact CD1-CD2 4.18Å; L132-F136 HydrophobicContact CD1-CE2 3.76Å; L132-F136 HydrophobicContact CG-CD2 4.11Å; L132-F136 HydrophobicContact CG-CE2 3.9Å; L132-F136 VanDerWaalsContact O-CD2 3.28Å; L132-F136 WeakPolarHBondContact O-CD2 3.42Å; L132-F136 PolarHBondContact O-N 2.95Å; A133-F136 CarbonylContact O-C 3.55Å; A133-F136 PolarHBondContact O-N 2.87Å; A133-F136 VanDerWaalsContact O-N 3.11Å; F136-K139 PolarHBondContact O-N 3.13Å; F136-K139 VanDerWaalsContact O-N 3.11Å; F136-Y140 HydrophobicContact CD1-CD2 4.03Å; F136-Y140 AromaticContact CD1-CE2 3.88Å; F136-Y140 HydrophobicContact CD1-CE2 3.88Å; F136-Y140 HydrophobicContact CE1-CE2 4.3Å; F136-Y140 PolarHBondContact O-N 2.93Å
137	E	71.7	Confident	65.2	Low	132 Å²	132	117.8 Å²	117.8	62%	0.617	61%	0.607	S	S	*	*	H	α-helix	trans	-64.1	-39.8	175.6	-168.7	177.1	-147.5	0	0	111.7	A133 K139 G141	A133-E137 WeakPolarHBondContact O-CB 3.19Å; A133-E137 PolarHBondContact O-N 3.33Å; E137-K139 VanDerWaalsContact C-N 3.33Å; E137-K139 PolarHBondContact O-N 3.24Å; E137-G141 WeakPolarHBondContact O-CA 2.93Å; E137-G141 PolarHBondContact O-N 3.36Å
138	N	67.9	Low	64.1	Low	129 Å²	129	125.4 Å²	125.4	69%	0.69	63%	0.629	S	S	*	*	H	α-helix	trans	-69.8	-26.2	172.1	-76.9	-36.1	0	0	0	113.6	K134	K134-N138 VanDerWaalsContact O-CB 3.24Å; K134-N138 WeakPolarHBondContact O-CB 3.42Å; K134-N138 PolarHBondContact O-N 3.09Å; K134-N138 PolarHBondContact O-ND2 3.42Å
139	K	68.4	Low	62.7	Low	150 Å²	150	127.5 Å²	127.5	65%	0.652	64%	0.636	S	S	*	*	H	α-helix	trans	-84.8	-33.8	179.5	-175.9	176.6	-74.9	-174.9	0	113.2	K135 F136 E137	K135-K139 VanDerWaalsContact O-CB 3.25Å; K135-K139 WeakPolarHBondContact O-CB 3.5Å; K135-K139 PolarHBondContact O-N 3.37Å; F136-K139 PolarHBondContact O-N 3.13Å; F136-K139 VanDerWaalsContact O-N 3.11Å; E137-K139 VanDerWaalsContact C-N 3.33Å; E137-K139 PolarHBondContact O-N 3.24Å
140	Y	57.6	Low	60.9	Low	160 Å²	160	130 Å²	130	63%	0.627	65%	0.647	S	S	*	*	H	α-helix	trans	-126.8	-24.6	-172.8	-60.7	-75.1	0	0	0	114.5	F136 N142	F136-Y140 HydrophobicContact CD1-CD2 4.03Å; F136-Y140 AromaticContact CD1-CE2 3.88Å; F136-Y140 HydrophobicContact CD1-CE2 3.88Å; F136-Y140 HydrophobicContact CE1-CE2 4.3Å; F136-Y140 PolarHBondContact O-N 2.93Å; Y140-N142 VanDerWaalsContact C-N 3.34Å; Y140-N142 PolarHBondContact O-N 3.46Å
141	G	52.3	Low	59.8	Low	41 Å²	41	136.4 Å²	136.4	42%	0.423	67%	0.668	S	S	.	*			trans	-79.4	-2.5	-174.6	0	0	0	0	0	116	E137 T143	E137-G141 WeakPolarHBondContact O-CA 2.93Å; E137-G141 PolarHBondContact O-N 3.36Å; G141-T143 PolarHBondContact O-N 3.37Å
142	N	47.2	Very low	58.3	Low	135 Å²	135	141.5 Å²	141.5	72%	0.722	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	34.4	178.1	-166.1	39.5	0	0	0	113.9	Y140	Y140-N142 VanDerWaalsContact C-N 3.34Å; Y140-N142 PolarHBondContact O-N 3.46Å
143	T	44.9	Very low	57.1	Low	132 Å²	132	142.9 Å²	142.9	81%	0.81	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.2	65.6	169.2	43	0	0	0	0	111.4	G141	G141-T143 PolarHBondContact O-N 3.37Å
144	G	44.7	Very low	55.6	Low	68 Å²	68	146.3 Å²	146.3	70%	0.701	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	126.5	-9.7	147.2	0	0	0	0	0	119.8	K146	G144-K146 PolarHBondContact O-N 2.96Å
145	M	50.1	Low	54.3	Low	185 Å²	185	147.5 Å²	147.5	91%	0.911	71%	0.711	S	S	*	*			trans	-81.2	87.4	-175.9	-75.7	-65.1	171.4	0	0	114.2
146	K	45.9	Very low	53.2	Low	181 Å²	181	143.5 Å²	143.5	79%	0.787	70%	0.696	S	S	*	*			trans	-133	104.1	169.1	-77.7	-178.6	180	164.7	0	114.2	G144	G144-K146 PolarHBondContact O-N 2.96Å
147	K	42.9	Very low	52.3	Low	198 Å²	198	143.6 Å²	143.6	86%	0.861	70%	0.702	S	S	*	*			trans	69.1	72.8	157.9	-60.5	-170	175.1	-174.1	0	119.2	K149	K147-K149 PolarHBondContact O-N 3.13Å
148	R	54.5	Low	51.4	Low	260 Å²	260	143 Å²	143	98%	0.981	70%	0.702	S	S	*	*	S	Bend		40.4	45.1	127.6	-156	177.7	-178	146.6	1.2	118
149	K	48.3	Very low	50.8	Low	189 Å²	189	137.5 Å²	137.5	82%	0.822	68%	0.675	S	S	*	*	S	Bend	trans	-156.4	48.5	170.7	-168.9	106.7	-172.4	161.4	0	113.8	K147	K147-K149 PolarHBondContact O-N 3.13Å
150	D	41.4	Very low	49.9	Very low	135 Å²	135	139.6 Å²	139.6	72%	0.722	69%	0.685	S	S	*	*			trans	-161.4	9.8	157.3	-114	-18.8	0	0	0	116.3	M152 Q153	D150-M152 PolarHBondContact O-N 3.15Å; D150-Q153 PolarHBondContact O-N 2.83Å
151	R	52.1	Low	49.8	Very low	216 Å²	216	135.7 Å²	135.7	82%	0.815	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	40.1	-170.7	-155.8	-168.4	179.8	178.1	0.7	115
152	M	50.9	Low	50.2	Low	147 Å²	147	141.1 Å²	141.1	72%	0.724	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	-10.7	172	-65.4	-164.7	-59.2	0	0	113.5	D150	D150-M152 PolarHBondContact O-N 3.15Å
153	Q	52.7	Low	51.1	Low	120 Å²	120	139.7 Å²	139.7	56%	0.561	69%	0.694	S	S	*	*	S	Bend	trans	-86	-31.9	176.6	-152.3	66.9	54.6	0	0	112.2	D150 L155 I156	D150-Q153 PolarHBondContact O-N 2.83Å; Q153-L155 PolarHBondContact O-N 3.44Å; Q153-I156 WeakPolarHBondContact O-CG1 3.39Å
154	D	47.2	Very low	51.8	Low	129 Å²	129	142.3 Å²	142.3	69%	0.69	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	2.8	-178	-49.1	-24.7	0	0	0	114	I156	D154-I156 VanDerWaalsContact C-N 3.3Å
155	L	51.8	Low	52.4	Low	136 Å²	136	144.4 Å²	144.4	71%	0.712	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	20.6	175.6	-73.8	169.9	0	0	0	112.5	Q153	Q153-L155 PolarHBondContact O-N 3.44Å
156	I	54.3	Low	53.8	Low	56 Å²	56	138.5 Å²	138.5	29%	0.287	67%	0.669	S	S	.	*			trans	-102.7	-21.5	-178.1	-68.6	176.9	0	0	0	111.3	Q153 D154 I158 Y175	Q153-I156 WeakPolarHBondContact O-CG1 3.39Å; D154-I156 VanDerWaalsContact C-N 3.3Å; I156-I158 PolarHBondContact O-N 3.1Å; I156-I158 VanDerWaalsContact O-N 3.13Å; I156-Y175 HydrophobicContact CB-CE2 4.32Å; I156-Y175 HydrophobicContact CG2-CD2 4.03Å; I156-Y175 HydrophobicContact CG2-CE2 3.61Å; I156-Y175 WeakPolarHBondContact O-CE2 3.46Å
157	D	51.5	Low	54.8	Low	117 Å²	117	136.3 Å²	136.3	63%	0.626	67%	0.673	S	S	*	*			trans	-85.4	84.8	175.3	-70.5	-45.7	0	0	0	111.4	G159 F160	D157-G159 PolarHBondContact O-N 2.73Å; D157-G159 VanDerWaalsContact O-N 3.15Å; D157-F160 PolarHBondContact O-N 3.11Å
158	I	52.6	Low	55.7	Low	119 Å²	119	135.6 Å²	135.6	61%	0.61	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.3	-21.2	173.4	-62.7	174.7	0	0	0	111.7	I156 F160	I156-I158 PolarHBondContact O-N 3.1Å; I156-I158 VanDerWaalsContact O-N 3.13Å; I158-F160 VanDerWaalsContact C-N 3.33Å; I158-F160 PolarHBondContact O-N 2.94Å
159	G	56.4	Low	56.2	Low	13 Å²	13	125.7 Å²	125.7	13%	0.134	64%	0.636	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77.4	-1.8	176.5	0	0	0	0	0	116.2	D157 G161 Y162	D157-G159 PolarHBondContact O-N 2.73Å; D157-G159 VanDerWaalsContact O-N 3.15Å; G159-G161 PolarHBondContact O-N 2.98Å; G159-Y162 PolarHBondContact O-N 2.74Å
160	F	49.3	Very low	57	Low	194 Å²	194	121.9 Å²	121.9	85%	0.851	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	87.6	-172.5	-157.3	-83.6	0	0	0	113.1	D157 I158	D157-F160 PolarHBondContact O-N 3.11Å; I158-F160 VanDerWaalsContact C-N 3.33Å; I158-F160 PolarHBondContact O-N 2.94Å
161	G	55	Low	57.9	Low	78 Å²	78	119.2 Å²	119.2	80%	0.804	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	133.9	-9.3	-175.1	0	0	0	0	0	114.5	G159	G159-G161 PolarHBondContact O-N 2.98Å
162	Y	61.2	Low	58.4	Low	156 Å²	156	112.6 Å²	112.6	61%	0.612	60%	0.598	S	S	*	*	S	Bend	trans	-98.8	158.2	169.8	-67.7	-84.3	0	0	0	110.8	G159 E164 I169	G159-Y162 PolarHBondContact O-N 2.74Å; Y162-E164 PolarHBondContact O-N 2.7Å; Y162-I169 HydrophobicContact CD1-CD1 3.42Å; Y162-I169 VanDerWaalsContact CD1-CD1 3.42Å; Y162-I169 HydrophobicContact CD2-CD1 4.28Å; Y162-I169 HydrophobicContact CE1-CD1 4.01Å; Y162-I169 HydrophobicContact CG-CD1 3.58Å
163	D	65.9	Low	58.7	Low	104 Å²	104	112.5 Å²	112.5	56%	0.556	60%	0.595	S	S	*	*			trans	-69.9	121.8	174.8	-168.6	-33.5	0	0	0	109.4	T165 D166	D163-T165 VanDerWaalsContact CG-OG1 3.28Å; D163-T165 PolarHBondContact O-N 2.85Å; D163-T165 WeakPolarHBondContact OD1-CA 3.39Å; D163-T165 WeakPolarHBondContact OD1-CB 3.5Å; D163-T165 PolarHBondContact OD1-N 3.45Å; D163-T165 PolarHBondContact OD1-OG1 3.43Å; D163-T165 PolarHBondContact OD2-OG1 2.97Å; D163-D166 HydrophobicContact CB-CB 4.41Å; D163-D166 WeakPolarHBondContact O-CB 3.32Å; D163-D166 PolarHBondContact O-N 3.25Å
164	E	58.4	Low	58.9	Low	187 Å²	187	109.2 Å²	109.2	87%	0.874	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-11.7	177.4	-64.8	-177.3	-174.5	0	0	113	Y162	Y162-E164 PolarHBondContact O-N 2.7Å
165	T	57.5	Low	59.2	Low	112 Å²	112	108.8 Å²	108.8	69%	0.687	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-2.4	175.8	72.2	0	0	0	0	114.3	D163 P167	D163-T165 VanDerWaalsContact CG-OG1 3.28Å; D163-T165 PolarHBondContact O-N 2.85Å; D163-T165 WeakPolarHBondContact OD1-CA 3.39Å; D163-T165 WeakPolarHBondContact OD1-CB 3.5Å; D163-T165 PolarHBondContact OD1-N 3.45Å; D163-T165 PolarHBondContact OD1-OG1 3.43Å; D163-T165 PolarHBondContact OD2-OG1 2.97Å; T165-P167 WeakPolarHBondContact O-CD 3.27Å
166	D	78.9	Confident	59.5	Low	62 Å²	62	108.9 Å²	108.9	33%	0.332	58%	0.58	S	S	.	*			trans	-65.9	113.4	176.8	-177.2	-1.1	0	0	0	111.4	D163 F168 I169	D163-D166 HydrophobicContact CB-CB 4.41Å; D163-D166 WeakPolarHBondContact O-CB 3.32Å; D163-D166 PolarHBondContact O-N 3.25Å; D166-F168 PolarHBondContact O-N 2.81Å; D166-F168 WeakPolarHBondContact OD1-CB 3.37Å; D166-F168 PolarHBondContact OD1-N 2.99Å; D166-I169 PolarHBondContact O-N 3.35Å
167	P	68.3	Low	59.8	Low	135 Å²	135	111.7 Å²	111.7	88%	0.877	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-6.2	-180	-18.9	33.8	0	0	0	114.6	T165	T165-P167 WeakPolarHBondContact O-CD 3.27Å
168	F	62	Low	60.1	Low	182 Å²	182	112.4 Å²	112.4	80%	0.798	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-21.8	176.8	-169.7	-112.1	0	0	0	113.5	D166	D166-F168 PolarHBondContact O-N 2.81Å; D166-F168 WeakPolarHBondContact OD1-CB 3.37Å; D166-F168 PolarHBondContact OD1-N 2.99Å
169	I	64.1	Low	60.6	Low	52 Å²	52	109.4 Å²	109.4	27%	0.267	58%	0.582	S	S	.	*			trans	-120.5	88.9	-169.8	-53.8	-179.5	0	0	0	111.1	Y162 D166 N171	Y162-I169 HydrophobicContact CD1-CD1 3.42Å; Y162-I169 VanDerWaalsContact CD1-CD1 3.42Å; Y162-I169 HydrophobicContact CD2-CD1 4.28Å; Y162-I169 HydrophobicContact CE1-CD1 4.01Å; Y162-I169 HydrophobicContact CG-CD1 3.58Å; D166-I169 PolarHBondContact O-N 3.35Å; I169-N171 PolarHBondContact O-N 3.46Å
170	D	65.9	Low	61.4	Low	110 Å²	110	112.1 Å²	112.1	59%	0.588	60%	0.597	S	S	*	*			trans	-81.1	96.2	176.1	-172.4	-7.3	0	0	0	111.6	S172	D170-S172 PolarHBondContact O-N 2.9Å; D170-S172 WeakPolarHBondContact OD1-CA 3.38Å; D170-S172 WeakPolarHBondContact OD1-CB 3.27Å; D170-S172 PolarHBondContact OD1-N 3.42Å; D170-S172 PolarHBondContact OD1-OG 3.38Å; D170-S172 PolarHBondContact OD2-OG 3.44Å
171	N	59.5	Low	62.2	Low	79 Å²	79	106.8 Å²	106.8	42%	0.422	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-69.7	-3.4	175.8	-67.8	-42.4	0	0	0	114	I169 E173	I169-N171 PolarHBondContact O-N 3.46Å; N171-E173 VanDerWaalsContact C-N 3.33Å; N171-E173 PolarHBondContact O-N 2.94Å
172	S	63.1	Low	62.7	Low	77 Å²	77	107 Å²	107	54%	0.538	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-79.7	-1.9	-172.9	76.6	0	0	0	0	116.1	D170 K622	D170-S172 PolarHBondContact O-N 2.9Å; D170-S172 WeakPolarHBondContact OD1-CA 3.38Å; D170-S172 WeakPolarHBondContact OD1-CB 3.27Å; D170-S172 PolarHBondContact OD1-N 3.42Å; D170-S172 PolarHBondContact OD1-OG 3.38Å; D170-S172 PolarHBondContact OD2-OG 3.44Å; S172-K622 PolarHBondContact OG-NZ 3.17Å
173	E	57.2	Low	63.5	Low	144 Å²	144	102.6 Å²	102.6	67%	0.673	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-134.7	26.8	-175.8	-153.4	161.2	-120.8	0	0	112.8	N171 Y175	N171-E173 VanDerWaalsContact C-N 3.33Å; N171-E173 PolarHBondContact O-N 2.94Å; E173-Y175 PolarHBondContact O-N 3.5Å
174	A	55.8	Low	64.4	Low	52 Å²	52	99.2 Å²	99.2	43%	0.43	55%	0.548	S	S	.	.	S	Bend	trans	-68.4	-25.7	-171.6	0	0	0	0	0	116
175	Y	54.1	Low	65.7	Low	119 Å²	119	91.1 Å²	91.1	47%	0.467	51%	0.512	S	S	.	.			trans	-143.6	122.3	-179.5	-60.2	-90.6	0	0	0	111.3	I156 E173	I156-Y175 HydrophobicContact CB-CE2 4.32Å; I156-Y175 HydrophobicContact CG2-CD2 4.03Å; I156-Y175 HydrophobicContact CG2-CE2 3.61Å; I156-Y175 WeakPolarHBondContact O-CE2 3.46Å; E173-Y175 PolarHBondContact O-N 3.5Å
176	D	58.7	Low	66.8	Low	139 Å²	139	91.3 Å²	91.3	74%	0.743	50%	0.503	S	S	*	.	S	Bend	trans	-84.9	-40.8	-175.1	-153.5	19.5	0	0	0	112.2
177	E	60.9	Low	66.7	Low	115 Å²	115	95.6 Å²	95.6	54%	0.537	53%	0.525	S	S	.	.	S	Bend	trans	-128	114	174.6	-68.9	-166.6	-168.6	0	0	112.2	V179 L197	E177-V179 PolarHBondContact O-N 2.86Å; E177-V179 VanDerWaalsContact O-N 3.12Å; E177-L197 WeakPolarHBondContact OE2-CD2 3.19Å
178	L	57.8	Low	67.2	Low	131 Å²	131	90.2 Å²	90.2	69%	0.686	49%	0.494	S	S	*	.			trans	-80.5	91.4	178	-172.8	75.7	0	0	0	111.4	P180	L178-P180 VanDerWaalsContact O-CD 3.31Å; L178-P180 WeakPolarHBondContact O-CD 3.49Å
179	V	63	Low	68.1	Low	56 Å²	56	84.6 Å²	84.6	34%	0.339	49%	0.487	S	S	.	.			trans	-68.2	118.3	171.9	-173.4	0	0	0	0	109.9	E177 L183 F199	E177-V179 PolarHBondContact O-N 2.86Å; E177-V179 VanDerWaalsContact O-N 3.12Å; V179-L183 HydrophobicContact CG1-CB 4.22Å; V179-F199 HydrophobicContact CB-CE1 4.35Å; V179-F199 HydrophobicContact CG1-CD1 4.05Å; V179-F199 HydrophobicContact CG1-CE1 3.69Å; V179-F199 HydrophobicContact CG2-CE1 3.83Å; V179-F199 HydrophobicContact CG2-CZ 4.46Å
180	P	72.9	Confident	68.3	Low	70 Å²	70	90.7 Å²	90.7	46%	0.455	51%	0.512	S	S	.	.			trans	-68.3	136.1	179.6	-17.9	31.3	0	0	0	110.9	L178 S182 L183	L178-P180 VanDerWaalsContact O-CD 3.31Å; L178-P180 WeakPolarHBondContact O-CD 3.49Å; P180-S182 PolarHBondContact O-N 3.45Å; P180-L183 WeakPolarHBondContact O-CA 3.41Å; P180-L183 PolarHBondContact O-N 3.04Å; P180-L183 VanDerWaalsContact O-O 3.14Å
181	A	65	Low	68.8	Low	83 Å²	83	88.9 Å²	88.9	69%	0.686	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-6.5	-174.6	0	0	0	0	0	116.7	L183 A202	A181-L183 VanDerWaalsContact C-N 3.3Å; A181-A202 WeakPolarHBondContact O-CB 3.44Å
182	S	67.3	Low	69.6	Low	83 Å²	83	90.5 Å²	90.5	58%	0.58	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-5.7	167.5	57.7	0	0	0	0	114	P180 A201 A202	P180-S182 PolarHBondContact O-N 3.45Å; S182-A201 WeakPolarHBondContact O-CA 3.13Å; S182-A202 PolarHBondContact O-N 2.98Å
183	L	77.1	Confident	70.1	Confident	63 Å²	63	91.5 Å²	91.5	33%	0.33	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	150.2	179.9	-62.5	178.3	0	0	0	109.1	V179 P180 A181 F199 R200	V179-L183 HydrophobicContact CG1-CB 4.22Å; P180-L183 WeakPolarHBondContact O-CA 3.41Å; P180-L183 PolarHBondContact O-N 3.04Å; P180-L183 VanDerWaalsContact O-O 3.14Å; A181-L183 VanDerWaalsContact C-N 3.3Å; L183-F199 HydrophobicContact CB-CB 4.46Å; L183-F199 HydrophobicContact CB-CD1 4.33Å; L183-F199 HydrophobicContact CD1-CB 4.35Å; L183-F199 HydrophobicContact CD1-CG 4.34Å; L183-F199 HydrophobicContact CD2-CB 4.47Å; L183-R200 CarbonylContact C-O 3.57Å; L183-R200 VanDerWaalsContact CA-O 3.26Å; L183-R200 WeakPolarHBondContact CA-O 3.39Å
184	T	85.1	Confident	70.8	Confident	32 Å²	32	88 Å²	88	20%	0.196	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	169.4	168	-173.8	0	0	0	0	108.6	F199 R200 A202	T184-F199 CarbonylContact O-C 3.56Å; T184-F199 WeakPolarHBondContact O-CA 3.3Å; T184-R200 HydrophobicContact CG2-CG 3.55Å; T184-R200 PolarHBondContact N-O 3.01Å; T184-R200 PolarHBondContact O-N 3.14Å; T184-A202 HydrophobicContact CG2-CB 4.4Å
185	T	85.2	Confident	71.7	Confident	18 Å²	18	88.6 Å²	88.6	11%	0.11	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	156.1	175.3	81.7	0	0	0	0	109.5	L187 G188 G189 L197 Q198 R200	T185-L187 PolarHBondContact O-N 2.96Å; T185-G188 PolarHBondContact O-N 3.01Å; T185-G188 VanDerWaalsContact OG1-C 3.3Å; T185-G188 WeakPolarHBondContact OG1-CA 3.39Å; T185-G188 PolarHBondContact OG1-N 3.22Å; T185-G188 PolarHBondContact OG1-O 2.84Å; T185-G189 WeakPolarHBondContact CG2-O 3.27Å; T185-L197 HydrophobicContact CG2-CD1 4.18Å; T185-Q198 CarbonylContact C-O 3.57Å; T185-R200 WeakPolarHBondContact O-CG 3.31Å
186	K	81	Confident	72.7	Confident	115 Å²	115	88.8 Å²	88.8	50%	0.5	52%	0.518	S	S	.	.	S	Bend	trans	-54.3	-26.7	-178.8	173.7	176.3	171.2	-168.4	0	113.8	Q198 R200	K186-Q198 HydrophobicContact CB-CB 3.83Å; K186-Q198 WeakPolarHBondContact CB-O 3.13Å; K186-Q198 HydrophobicContact CD-CB 3.93Å; K186-Q198 PolarHBondContact N-O 3.47Å; K186-R200 PolarHBondContact O-NH1 3.21Å
187	L	76.4	Confident	73.5	Confident	152 Å²	152	83.7 Å²	83.7	80%	0.796	49%	0.491	S	S	*	.	S	Bend	trans	-100.9	-21.8	176.6	-60.2	-178	0	0	0	113.3	T185 R200	T185-L187 PolarHBondContact O-N 2.96Å; L187-R200 VanDerWaalsContact CA-NH1 3.28Å; L187-R200 PolarHBondContact O-NH1 3.13Å; L187-R200 PolarHBondContact O-NH2 2.92Å; L187-R200 VanDerWaalsContact O-NH2 3.15Å
188	G	79.9	Confident	74.4	Confident	22 Å²	22	83 Å²	83	23%	0.227	49%	0.488	C	S	.	.	S	Bend	trans	97.8	174	-169.4	0	0	0	0	0	111.1	T185	T185-G188 PolarHBondContact O-N 3.01Å; T185-G188 VanDerWaalsContact OG1-C 3.3Å; T185-G188 WeakPolarHBondContact OG1-CA 3.39Å; T185-G188 PolarHBondContact OG1-N 3.22Å; T185-G188 PolarHBondContact OG1-O 2.84Å
189	G	79.9	Confident	75.8	Confident	64 Å²	64	81.3 Å²	81.3	66%	0.66	48%	0.475	S	S	*	.	S	Bend	trans	67.9	-157.2	-178.2	0	0	0	0	0	114.1	T185	T185-G189 WeakPolarHBondContact CG2-O 3.27Å
190	F	68.4	Low	76.8	Confident	181 Å²	181	82.2 Å²	82.2	79%	0.794	47%	0.472	S	S	*	.			trans	-84.2	151	-175.5	51.8	-90.7	0	0	0	112.6	I192	F190-I192 HydrophobicContact CD2-CG1 4.14Å; F190-I192 HydrophobicContact CE2-CD1 4.21Å; F190-I192 HydrophobicContact CE2-CG1 4.24Å
191	Y	76.3	Confident	77.4	Confident	72 Å²	72	82.1 Å²	82.1	28%	0.282	48%	0.478	S	S	.	.			trans	-96.3	137.2	169.6	175.5	-121.2	0	0	0	109.8	N193 T194 G195 L197	Y191-N193 WeakPolarHBondContact CD1-OD1 3.42Å; Y191-N193 HydrophobicContact CE1-CB 4.46Å; Y191-N193 WeakPolarHBondContact CE1-OD1 3.47Å; Y191-T194 PolarHBondContact OH-N 2.9Å; Y191-G195 PolarHBondContact OH-O 2.89Å; Y191-L197 HydrophobicContact CD1-CB 4.45Å; Y191-L197 HydrophobicContact CD1-CD1 4.25Å; Y191-L197 HydrophobicContact CD1-CD2 3.78Å; Y191-L197 HydrophobicContact CD1-CG 4.39Å; Y191-L197 HydrophobicContact CD2-CB 4.48Å; Y191-L197 HydrophobicContact CD2-CD1 3.75Å; Y191-L197 HydrophobicContact CE1-CB 4.01Å; Y191-L197 HydrophobicContact CE1-CD2 4.01Å; Y191-L197 HydrophobicContact CE1-CG 4.43Å; Y191-L197 HydrophobicContact CE2-CB 4.06Å; Y191-L197 HydrophobicContact CE2-CD1 4.17Å; Y191-L197 HydrophobicContact CG-CD1 3.8Å; Y191-L197 HydrophobicContact CG-CD2 4.14Å; Y191-L197 HydrophobicContact CG-CG 4.41Å
192	I	75.9	Confident	77.7	Confident	113 Å²	113	80.2 Å²	80.2	58%	0.579	46%	0.462	S	S	*	.			trans	-105.2	134.6	165.5	-55.4	176.2	0	0	0	105.6	F190 T194	F190-I192 HydrophobicContact CD2-CG1 4.14Å; F190-I192 HydrophobicContact CE2-CD1 4.21Å; F190-I192 HydrophobicContact CE2-CG1 4.24Å; I192-T194 PolarHBondContact O-N 3.13Å; I192-T194 PolarHBondContact O-OG1 3.09Å
193	N	73.1	Confident	77.7	Confident	97 Å²	97	79.7 Å²	79.7	52%	0.519	46%	0.458	S	S	.	.	S	Bend	trans	-66.7	67.7	-169.9	-76	-1.3	0	0	0	114.2	Y191	Y191-N193 WeakPolarHBondContact CD1-OD1 3.42Å; Y191-N193 HydrophobicContact CE1-CB 4.46Å; Y191-N193 WeakPolarHBondContact CE1-OD1 3.47Å
194	T	72.8	Confident	76.5	Confident	70 Å²	70	85.4 Å²	85.4	43%	0.429	49%	0.489	S	S	.	.			trans	-143.5	124.4	-177.3	51.7	0	0	0	0	110.4	Y191 I192	Y191-T194 PolarHBondContact OH-N 2.9Å; I192-T194 PolarHBondContact O-N 3.13Å; I192-T194 PolarHBondContact O-OG1 3.09Å
195	G	74.3	Confident	74.7	Confident	66 Å²	66	89.1 Å²	89.1	68%	0.68	52%	0.516	S	S	*	.	S	Bend	trans	82.9	-162.7	-176.3	0	0	0	0	0	113.4	Y191	Y191-G195 PolarHBondContact OH-O 2.89Å
196	T	74.7	Confident	72.9	Confident	123 Å²	123	93.6 Å²	93.6	76%	0.755	54%	0.536	S	S	*	.			trans	-98.5	116	176.8	-49.6	0	0	0	0	109.6	Q198	T196-Q198 PolarHBondContact O-N 3.46Å; T196-Q198 VanDerWaalsContact O-N 3.14Å
197	L	77.1	Confident	71.2	Confident	31 Å²	31	91.5 Å²	91.5	16%	0.162	55%	0.547	C	S	.	.			trans	-60	115.6	177.2	179.5	49.9	0	0	0	111.2	E177 T185 Y191 F199	E177-L197 WeakPolarHBondContact OE2-CD2 3.19Å; T185-L197 HydrophobicContact CG2-CD1 4.18Å; Y191-L197 HydrophobicContact CD1-CB 4.45Å; Y191-L197 HydrophobicContact CD1-CD1 4.25Å; Y191-L197 HydrophobicContact CD1-CD2 3.78Å; Y191-L197 HydrophobicContact CD1-CG 4.39Å; Y191-L197 HydrophobicContact CD2-CB 4.48Å; Y191-L197 HydrophobicContact CD2-CD1 3.75Å; Y191-L197 HydrophobicContact CE1-CB 4.01Å; Y191-L197 HydrophobicContact CE1-CD2 4.01Å; Y191-L197 HydrophobicContact CE1-CG 4.43Å; Y191-L197 HydrophobicContact CE2-CB 4.06Å; Y191-L197 HydrophobicContact CE2-CD1 4.17Å; Y191-L197 HydrophobicContact CG-CD1 3.8Å; Y191-L197 HydrophobicContact CG-CD2 4.14Å; Y191-L197 HydrophobicContact CG-CG 4.41Å; L197-F199 HydrophobicContact CD1-CE1 4.19Å; L197-F199 HydrophobicContact CD1-CZ 4.44Å; L197-F199 HydrophobicContact CD2-CE1 3.63Å; L197-F199 HydrophobicContact CD2-CE2 4.22Å; L197-F199 HydrophobicContact CD2-CZ 3.35Å; L197-F199 HydrophobicContact CG-CD1 4.42Å; L197-F199 HydrophobicContact CG-CE1 3.75Å; L197-F199 HydrophobicContact CG-CE2 3.99Å; L197-F199 HydrophobicContact CG-CZ 3.52Å
198	Q	80.3	Confident	69.4	Low	101 Å²	101	93.9 Å²	93.9	47%	0.472	55%	0.554	S	S	.	*			trans	-103.3	132.2	176.1	-69.6	171.1	33.2	0	0	109.2	T185 K186 T196	T185-Q198 CarbonylContact C-O 3.57Å; K186-Q198 HydrophobicContact CB-CB 3.83Å; K186-Q198 WeakPolarHBondContact CB-O 3.13Å; K186-Q198 HydrophobicContact CD-CB 3.93Å; K186-Q198 PolarHBondContact N-O 3.47Å; T196-Q198 PolarHBondContact O-N 3.46Å; T196-Q198 VanDerWaalsContact O-N 3.14Å
199	F	85.8	Confident	67.4	Low	95 Å²	95	101.2 Å²	101.2	42%	0.417	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106	142.6	-179.5	-61.2	-74.3	0	0	0	112.2	V179 L183 T184 L197	V179-F199 HydrophobicContact CB-CE1 4.35Å; V179-F199 HydrophobicContact CG1-CD1 4.05Å; V179-F199 HydrophobicContact CG1-CE1 3.69Å; V179-F199 HydrophobicContact CG2-CE1 3.83Å; V179-F199 HydrophobicContact CG2-CZ 4.46Å; L183-F199 HydrophobicContact CB-CB 4.46Å; L183-F199 HydrophobicContact CB-CD1 4.33Å; L183-F199 HydrophobicContact CD1-CB 4.35Å; L183-F199 HydrophobicContact CD1-CG 4.34Å; L183-F199 HydrophobicContact CD2-CB 4.47Å; T184-F199 CarbonylContact O-C 3.56Å; T184-F199 WeakPolarHBondContact O-CA 3.3Å; L197-F199 HydrophobicContact CD1-CE1 4.19Å; L197-F199 HydrophobicContact CD1-CZ 4.44Å; L197-F199 HydrophobicContact CD2-CE1 3.63Å; L197-F199 HydrophobicContact CD2-CE2 4.22Å; L197-F199 HydrophobicContact CD2-CZ 3.35Å; L197-F199 HydrophobicContact CG-CD1 4.42Å; L197-F199 HydrophobicContact CG-CE1 3.75Å; L197-F199 HydrophobicContact CG-CE2 3.99Å; L197-F199 HydrophobicContact CG-CZ 3.52Å
200	R	84	Confident	65.3	Low	75 Å²	75	106 Å²	106	28%	0.283	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.3	161.6	159.7	71.8	-179	-176.2	-131.4	0.1	109.7	L183 T184 T185 K186 L187 E206	L183-R200 CarbonylContact C-O 3.57Å; L183-R200 VanDerWaalsContact CA-O 3.26Å; L183-R200 WeakPolarHBondContact CA-O 3.39Å; T184-R200 HydrophobicContact CG2-CG 3.55Å; T184-R200 PolarHBondContact N-O 3.01Å; T184-R200 PolarHBondContact O-N 3.14Å; T185-R200 WeakPolarHBondContact O-CG 3.31Å; K186-R200 PolarHBondContact O-NH1 3.21Å; L187-R200 VanDerWaalsContact CA-NH1 3.28Å; L187-R200 PolarHBondContact O-NH1 3.13Å; L187-R200 PolarHBondContact O-NH2 2.92Å; L187-R200 VanDerWaalsContact O-NH2 3.15Å; R200-E206 IonicContact CZ-OE2 3.44Å; R200-E206 IonicContact NE-OE1 2.81Å; R200-E206 IonicContact NE-OE2 3.95Å; R200-E206 PolarHBondContact NE-OE2 2.91Å; R200-E206 IonicContact NH2-OE1 2.71Å; R200-E206 IonicContact NH2-OE2 3.74Å; R200-E206 PolarHBondContact NH2-OE2 2.61Å
201	A	85.1	Confident	63.6	Low	69 Å²	69	107 Å²	107	57%	0.57	60%	0.597	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-65.5	136.4	168.4	0	0	0	0	0	109.5	S182 S203	S182-A201 WeakPolarHBondContact O-CA 3.13Å; A201-S203 PolarHBondContact O-N 3.36Å
202	A	72.3	Confident	61.5	Low	43 Å²	43	109.7 Å²	109.7	36%	0.355	62%	0.62	S	S	.	*			trans	-71.8	113.2	174.3	0	0	0	0	0	109.4	A181 S182 T184	A181-A202 WeakPolarHBondContact O-CB 3.44Å; S182-A202 PolarHBondContact O-N 2.98Å; T184-A202 HydrophobicContact CG2-CB 4.4Å
203	S	66.1	Low	59.3	Low	72 Å²	72	115.8 Å²	115.8	50%	0.503	64%	0.636	S	S	.	*			trans	-82.2	135.5	172.1	-67.5	0	0	0	0	109.8	A201 S205	A201-S203 PolarHBondContact O-N 3.36Å; S203-S205 PolarHBondContact O-N 2.74Å
204	D	53.4	Low	57	Low	183 Å²	183	119.2 Å²	119.2	98%	0.979	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	37.9	-178.1	-156	27.9	0	0	0	112.3
205	S	46.7	Very low	55.1	Low	110 Å²	110	121.8 Å²	121.8	77%	0.769	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.8	5.9	-162.9	-169.4	0	0	0	0	115.3	S203	S203-S205 PolarHBondContact O-N 2.74Å
206	E	48.6	Very low	53	Low	111 Å²	111	127.1 Å²	127.1	52%	0.519	67%	0.669	S	S	.	*			trans	-111.5	88.1	-179.6	-67.8	172.2	179	0	0	108.7	R200	R200-E206 IonicContact CZ-OE2 3.44Å; R200-E206 IonicContact NE-OE1 2.81Å; R200-E206 IonicContact NE-OE2 3.95Å; R200-E206 PolarHBondContact NE-OE2 2.91Å; R200-E206 IonicContact NH2-OE1 2.71Å; R200-E206 IonicContact NH2-OE2 3.74Å; R200-E206 PolarHBondContact NH2-OE2 2.61Å
207	G	43.6	Very low	50.9	Low	71 Å²	71	129.1 Å²	129.1	73%	0.732	67%	0.669	S	S	*	*			trans	-176.9	7.6	-170.6	0	0	0	0	0	120
208	E	39.5	Very low	48.6	Very low	203 Å²	203	135.8 Å²	135.8	95%	0.949	70%	0.697	S	S	*	*			trans	-142.4	58.4	171.4	-80.8	-152.9	136.1	0	0	112.4
209	E	38	Very low	46.3	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	71%	0.708	S	S	*	*			trans	-148.2	66.8	170.5	53.5	179.7	-170	0	0	113.9
210	D	35.1	Very low	43.7	Very low	163 Å²	163	143.6 Å²	143.6	87%	0.872	73%	0.732	S	S	*	*				-171	91.3	128.3	-116.3	-25.6	0	0	0	113.5
211	K	32.3	Very low	41	Very low	202 Å²	202	143.8 Å²	143.8	88%	0.878	76%	0.757	S	S	*	*			trans	-144.1	145.1	150.2	-73.7	-161.5	177.2	-177.1	0	109.8
212	V	32.2	Very low	38.6	Very low	129 Å²	129	146.9 Å²	146.9	78%	0.782	77%	0.769	S	S	*	*			trans	85.8	94.6	177.1	-169.4	0	0	0	0	116.6
213	R	29.8	Very low	36.8	Very low	242 Å²	242	154.2 Å²	154.2	91%	0.913	79%	0.793	S	S	*	*			trans	-133.9	157.6	133.2	-69.2	-165	178	-162.7	0.8	108.7
214	Q	26.2	Very low	35.2	Very low	168 Å²	168	157.8 Å²	157.8	79%	0.785	81%	0.805	S	S	*	*			trans	67.2	123.4	-156.5	-43.4	-67.9	21.5	0	0	111.1
215	V	32.8	Very low	34.3	Very low	125 Å²	125	154.4 Å²	154.4	76%	0.758	80%	0.796	S	S	*	*			cis	-136.4	129.7	8.2	175.7	0	0	0	0	112.3
216	K	29.9	Very low	33.8	Very low	178 Å²	178	157.7 Å²	157.7	77%	0.774	80%	0.797	S	S	*	*			trans	21.5	149.7	153.5	-64.6	175.9	178.8	171.5	0	124
217	H	30.6	Very low	33.4	Very low	165 Å²	165	157.9 Å²	157.9	76%	0.764	80%	0.801	S	S	*	*			trans	81.3	142.6	154.9	-79	-165.2	0	0	0	118.9
218	K	29.3	Very low	33.2	Very low	170 Å²	170	161.2 Å²	161.2	74%	0.739	80%	0.801	S	S	*	*			cis	-165.6	161.9	-19.4	-156	-176.6	176.9	179.2	0	110.6
219	V	31.7	Very low	33.1	Very low	118 Å²	118	154.4 Å²	154.4	72%	0.715	79%	0.785	S	S	*	*			trans	73.4	90	161.6	-161.9	0	0	0	0	120.4
220	R	31.4	Very low	33.1	Very low	242 Å²	242	153.1 Å²	153.1	91%	0.913	78%	0.779	S	S	*	*				32.2	110	115.6	-165.2	-179.2	-164.4	165.8	3.6	119.3
221	G	27	Very low	33.2	Very low	79 Å²	79	152.3 Å²	152.3	81%	0.814	77%	0.773	S	S	*	*			trans	-151.9	82.4	169.5	0	0	0	0	0	115.1
222	V	34.7	Very low	33.5	Very low	134 Å²	134	152.2 Å²	152.2	81%	0.812	77%	0.773	S	S	*	*			trans	-108.6	93.3	-177	-178.7	0	0	0	0	111.6
223	K	34.4	Very low	33.4	Very low	198 Å²	198	154.9 Å²	154.9	86%	0.861	77%	0.774	S	S	*	*			trans	-164.6	52.9	163.2	-132.3	173.1	-174.7	179.4	0	117.9
224	L	32.4	Very low	33.5	Very low	146 Å²	146	150.7 Å²	150.7	76%	0.764	77%	0.769	S	S	*	*			trans	-137.9	19.5	168.8	-145.4	70.3	0	0	0	116.1	F226	L224-F226 VanDerWaalsContact C-N 3.31Å; L224-F226 PolarHBondContact O-N 3.18Å
225	S	34.4	Very low	33.7	Very low	113 Å²	113	150.7 Å²	150.7	79%	0.79	77%	0.774	S	S	*	*	S	Bend	trans	-80.7	0.2	179.6	48.7	0	0	0	0	115.5
226	F	35.2	Very low	33.5	Very low	179 Å²	179	149.2 Å²	149.2	79%	0.785	77%	0.765	S	S	*	*	S	Bend	trans	-109.2	-16.3	-165	-144.8	-98.9	0	0	0	116	L224	L224-F226 VanDerWaalsContact C-N 3.31Å; L224-F226 PolarHBondContact O-N 3.18Å
227	I	41.3	Very low	33.5	Very low	115 Å²	115	147.2 Å²	147.2	59%	0.59	76%	0.762	S	S	*	*	S	Bend	trans	-98.4	-48.1	-169.6	-62.8	179.9	0	0	0	112.7	G229 Q230	I227-G229 PolarHBondContact O-N 3.09Å; I227-Q230 PolarHBondContact O-N 3.2Å; I227-Q230 VanDerWaalsContact O-N 3.13Å
228	L	39.4	Very low	33.3	Very low	141 Å²	141	149.8 Å²	149.8	74%	0.738	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-5.4	179.5	-92.2	70.4	0	0	0	114.2	Q230	L228-Q230 PolarHBondContact O-N 3.25Å
229	G	36.9	Very low	33.1	Very low	60 Å²	60	144.8 Å²	144.8	62%	0.619	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-21.1	168.8	0	0	0	0	0	114.1	I227	I227-G229 PolarHBondContact O-N 3.09Å
230	Q	38.7	Very low	33.1	Very low	149 Å²	149	145.2 Å²	145.2	70%	0.696	77%	0.765	S	S	*	*	S	Bend	trans	-87.3	-21.2	-172.1	-67.4	-69.8	8.7	0	0	114.9	I227 L228 K232	I227-Q230 PolarHBondContact O-N 3.2Å; I227-Q230 VanDerWaalsContact O-N 3.13Å; L228-Q230 PolarHBondContact O-N 3.25Å; Q230-K232 VanDerWaalsContact C-N 3.28Å; Q230-K232 PolarHBondContact O-N 3.23Å
231	I	37.4	Very low	32.9	Very low	145 Å²	145	142.2 Å²	142.2	74%	0.744	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	5.3	-172.7	-49.7	-179.6	0	0	0	112.3
232	K	37.7	Very low	32.9	Very low	201 Å²	201	143.5 Å²	143.5	87%	0.874	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	11.2	176.1	-84.3	-175.7	174.5	176	0	114.9	Q230	Q230-K232 VanDerWaalsContact C-N 3.28Å; Q230-K232 PolarHBondContact O-N 3.23Å
233	K	31.3	Very low	32.5	Very low	185 Å²	185	141.9 Å²	141.9	80%	0.804	75%	0.746	S	S	*	*	S	Bend	trans	-153.6	51.4	-176.8	-154.1	-169.6	178.2	-174.8	0	116.2
234	L	30.8	Very low	32.2	Very low	154 Å²	154	140.6 Å²	140.6	81%	0.806	74%	0.743	S	S	*	*			trans	-174	85.7	148.3	-105.3	158.5	0	0	0	111.4	V236	L234-V236 HydrophobicContact CD2-CB 3.89Å; L234-V236 HydrophobicContact CD2-CG1 4.44Å; L234-V236 HydrophobicContact CD2-CG2 3.72Å
235	D	31.5	Very low	31.8	Very low	168 Å²	168	138.7 Å²	138.7	90%	0.898	74%	0.74	S	S	*	*			trans	-129.8	120.5	144.3	-161.8	-4.2	0	0	0	106.5
236	V	27.7	Very low	31.3	Very low	94 Å²	94	139.1 Å²	139.1	57%	0.57	74%	0.738	S	S	*	*			trans	-152.1	152.4	-151.4	157.6	0	0	0	0	110.9	L234	L234-V236 HydrophobicContact CD2-CB 3.89Å; L234-V236 HydrophobicContact CD2-CG1 4.44Å; L234-V236 HydrophobicContact CD2-CG2 3.72Å
237	L	29	Very low	30.8	Very low	135 Å²	135	136.1 Å²	136.1	71%	0.707	74%	0.735	S	S	*	*			trans	70.7	80.4	168.9	-88.3	163.2	0	0	0	117.6	L240	L237-L240 HydrophobicContact CD2-CD1 3.92Å
238	K	27.1	Very low	30	Very low	220 Å²	220	137.6 Å²	137.6	96%	0.957	74%	0.744	S	S	*	*	S	Bend	trans	-170.7	108.6	133.5	-101.5	162.2	-175	176.4	0	109
239	G	24.9	Very low	29.3	Very low	64 Å²	64	140.1 Å²	140.1	66%	0.66	75%	0.749	S	S	*	*			cis	-171.6	138.5	-10.9	0	0	0	0	0	111.3
240	L	32.3	Very low	28.7	Very low	127 Å²	127	143 Å²	143	67%	0.665	75%	0.754	S	S	*	*			trans	16.8	146.6	151.7	-73.2	62.7	0	0	0	120	L237	L237-L240 HydrophobicContact CD2-CD1 3.92Å
241	F	26.8	Very low	28.1	Very low	180 Å²	180	141.3 Å²	141.3	79%	0.789	75%	0.754	S	S	*	*			cis	-164.9	172	22	-118.2	-177.5	0	0	0	108.1
242	V	26.8	Very low	27.6	Very low	105 Å²	105	142.7 Å²	142.7	64%	0.636	76%	0.755	S	S	*	*			cis	-172.7	-171.1	-18.2	65.6	0	0	0	0	108.6
243	S	25.5	Very low	27	Very low	101 Å²	101	141.2 Å²	141.2	71%	0.706	75%	0.751	S	S	*	*			trans	75.3	82.2	167.9	-135.3	0	0	0	0	115.7
244	E	30	Very low	26.8	Very low	171 Å²	171	135.8 Å²	135.8	80%	0.799	75%	0.747	S	S	*	*				78	131.5	66.6	-67.2	-151.2	88.4	0	0	115.1
245	C	22.4	Very low	26.5	Very low	105 Å²	105	135.7 Å²	135.7	71%	0.709	75%	0.753	S	S	*	*			cis	-141.9	-122	-11.3	-156.5	0	0	0	0	112
246	T	24.3	Very low	26.4	Very low	123 Å²	123	134 Å²	134	76%	0.755	75%	0.749	S	S	*	*			cis	-155.8	-156.4	5	-27.8	0	0	0	0	111.3
247	V	25.1	Very low	26.7	Very low	116 Å²	116	133.9 Å²	133.9	70%	0.703	76%	0.757	S	S	*	*			trans	-97.3	133.2	-157.7	-74.7	0	0	0	0	120.4
248	N	24.3	Very low	26.6	Very low	146 Å²	146	134.8 Å²	134.8	78%	0.781	76%	0.762	S	S	*	*				49.6	148.5	119.2	-54.5	-26.2	0	0	0	127.4
249	K	25.7	Very low	26.6	Very low	194 Å²	194	130.8 Å²	130.8	84%	0.843	75%	0.751	S	S	*	*			trans	97.1	110.7	139.7	-89.2	-167.7	174.5	179.8	0	123.6
250	V	24.2	Very low	26.8	Very low	119 Å²	119	135 Å²	135	72%	0.721	76%	0.758	S	S	*	*				93.3	146.1	117.9	164.1	0	0	0	0	123.7
251	T	24.3	Very low	26.6	Very low	115 Å²	115	136.7 Å²	136.7	71%	0.706	76%	0.762	S	S	*	*			trans	83.5	114	160.9	29.2	0	0	0	0	124.7
252	K	28.4	Very low	26.8	Very low	174 Å²	174	137.1 Å²	137.1	76%	0.757	76%	0.758	S	S	*	*				64.4	136.9	123.8	-78	177.8	174	-169.7	0	124.7
253	Q	24.9	Very low	27.4	Very low	170 Å²	170	138.2 Å²	138.2	79%	0.794	77%	0.767	S	S	*	*			trans	49	108.8	137.8	-65.2	172.8	-81.6	0	0	121.7
254	G	26.5	Very low	28.1	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	77%	0.768	S	S	*	*				95.3	166.2	104.9	0	0	0	0	0	121
255	V	25.9	Very low	28.7	Very low	151 Å²	151	141.4 Å²	141.4	92%	0.915	77%	0.768	S	S	*	*			trans	73.3	166.3	164.1	-169.5	0	0	0	0	116.2
256	T	28.5	Very low	29.8	Very low	134 Å²	134	145.9 Å²	145.9	82%	0.822	78%	0.776	S	S	*	*			trans	-96.7	155.6	-150.6	45.6	0	0	0	0	116.5
257	A	34.7	Very low	30.7	Very low	90 Å²	90	148.9 Å²	148.9	74%	0.744	78%	0.778	S	S	*	*			trans	-42	150.5	175.8	0	0	0	0	0	118.8
258	L	26.5	Very low	31.8	Very low	155 Å²	155	151 Å²	151	81%	0.812	77%	0.774	S	S	*	*				-147.4	145	125.9	-78.8	-169.7	0	0	0	110.3
259	N	27.6	Very low	33	Very low	136 Å²	136	152.5 Å²	152.5	73%	0.727	77%	0.773	S	S	*	*			trans	33.4	138.2	150.9	-63.1	-54.2	0	0	0	120.8
260	L	28.6	Very low	34.1	Very low	153 Å²	153	150.9 Å²	150.9	80%	0.801	77%	0.766	S	S	*	*			cis	-162.9	163.4	21.9	-156.8	71.6	0	0	0	111.4
261	H	28.6	Very low	35.2	Very low	162 Å²	162	151.3 Å²	151.3	75%	0.75	76%	0.764	S	S	*	*			trans	75.6	133.3	154.4	-170	63.8	0	0	0	121.5
262	R	31.1	Very low	36.4	Very low	189 Å²	189	150.9 Å²	150.9	71%	0.713	76%	0.755	S	S	*	*			trans	95.5	104.9	150.1	-158	-178.4	-155.2	147.2	12.4	121.8
263	P	38.6	Very low	38	Very low	127 Å²	127	150.2 Å²	150.2	83%	0.825	75%	0.752	S	S	*	*			trans	-129.5	94.1	167.2	36.9	-20.2	0	0	0	115.2
264	E	39.6	Very low	39.6	Very low	154 Å²	154	146 Å²	146	72%	0.72	74%	0.735	S	S	*	*			trans	-163.6	56.5	169.2	-134.3	-72.5	84.2	0	0	114.7
265	K	43.3	Very low	41.6	Very low	186 Å²	186	145.9 Å²	145.9	81%	0.809	72%	0.723	S	S	*	*			trans	-145.4	50.9	178.2	-73.3	-165.7	179	178.1	0	115.9
266	K	46.3	Very low	44.1	Very low	199 Å²	199	144.3 Å²	144.3	87%	0.865	71%	0.709	S	S	*	*	S	Bend	trans	-138	-28.2	165.2	-109	173	-177.5	176.7	0	116.1	R268	K266-R268 VanDerWaalsContact C-N 3.31Å; K266-R268 PolarHBondContact O-N 3.09Å
267	K	43	Very low	46.3	Very low	186 Å²	186	145.9 Å²	145.9	81%	0.809	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-25.5	-178.4	-148.1	170.2	-173.9	176.5	0	114	K269	K267-K269 PolarHBondContact O-N 3.32Å
268	R	47.2	Very low	48.4	Very low	159 Å²	159	146.2 Å²	146.2	60%	0.6	69%	0.69	S	S	*	*	H	α-helix	trans	-68.7	-19.9	-175.6	-163.8	170.6	179.6	-175.7	-2	115.2	K266 M272 D1054	K266-R268 VanDerWaalsContact C-N 3.31Å; K266-R268 PolarHBondContact O-N 3.09Å; R268-M272 VanDerWaalsContact O-CB 3.24Å; R268-M272 WeakPolarHBondContact O-CB 3.29Å; R268-M272 PolarHBondContact O-N 2.95Å; R268-D1054 IonicContact CZ-OD2 3.71Å; R268-D1054 IonicContact NE-OD2 3.99Å; R268-D1054 IonicContact NH2-OD2 2.66Å; R268-D1054 PolarHBondContact NH2-OD2 3.35Å
269	K	50.8	Low	50.6	Low	179 Å²	179	140.2 Å²	140.2	78%	0.778	66%	0.663	S	S	*	*	H	α-helix	trans	-77.5	-29.5	-174.4	-152	176.8	-175.3	-176.6	0	113.8	K267 K273	K267-K269 PolarHBondContact O-N 3.32Å; K269-K273 PolarHBondContact O-N 2.74Å
270	K	47.7	Very low	53.1	Low	160 Å²	160	136.3 Å²	136.3	70%	0.696	65%	0.649	S	S	*	*	H	α-helix	trans	-70.1	-54.4	171.9	-172.2	177.6	178.3	-179.4	0	110.2	M272 K273 D274	K270-M272 PolarHBondContact O-N 2.7Å; K270-M272 VanDerWaalsContact O-N 3.14Å; K270-K273 WeakPolarHBondContact O-CA 3.11Å; K270-K273 WeakPolarHBondContact O-CB 3.4Å; K270-K273 PolarHBondContact O-N 3.41Å; K270-D274 VanDerWaalsContact O-CG 3.29Å; K270-D274 PolarHBondContact O-N 3.4Å
271	L	48.3	Very low	55.6	Low	127 Å²	127	133.5 Å²	133.5	67%	0.665	63%	0.633	S	S	*	*	H	α-helix	trans	-58.3	-31.6	179.7	-148.9	150	0	0	0	113	S275	L271-S275 WeakPolarHBondContact O-CB 3.42Å; L271-S275 PolarHBondContact O-N 2.98Å
272	M	47.6	Very low	58.2	Low	106 Å²	106	130.7 Å²	130.7	52%	0.522	62%	0.623	S	S	.	*	H	α-helix	trans	-73.1	-29.9	172.1	-176.2	178.1	165.4	0	0	113.8	R268 K270 L276	R268-M272 VanDerWaalsContact O-CB 3.24Å; R268-M272 WeakPolarHBondContact O-CB 3.29Å; R268-M272 PolarHBondContact O-N 2.95Å; K270-M272 PolarHBondContact O-N 2.7Å; K270-M272 VanDerWaalsContact O-N 3.14Å; M272-L276 WeakPolarHBondContact O-CB 3.25Å; M272-L276 PolarHBondContact O-N 3.05Å
273	K	63.5	Low	60.6	Low	160 Å²	160	130 Å²	130	70%	0.696	62%	0.62	S	S	*	*	H	α-helix	trans	-73.3	-44	173.1	-171.6	-176.8	178.6	-172.1	0	110.7	K269 K270 S275 L276 Y277	K269-K273 PolarHBondContact O-N 2.74Å; K270-K273 WeakPolarHBondContact O-CA 3.11Å; K270-K273 WeakPolarHBondContact O-CB 3.4Å; K270-K273 PolarHBondContact O-N 3.41Å; K273-S275 VanDerWaalsContact C-N 3.32Å; K273-S275 PolarHBondContact O-N 3.3Å; K273-L276 PolarHBondContact O-N 3.37Å; K273-L276 VanDerWaalsContact O-N 3.12Å; K273-Y277 PolarHBondContact O-N 3.02Å
274	D	57	Low	62.4	Low	82 Å²	82	133 Å²	133	44%	0.439	62%	0.615	S	S	.	*	H	α-helix	trans	-65.4	-39.1	178.3	-51.9	-24.5	0	0	0	110.3	K270 Y277 L278	K270-D274 VanDerWaalsContact O-CG 3.29Å; K270-D274 PolarHBondContact O-N 3.4Å; D274-Y277 PolarHBondContact O-N 2.99Å; D274-L278 WeakPolarHBondContact O-CB 3.39Å; D274-L278 PolarHBondContact O-N 3.35Å
275	S	69.9	Low	64.1	Low	68 Å²	68	132.6 Å²	132.6	48%	0.476	61%	0.611	S	S	.	*	H	α-helix	trans	-61.5	-41.2	169.1	173.9	0	0	0	0	113	L271 K273 Y277 L278 A279	L271-S275 WeakPolarHBondContact O-CB 3.42Å; L271-S275 PolarHBondContact O-N 2.98Å; K273-S275 VanDerWaalsContact C-N 3.32Å; K273-S275 PolarHBondContact O-N 3.3Å; S275-Y277 VanDerWaalsContact C-N 3.34Å; S275-Y277 PolarHBondContact O-N 3.06Å; S275-L278 PolarHBondContact O-N 3.03Å; S275-A279 WeakPolarHBondContact O-CB 3.4Å; S275-A279 PolarHBondContact O-N 2.96Å
276	L	77.8	Confident	65.7	Low	118 Å²	118	127.8 Å²	127.8	62%	0.618	60%	0.598	S	S	*	*	H	α-helix	trans	-67.2	-35.8	177.2	-146.5	78.4	0	0	0	112.1	M272 K273 A280	M272-L276 WeakPolarHBondContact O-CB 3.25Å; M272-L276 PolarHBondContact O-N 3.05Å; K273-L276 PolarHBondContact O-N 3.37Å; K273-L276 VanDerWaalsContact O-N 3.12Å; L276-A280 WeakPolarHBondContact O-CB 3.49Å; L276-A280 PolarHBondContact O-N 2.89Å
277	Y	75.4	Confident	67.1	Low	167 Å²	167	126.7 Å²	126.7	66%	0.655	59%	0.588	S	S	*	*	H	α-helix	trans	-69.2	-46.4	175.1	-176.9	-106.8	0	0	0	111.6	K273 D274 S275 A279 A280 M281	K273-Y277 PolarHBondContact O-N 3.02Å; D274-Y277 PolarHBondContact O-N 2.99Å; S275-Y277 VanDerWaalsContact C-N 3.34Å; S275-Y277 PolarHBondContact O-N 3.06Å; Y277-A279 VanDerWaalsContact C-N 3.34Å; Y277-A279 PolarHBondContact O-N 3.11Å; Y277-A280 WeakPolarHBondContact O-CB 3.3Å; Y277-A280 PolarHBondContact O-N 3.13Å; Y277-A280 VanDerWaalsContact O-N 3.16Å; Y277-M281 HydrophobicContact CD1-CE 4.03Å; Y277-M281 HydrophobicContact CE1-CE 3.4Å; Y277-M281 WeakPolarHBondContact O-CB 3.46Å; Y277-M281 PolarHBondContact O-N 3.46Å
278	L	77.1	Confident	68.5	Low	98 Å²	98	122.3 Å²	122.3	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-61.7	-40.4	173.7	-178.4	60.4	0	0	0	111.8	D274 S275 A280 M281 L282	D274-L278 WeakPolarHBondContact O-CB 3.39Å; D274-L278 PolarHBondContact O-N 3.35Å; S275-L278 PolarHBondContact O-N 3.03Å; L278-A280 VanDerWaalsContact C-N 3.35Å; L278-A280 PolarHBondContact O-N 3.26Å; L278-M281 PolarHBondContact O-N 3.05Å; L278-L282 HydrophobicContact CD1-CD1 4.4Å; L278-L282 HydrophobicContact CD1-CG 4.45Å; L278-L282 HydrophobicContact CG-CD1 4.09Å; L278-L282 WeakPolarHBondContact O-CB 3.43Å; L278-L282 WeakPolarHBondContact O-CG 3.26Å; L278-L282 PolarHBondContact O-N 3.4Å
279	A	74.5	Confident	69.7	Low	29 Å²	29	121.7 Å²	121.7	24%	0.24	57%	0.572	C	S	.	*	H	α-helix	trans	-66.5	-33.8	174.4	0	0	0	0	0	112.6	S275 Y277 R283	S275-A279 WeakPolarHBondContact O-CB 3.4Å; S275-A279 PolarHBondContact O-N 2.96Å; Y277-A279 VanDerWaalsContact C-N 3.34Å; Y277-A279 PolarHBondContact O-N 3.11Å; A279-R283 VanDerWaalsContact O-CB 3.27Å; A279-R283 WeakPolarHBondContact O-CB 3.11Å; A279-R283 WeakPolarHBondContact O-CD 3.4Å; A279-R283 WeakPolarHBondContact O-CG 3.2Å; A279-R283 PolarHBondContact O-N 3.3Å
280	A	79.4	Confident	70.3	Confident	53 Å²	53	119.5 Å²	119.5	44%	0.438	56%	0.564	S	S	.	*	H	α-helix	trans	-69.1	-38.9	171.9	0	0	0	0	0	111.9	L276 Y277 L278 R283 R284	L276-A280 WeakPolarHBondContact O-CB 3.49Å; L276-A280 PolarHBondContact O-N 2.89Å; Y277-A280 WeakPolarHBondContact O-CB 3.3Å; Y277-A280 PolarHBondContact O-N 3.13Å; Y277-A280 VanDerWaalsContact O-N 3.16Å; L278-A280 VanDerWaalsContact C-N 3.35Å; L278-A280 PolarHBondContact O-N 3.26Å; A280-R283 PolarHBondContact O-N 2.8Å; A280-R284 PolarHBondContact O-N 2.94Å
281	M	81.5	Confident	71.1	Confident	95 Å²	95	118.4 Å²	118.4	47%	0.468	56%	0.562	S	S	.	*	H	α-helix	trans	-66.5	-46.5	176.6	-163.5	-174.4	-61.5	0	0	111.6	Y277 L278 R283 R284 F285	Y277-M281 HydrophobicContact CD1-CE 4.03Å; Y277-M281 HydrophobicContact CE1-CE 3.4Å; Y277-M281 WeakPolarHBondContact O-CB 3.46Å; Y277-M281 PolarHBondContact O-N 3.46Å; L278-M281 PolarHBondContact O-N 3.05Å; M281-R283 VanDerWaalsContact C-N 3.35Å; M281-R283 PolarHBondContact O-N 3.31Å; M281-R284 WeakPolarHBondContact O-CA 3.33Å; M281-R284 VanDerWaalsContact O-CB 3.3Å; M281-R284 WeakPolarHBondContact O-CB 3.37Å; M281-R284 PolarHBondContact O-N 3.06Å; M281-R284 VanDerWaalsContact O-N 3.12Å; M281-F285 PolarHBondContact O-N 2.63Å
282	L	82.6	Confident	71.3	Confident	103 Å²	103	118.7 Å²	118.7	54%	0.539	56%	0.561	S	S	.	*	H	α-helix	trans	-59.5	-43	172.4	-74.5	165.4	0	0	0	111.7	L278 R284 F285 T286	L278-L282 HydrophobicContact CD1-CD1 4.4Å; L278-L282 HydrophobicContact CD1-CG 4.45Å; L278-L282 HydrophobicContact CG-CD1 4.09Å; L278-L282 WeakPolarHBondContact O-CB 3.43Å; L278-L282 WeakPolarHBondContact O-CG 3.26Å; L278-L282 PolarHBondContact O-N 3.4Å; L282-R284 VanDerWaalsContact C-N 3.3Å; L282-R284 PolarHBondContact O-N 3.06Å; L282-F285 PolarHBondContact O-N 3.04Å; L282-T286 WeakPolarHBondContact O-CG2 3.43Å; L282-T286 PolarHBondContact O-N 3.13Å; L282-T286 PolarHBondContact O-OG1 3.04Å
283	R	81.6	Confident	71.6	Confident	173 Å²	173	121.9 Å²	121.9	65%	0.653	57%	0.573	S	S	*	*	H	α-helix	trans	-65	-31.1	174.5	-77.7	169.2	-179.8	166.1	-0.3	113.3	A279 A280 M281 T286 R287	A279-R283 VanDerWaalsContact O-CB 3.27Å; A279-R283 WeakPolarHBondContact O-CB 3.11Å; A279-R283 WeakPolarHBondContact O-CD 3.4Å; A279-R283 WeakPolarHBondContact O-CG 3.2Å; A279-R283 PolarHBondContact O-N 3.3Å; A280-R283 PolarHBondContact O-N 2.8Å; M281-R283 VanDerWaalsContact C-N 3.35Å; M281-R283 PolarHBondContact O-N 3.31Å; R283-T286 WeakPolarHBondContact CA-OG1 3.34Å; R283-T286 PolarHBondContact O-OG1 3.36Å; R283-R287 WeakPolarHBondContact O-CB 3.45Å; R283-R287 PolarHBondContact O-N 2.97Å
284	R	76.8	Confident	71.4	Confident	192 Å²	192	122.8 Å²	122.8	73%	0.725	58%	0.576	S	S	*	*	H	α-helix	trans	-65.1	-54	170.1	-118.5	-178.4	178.6	178.3	-2.1	109.6	A280 M281 L282 T286 R287 E288	A280-R284 PolarHBondContact O-N 2.94Å; M281-R284 WeakPolarHBondContact O-CA 3.33Å; M281-R284 VanDerWaalsContact O-CB 3.3Å; M281-R284 WeakPolarHBondContact O-CB 3.37Å; M281-R284 PolarHBondContact O-N 3.06Å; M281-R284 VanDerWaalsContact O-N 3.12Å; L282-R284 VanDerWaalsContact C-N 3.3Å; L282-R284 PolarHBondContact O-N 3.06Å; R284-T286 VanDerWaalsContact C-N 3.3Å; R284-T286 PolarHBondContact O-N 3.26Å; R284-R287 WeakPolarHBondContact O-CB 3.37Å; R284-R287 PolarHBondContact O-N 2.84Å; R284-E288 VanDerWaalsContact O-CB 3.26Å; R284-E288 WeakPolarHBondContact O-CB 3.44Å; R284-E288 PolarHBondContact O-N 3.45Å
285	F	74.9	Confident	71.2	Confident	145 Å²	145	130 Å²	130	64%	0.636	60%	0.597	S	S	*	*	H	α-helix	trans	-61.6	-34.8	-178.6	-140.5	-93.1	0	0	0	113.1	M281 L282 K289	M281-F285 PolarHBondContact O-N 2.63Å; L282-F285 PolarHBondContact O-N 3.04Å; F285-K289 WeakPolarHBondContact O-CB 3.43Å; F285-K289 PolarHBondContact O-N 3.49Å
286	T	75.8	Confident	69.7	Low	85 Å²	85	133.2 Å²	133.2	52%	0.521	61%	0.609	S	S	.	*	H	α-helix	trans	-72.5	-38.4	172.2	56.1	0	0	0	0	112.8	L282 R283 R284 E290	L282-T286 WeakPolarHBondContact O-CG2 3.43Å; L282-T286 PolarHBondContact O-N 3.13Å; L282-T286 PolarHBondContact O-OG1 3.04Å; R283-T286 WeakPolarHBondContact CA-OG1 3.34Å; R283-T286 PolarHBondContact O-OG1 3.36Å; R284-T286 VanDerWaalsContact C-N 3.3Å; R284-T286 PolarHBondContact O-N 3.26Å; T286-E290 WeakPolarHBondContact O-CB 3.36Å; T286-E290 PolarHBondContact O-N 3.38Å
287	R	76.4	Confident	68.1	Low	175 Å²	175	132.7 Å²	132.7	66%	0.66	61%	0.613	S	S	*	*	H	α-helix	trans	-66.4	-41.9	176.3	-179.8	-176.6	-61.8	-165.6	-2.6	111.4	R283 R284 E290 E291	R283-R287 WeakPolarHBondContact O-CB 3.45Å; R283-R287 PolarHBondContact O-N 2.97Å; R284-R287 WeakPolarHBondContact O-CB 3.37Å; R284-R287 PolarHBondContact O-N 2.84Å; R287-E290 CarbonylContact O-C 3.45Å; R287-E290 WeakPolarHBondContact O-CB 3.34Å; R287-E290 PolarHBondContact O-N 3.03Å; R287-E291 VanDerWaalsContact O-CB 3.28Å; R287-E291 WeakPolarHBondContact O-CB 3.14Å; R287-E291 PolarHBondContact O-N 3.33Å
288	E	72.4	Confident	66	Low	94 Å²	94	131 Å²	131	44%	0.439	63%	0.625	S	S	.	*	H	α-helix	trans	-64	-45.7	176.6	-168.4	177.7	174.9	0	0	110.4	R284 E290 E291 M292	R284-E288 VanDerWaalsContact O-CB 3.26Å; R284-E288 WeakPolarHBondContact O-CB 3.44Å; R284-E288 PolarHBondContact O-N 3.45Å; E288-E290 VanDerWaalsContact C-N 3.31Å; E288-E290 PolarHBondContact O-N 3.39Å; E288-E291 WeakPolarHBondContact O-CB 3.32Å; E288-E291 PolarHBondContact O-N 3.31Å; E288-M292 HydrophobicContact CG-CE 3.95Å; E288-M292 VanDerWaalsContact O-CG 3.31Å; E288-M292 WeakPolarHBondContact O-CG 3.34Å; E288-M292 PolarHBondContact O-N 3.29Å
289	K	72	Confident	63.9	Low	146 Å²	146	129.2 Å²	129.2	64%	0.635	63%	0.631	S	S	*	*	H	α-helix	trans	-63.4	-32.2	171.4	-178.6	175.6	178.1	175.5	0	113.5	F285 K293	F285-K289 WeakPolarHBondContact O-CB 3.43Å; F285-K289 PolarHBondContact O-N 3.49Å; K289-K293 PolarHBondContact O-N 3.38Å
290	E	64.1	Low	62	Low	133 Å²	133	135.5 Å²	135.5	62%	0.621	66%	0.66	S	S	*	*	H	α-helix	trans	-73.4	-37	173.9	-177.1	176.6	-162.4	0	0	111.4	T286 R287 E288 K293 K294	T286-E290 WeakPolarHBondContact O-CB 3.36Å; T286-E290 PolarHBondContact O-N 3.38Å; R287-E290 CarbonylContact O-C 3.45Å; R287-E290 WeakPolarHBondContact O-CB 3.34Å; R287-E290 PolarHBondContact O-N 3.03Å; E288-E290 VanDerWaalsContact C-N 3.31Å; E288-E290 PolarHBondContact O-N 3.39Å; E290-K293 CarbonylContact O-C 3.57Å; E290-K293 WeakPolarHBondContact O-CA 3.29Å; E290-K293 PolarHBondContact O-N 2.88Å; E290-K293 VanDerWaalsContact O-N 3.14Å; E290-K294 VanDerWaalsContact O-CB 3.32Å; E290-K294 WeakPolarHBondContact O-CB 3.41Å; E290-K294 PolarHBondContact O-N 3.14Å
291	E	64	Low	59.7	Low	138 Å²	138	140.6 Å²	140.6	65%	0.645	68%	0.675	S	S	*	*	H	α-helix	trans	-67.4	-42.5	175.1	-174.4	166.4	-164.9	0	0	111.6	R287 E288 K293 K294 R295	R287-E291 VanDerWaalsContact O-CB 3.28Å; R287-E291 WeakPolarHBondContact O-CB 3.14Å; R287-E291 PolarHBondContact O-N 3.33Å; E288-E291 WeakPolarHBondContact O-CB 3.32Å; E288-E291 PolarHBondContact O-N 3.31Å; E291-K293 PolarHBondContact O-N 2.86Å; E291-K294 PolarHBondContact O-N 3.26Å; E291-R295 PolarHBondContact O-N 3.35Å
292	M	52.1	Low	57.3	Low	132 Å²	132	142.4 Å²	142.4	65%	0.65	69%	0.686	S	S	*	*	H	α-helix	trans	-54.3	-41.8	166.6	-67.3	176.5	-149.4	0	0	111.6	E288	E288-M292 HydrophobicContact CG-CE 3.95Å; E288-M292 VanDerWaalsContact O-CG 3.31Å; E288-M292 WeakPolarHBondContact O-CG 3.34Å; E288-M292 PolarHBondContact O-N 3.29Å
293	K	54.9	Low	54.8	Low	174 Å²	174	147.6 Å²	147.6	76%	0.757	70%	0.698	S	S	*	*	H	α-helix	trans	-78.4	-23	-180	-170.1	165.4	-178.4	175.5	0	113.3	K289 E290 E291	K289-K293 PolarHBondContact O-N 3.38Å; E290-K293 CarbonylContact O-C 3.57Å; E290-K293 WeakPolarHBondContact O-CA 3.29Å; E290-K293 PolarHBondContact O-N 2.88Å; E290-K293 VanDerWaalsContact O-N 3.14Å; E291-K293 PolarHBondContact O-N 2.86Å
294	K	59	Low	52.7	Low	179 Å²	179	146.5 Å²	146.5	78%	0.778	71%	0.705	S	S	*	*	H	α-helix	trans	-83.9	-10.9	178.7	-163.8	169.9	-177.8	178.9	0	113.2	E290 E291 N296	E290-K294 VanDerWaalsContact O-CB 3.32Å; E290-K294 WeakPolarHBondContact O-CB 3.41Å; E290-K294 PolarHBondContact O-N 3.14Å; E291-K294 PolarHBondContact O-N 3.26Å; K294-N296 VanDerWaalsContact C-N 3.25Å; K294-N296 PolarHBondContact O-N 3.04Å
295	R	53.9	Low	50.5	Low	233 Å²	233	141.1 Å²	141.1	88%	0.879	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	3.7	173.5	-162.8	163.9	178.4	129.7	1.7	114.1	E291	E291-R295 PolarHBondContact O-N 3.35Å
296	N	38.1	Very low	48.4	Very low	136 Å²	136	139.4 Å²	139.4	73%	0.727	71%	0.713	S	S	*	*	S	Bend	trans	-140	111.2	172.4	-157.7	30.7	0	0	0	111.3	K294	K294-N296 VanDerWaalsContact C-N 3.25Å; K294-N296 PolarHBondContact O-N 3.04Å
297	P	44.4	Very low	46.2	Very low	106 Å²	106	138.5 Å²	138.5	69%	0.688	72%	0.721	S	S	*	*			trans	-92.1	170.3	-175.4	36.6	-35.4	0	0	0	114.5
298	S	31.4	Very low	44.2	Very low	131 Å²	131	136.7 Å²	136.7	92%	0.916	73%	0.73	S	S	*	*			trans	62.8	134	178.6	69.5	0	0	0	0	118.4
299	G	31.8	Very low	42.1	Very low	61 Å²	61	137.1 Å²	137.1	63%	0.629	75%	0.749	S	S	*	*			cis	177.5	127	-14.2	0	0	0	0	0	114
300	D	34.1	Very low	40	Very low	161 Å²	161	136.2 Å²	136.2	86%	0.861	76%	0.762	S	S	*	*			trans	51.1	162.8	148.6	-52.4	-53.3	0	0	0	120.5
301	H	31.9	Very low	38.3	Very low	161 Å²	161	139.1 Å²	139.1	75%	0.745	77%	0.772	S	S	*	*			cis	-152.7	160.4	15.9	-169.8	-137.7	0	0	0	114.2
302	L	31.6	Very low	37.4	Very low	133 Å²	133	137.5 Å²	137.5	70%	0.696	77%	0.773	S	S	*	*			trans	87.9	146.5	152.4	-150.2	50.2	0	0	0	121.2
303	R	30.2	Very low	37.1	Very low	211 Å²	211	136.4 Å²	136.4	80%	0.796	78%	0.776	S	S	*	*			trans	-114.9	167	-175.6	-60.3	163.4	63.9	-177.4	1.2	109.2
304	L	37	Very low	35.9	Very low	151 Å²	151	135.6 Å²	135.6	79%	0.791	78%	0.78	S	S	*	*				151.6	165.8	99.3	-87.7	122.8	0	0	0	106.8
305	A	30.7	Very low	34.9	Very low	79 Å²	79	132.6 Å²	132.6	65%	0.653	78%	0.779	S	S	*	*			cis	-175.8	163.9	-34.3	0	0	0	0	0	109.8
306	A	30	Very low	33.7	Very low	108 Å²	108	124.9 Å²	124.9	89%	0.893	77%	0.772	S	S	*	*			trans	62.8	162.1	170.7	0	0	0	0	0	116.4
307	G	30.4	Very low	33.6	Very low	67 Å²	67	126 Å²	126	69%	0.691	78%	0.778	S	S	*	*			cis	123.7	148.6	5.4	0	0	0	0	0	111.2
308	T	33.2	Very low	33.2	Very low	137 Å²	137	125 Å²	125	84%	0.84	78%	0.779	S	S	*	*			cis	-160.6	147.7	0.8	49.4	0	0	0	0	112.8
309	A	28.7	Very low	33.4	Very low	102 Å²	102	124.7 Å²	124.7	84%	0.843	77%	0.771	S	S	*	*			trans	50.6	131.5	141.1	0	0	0	0	0	124.5
310	S	27.7	Very low	33.3	Very low	128 Å²	128	130.7 Å²	130.7	90%	0.895	78%	0.783	S	S	*	*			trans	-157.6	166.6	135	64.2	0	0	0	0	111.8
311	K	29.3	Very low	33.2	Very low	194 Å²	194	130.2 Å²	130.2	84%	0.843	78%	0.779	S	S	*	*			trans	-176.5	165.8	-158	168.2	178.5	176.1	-175.2	0	109.6
312	P	44.2	Very low	33.1	Very low	103 Å²	103	127.4 Å²	127.4	67%	0.669	78%	0.776	S	S	*	*			cis	-121.8	-135.7	-17.4	37.4	-15	0	0	0	110.3
313	P	46.8	Very low	32.7	Very low	109 Å²	109	125.1 Å²	125.1	71%	0.708	76%	0.764	S	S	*	*			cis	-137.6	140.8	-23.7	33.2	-12.2	0	0	0	118.7
314	N	29	Very low	32.5	Very low	158 Å²	158	118.7 Å²	118.7	85%	0.845	76%	0.756	S	S	*	*			trans	58.9	174.1	147	-110.5	16.7	0	0	0	119.9
315	P	38.7	Very low	32.1	Very low	115 Å²	115	116.4 Å²	116.4	75%	0.747	75%	0.752	S	S	*	*			cis	-128.1	168.6	-3.8	41.1	-25.9	0	0	0	116.7
316	G	29.6	Very low	31.8	Very low	71 Å²	71	115.7 Å²	115.7	73%	0.732	74%	0.737	S	S	*	*			trans	81	113.8	143.6	0	0	0	0	0	120.4
317	N	34.4	Very low	31.9	Very low	159 Å²	159	114.6 Å²	114.6	85%	0.85	72%	0.723	S	S	*	*			trans	-1.6	120.8	161.4	-65.6	8.1	0	0	0	118.8
318	A	36.5	Very low	31.9	Very low	86 Å²	86	116 Å²	116	71%	0.711	72%	0.718	S	S	*	*				81.9	152.1	73.4	0	0	0	0	0	113.7
319	T	34.8	Very low	31.6	Very low	124 Å²	124	117.3 Å²	117.3	76%	0.761	72%	0.715	S	S	*	*			cis	-152.9	132.7	23.7	-37.8	0	0	0	0	114.4
320	H	30.9	Very low	31.5	Very low	188 Å²	188	118.1 Å²	118.1	87%	0.87	70%	0.704	S	S	*	*			trans	67.6	157.5	153	-91.1	-108.7	0	0	0	125.1
321	L	30.8	Very low	31.6	Very low	150 Å²	150	120.7 Å²	120.7	79%	0.785	70%	0.702	S	S	*	*			trans	-121.3	168.7	-163.1	-82.5	160.1	0	0	0	112.6
322	P	29.7	Very low	31.4	Very low	103 Å²	103	115.3 Å²	115.3	67%	0.669	70%	0.702	S	S	*	*			trans	-100.7	-153.4	-174.9	42.5	-37.7	0	0	0	113.8	M1	M1-P322 WeakPolarHBondContact CE-O 3.46Å
323	L	23.8	Very low	30.8	Very low	85 Å²	85	114.3 Å²	114.3	45%	0.445	71%	0.711	S	S	.	*			trans	-92.3	151.1	-169.3	-172.1	55.8	0	0	0	115.7	M1 A2	M1-L323 HydrophobicContact CB-CB 4.37Å; M1-L323 HydrophobicContact CB-CD1 3.84Å; M1-L323 HydrophobicContact CE-CD1 4.29Å; M1-L323 HydrophobicContact CG-CB 3.9Å; M1-L323 HydrophobicContact CG-CD1 4.07Å; A2-L323 HydrophobicContact CB-CD1 3.96Å; A2-L323 HydrophobicContact CB-CD2 3.84Å; A2-L323 HydrophobicContact CB-CG 4.5Å
324	A	26.6	Very low	30	Very low	76 Å²	76	113.1 Å²	113.1	63%	0.628	72%	0.718	S	S	*	*			trans	-69.3	-167	168	0	0	0	0	0	116.6
325	S	28.7	Very low	30.3	Very low	102 Å²	102	110.7 Å²	110.7	71%	0.713	72%	0.72	S	S	*	*			trans	92.5	122.4	157.3	-58.2	0	0	0	0	118.2
326	N	24.5	Very low	29.8	Very low	64 Å²	64	110.1 Å²	110.1	34%	0.342	72%	0.718	S	S	.	*			trans	-156.4	-177.7	144.8	-141.2	74	0	0	0	110.8	H1002 Q1003	N326-H1002 PolarHBondContact ND2-CD2 3.04Å; N326-H1002 VanDerWaalsContact ND2-CD2 3.3Å; N326-H1002 VanDerWaalsContact ND2-CG 3.27Å; N326-H1002 PolarHBondContact ND2-ND1 2.66Å; N326-H1002 PolarHBondContact OD1-ND1 3.4Å; N326-H1002 VanDerWaalsContact OD1-ND1 3.1Å; N326-Q1003 HydrophobicContact CB-CG 4.36Å; N326-Q1003 VanDerWaalsContact CB-NE2 3.34Å; N326-Q1003 PolarHBondContact ND2-NE2 3.06Å; N326-Q1003 PolarHBondContact ND2-OE1 3.13Å; N326-Q1003 WeakPolarHBondContact OD1-CG 3.46Å
327	S	31.1	Very low	30.1	Very low	86 Å²	86	113.4 Å²	113.4	60%	0.601	72%	0.724	S	S	*	*			trans	-147	-165.6	174.2	-141.3	0	0	0	0	109.3
328	T	30.8	Very low	29.7	Very low	96 Å²	96	109.6 Å²	109.6	59%	0.589	72%	0.723	S	S	*	*			cis	-167.2	169.7	29.4	-22.2	0	0	0	0	111.9	H1002	T328-H1002 PolarHBondContact OG1-NE2 3.44Å
329	H	27.3	Very low	29.6	Very low	164 Å²	164	112.6 Å²	112.6	76%	0.759	73%	0.727	S	S	*	*			trans	95.1	132.8	146.6	-140.1	-131.6	0	0	0	121.2
330	L	27.1	Very low	29.6	Very low	120 Å²	120	114 Å²	114	63%	0.628	73%	0.729	S	S	*	*			trans	48.9	121.9	155.4	-69.9	-174.6	0	0	0	126.5
331	Q	28.2	Very low	29.5	Very low	181 Å²	181	110.4 Å²	110.4	85%	0.846	73%	0.725	S	S	*	*				77.1	100.9	116.3	-151.6	150.9	16.5	0	0	121.3
332	G	25.4	Very low	29.4	Very low	82 Å²	82	110.3 Å²	110.3	85%	0.845	73%	0.725	S	S	*	*			trans	174.8	162.8	166.2	0	0	0	0	0	111.6
333	G	32.8	Very low	29.4	Very low	82 Å²	82	111 Å²	111	85%	0.845	73%	0.727	S	S	*	*			cis	165.1	93.6	-7.4	0	0	0	0	0	113.4
334	G	29.2	Very low	29.6	Very low	83 Å²	83	114 Å²	114	86%	0.856	74%	0.743	S	S	*	*			trans	71.7	172.2	174.7	0	0	0	0	0	115.5
335	A	35.3	Very low	29.8	Very low	108 Å²	108	117.6 Å²	117.6	89%	0.893	75%	0.752	S	S	*	*	S	Bend	trans	-117.4	96.2	-169.5	0	0	0	0	0	114.4
336	S	29.3	Very low	29.9	Very low	102 Å²	102	118.3 Å²	118.3	71%	0.713	75%	0.752	S	S	*	*	S	Bend		173.9	138.7	127.5	-167.6	0	0	0	0	111.4	G338	S336-G338 PolarHBondContact O-N 3.43Å
337	T	34.2	Very low	30.6	Very low	140 Å²	140	120.9 Å²	120.9	86%	0.859	78%	0.775	S	S	*	*			trans	22.6	88	153.7	56.4	0	0	0	0	118.1
338	G	27.6	Very low	30.8	Very low	80 Å²	80	123.2 Å²	123.2	83%	0.825	78%	0.78	S	S	*	*			trans	-158.7	171.6	176.1	0	0	0	0	0	113.6	S336	S336-G338 PolarHBondContact O-N 3.43Å
339	N	33.7	Very low	31.6	Very low	149 Å²	149	124.4 Å²	124.4	80%	0.797	79%	0.79	S	S	*	*			trans	-152.8	161.4	-179	-168.7	8.5	0	0	0	109.9
340	L	34.8	Very low	32.6	Very low	152 Å²	152	120.4 Å²	120.4	80%	0.796	79%	0.785	S	S	*	*			trans	87.1	135.2	168.5	-47.2	175.8	0	0	0	120.4
341	S	29.6	Very low	33.5	Very low	114 Å²	114	121 Å²	121	80%	0.797	79%	0.794	S	S	*	*			trans	83.1	107	141.1	-151.9	0	0	0	0	124
342	L	27.7	Very low	34	Very low	148 Å²	148	121.1 Å²	121.1	78%	0.775	80%	0.796	S	S	*	*				40.6	117.3	124.1	-137.4	80.3	0	0	0	122.8
343	T	29.5	Very low	35.1	Very low	118 Å²	118	122.6 Å²	122.6	72%	0.724	79%	0.793	S	S	*	*			trans	59.2	124	140.7	51.9	0	0	0	0	124
344	D	28.6	Very low	35.6	Very low	146 Å²	146	126.5 Å²	126.5	78%	0.781	79%	0.794	S	S	*	*				79.6	117.8	125.4	-164.4	26.8	0	0	0	120.9
345	L	31.1	Very low	36.2	Very low	153 Å²	153	131.3 Å²	131.3	80%	0.801	80%	0.799	S	S	*	*			trans	178.9	143.5	134.2	-98.3	166.5	0	0	0	110.4
346	T	29.8	Very low	36.5	Very low	117 Å²	117	129.8 Å²	129.8	72%	0.718	80%	0.795	S	S	*	*			trans	54.7	128	170.2	-175.2	0	0	0	0	118.6
347	S	40.7	Very low	37.1	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	80%	0.801	S	S	*	*			cis	80.9	61.4	9.6	-42.8	0	0	0	0	119.2
348	D	34.1	Very low	37.1	Very low	135 Å²	135	128.5 Å²	128.5	72%	0.722	80%	0.797	S	S	*	*			trans	-156.4	144.9	146.4	-150.5	36.4	0	0	0	112.5	A350	D348-A350 PolarHBondContact O-N 3.06Å
349	P	47.9	Very low	37.6	Very low	122 Å²	122	128.7 Å²	128.7	79%	0.792	78%	0.779	S	S	*	*			trans	-101.7	34.5	-161.7	40.3	-35.9	0	0	0	115.9
350	A	48.8	Very low	38.3	Very low	79 Å²	79	128.5 Å²	128.5	65%	0.653	77%	0.773	S	S	*	*			trans	-91	-14.8	-173.2	0	0	0	0	0	116.3	D348	D348-A350 PolarHBondContact O-N 3.06Å
351	V	44.5	Very low	38.9	Very low	134 Å²	134	128.5 Å²	128.5	81%	0.812	77%	0.767	S	S	*	*	S	Bend	trans	-97.5	-2.8	-162.3	-63	0	0	0	0	116.5	S353	V351-S353 PolarHBondContact O-N 3.12Å
352	M	39.4	Very low	39.9	Very low	182 Å²	182	128.9 Å²	128.9	90%	0.897	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-4.5	-175.7	-86	-179.5	61.3	0	0	115.5
353	S	48.8	Very low	41	Very low	113 Å²	113	128.6 Å²	128.6	79%	0.79	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	5.9	-166.8	-54.8	0	0	0	0	116.2	V351	V351-S353 PolarHBondContact O-N 3.12Å
354	L	44.2	Very low	42	Very low	165 Å²	165	129.4 Å²	129.4	86%	0.864	75%	0.75	S	S	*	*	S	Bend	trans	-122	-0.5	-167.8	-159.4	58.5	0	0	0	116.4
355	L	41	Very low	42.7	Very low	183 Å²	183	129 Å²	129	96%	0.958	75%	0.748	S	S	*	*	S	Bend	trans	-121.7	45.2	178.6	-157.1	69.2	0	0	0	112.9
356	G	41.4	Very low	43.5	Very low	77 Å²	77	129.1 Å²	129.1	79%	0.794	75%	0.749	S	S	*	*			trans	-129.4	48.3	-175.9	0	0	0	0	0	114.1
357	S	42.3	Very low	44.3	Very low	120 Å²	120	130.9 Å²	130.9	84%	0.839	75%	0.753	S	S	*	*			trans	-163.3	105.4	172.3	-179.4	0	0	0	0	112.9
358	A	33.6	Very low	44.7	Very low	94 Å²	94	128.7 Å²	128.7	78%	0.777	75%	0.749	S	S	*	*			trans	-176.3	117.7	144.5	0	0	0	0	0	112.2
359	N	37.9	Very low	44.9	Very low	84 Å²	84	129.3 Å²	129.3	45%	0.449	75%	0.752	S	S	.	*			trans	51.1	96.5	135	-173.5	17.4	0	0	0	119.7	K361 E362	N359-K361 WeakPolarHBondContact OD1-CG 3.33Å; N359-K361 PolarHBondContact OD1-N 3.35Å; N359-E362 VanDerWaalsContact ND2-CD 3.3Å; N359-E362 PolarHBondContact ND2-OE2 2.8Å
360	E	49.2	Very low	44.6	Very low	145 Å²	145	130.6 Å²	130.6	68%	0.678	75%	0.751	S	S	*	*	S	Bend	trans	-93.5	-15.8	162.5	68.6	-174.8	-105	0	0	114.2	E362 L363	E360-E362 PolarHBondContact O-N 2.93Å; E360-L363 PolarHBondContact O-N 3.25Å
361	K	47.8	Very low	44	Very low	153 Å²	153	133 Å²	133	67%	0.665	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-23.4	-163.2	59.1	156.4	-171.7	157.7	0	114.9	N359 L363	N359-K361 WeakPolarHBondContact OD1-CG 3.33Å; N359-K361 PolarHBondContact OD1-N 3.35Å; K361-L363 VanDerWaalsContact C-N 3.34Å
362	E	49.1	Very low	43.4	Very low	121 Å²	121	135.7 Å²	135.7	57%	0.565	75%	0.754	S	S	*	*	H	α-helix	trans	-80.7	-13.8	179.3	-73	168.9	171.9	0	0	113.2	N359 E360	N359-E362 VanDerWaalsContact ND2-CD 3.3Å; N359-E362 PolarHBondContact ND2-OE2 2.8Å; E360-E362 PolarHBondContact O-N 2.93Å
363	L	51	Low	42.9	Very low	142 Å²	142	131.5 Å²	131.5	74%	0.743	74%	0.743	S	S	*	*	H	α-helix	trans	-86.1	-7.7	179.3	-69.1	175.4	0	0	0	114.1	E360 K361	E360-L363 PolarHBondContact O-N 3.25Å; K361-L363 VanDerWaalsContact C-N 3.34Å
364	Q	51	Low	42	Very low	135 Å²	135	133.6 Å²	133.6	63%	0.631	74%	0.744	S	S	*	*	H	α-helix	trans	-99.9	-31.9	178.5	-67.9	166.9	16.8	0	0	111.6
365	D	43.3	Very low	41.5	Very low	138 Å²	138	133 Å²	133	74%	0.738	74%	0.741	S	S	*	*	H	α-helix	trans	-64.4	-43.7	175.7	-150.8	42.5	0	0	0	111.3	L367 G368	D365-L367 PolarHBondContact O-N 3.28Å; D365-L367 VanDerWaalsContact O-N 3.09Å; D365-G368 PolarHBondContact O-N 2.83Å
366	L	47.1	Very low	40.8	Very low	156 Å²	156	131.1 Å²	131.1	82%	0.817	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	8.1	-174.2	-140.1	76.5	0	0	0	115.6
367	L	47	Very low	40.4	Very low	154 Å²	154	133.8 Å²	133.8	81%	0.806	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	-3.4	178.9	-165.9	57.7	0	0	0	113.2	D365	D365-L367 PolarHBondContact O-N 3.28Å; D365-L367 VanDerWaalsContact O-N 3.09Å
368	G	48.5	Very low	39.6	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	73%	0.726	S	S	*	*	S	Bend	trans	-83.9	-19.1	177	0	0	0	0	0	115.2	D365	D365-G368 PolarHBondContact O-N 2.83Å
369	D	40.3	Very low	39.4	Very low	148 Å²	148	137.8 Å²	137.8	79%	0.791	73%	0.727	S	S	*	*	S	Bend	trans	-107.2	34.7	-160	-160.9	38.3	0	0	0	114.6
370	L	40.8	Very low	39.2	Very low	149 Å²	149	140.5 Å²	140.5	78%	0.78	74%	0.737	S	S	*	*			trans	-140.2	65.5	176.3	-74.7	178.6	0	0	0	112.7
371	D	35.5	Very low	38.5	Very low	129 Å²	129	141.8 Å²	141.8	69%	0.69	74%	0.743	S	S	*	*			trans	-81.7	143.8	155.4	-173.8	13	0	0	0	109.9	S373	D371-S373 PolarHBondContact OD1-N 2.98Å; D371-S373 PolarHBondContact OD1-OG 3.4Å; D371-S373 PolarHBondContact OD2-OG 3.46Å
372	F	31.6	Very low	37.8	Very low	190 Å²	190	137.5 Å²	137.5	83%	0.833	74%	0.736	S	S	*	*			trans	-149	61.6	178.9	-108.9	-77.9	0	0	0	111.3
373	S	30.4	Very low	37	Very low	95 Å²	95	140.3 Å²	140.3	66%	0.664	75%	0.751	S	S	*	*			trans	-99	82.7	172.2	54.6	0	0	0	0	112.4	D371	D371-S373 PolarHBondContact OD1-N 2.98Å; D371-S373 PolarHBondContact OD1-OG 3.4Å; D371-S373 PolarHBondContact OD2-OG 3.46Å
374	L	29.6	Very low	35.9	Very low	156 Å²	156	138.6 Å²	138.6	82%	0.817	76%	0.758	S	S	*	*			trans	-152	152.4	164.3	-163.7	57	0	0	0	112.8
375	L	33	Very low	35	Very low	152 Å²	152	138.7 Å²	138.7	80%	0.796	77%	0.767	S	S	*	*			trans	72.6	118.8	-171.2	-50.6	-179.6	0	0	0	113.2
376	D	25.5	Very low	34.3	Very low	144 Å²	144	136.1 Å²	136.1	77%	0.77	77%	0.765	S	S	*	*			cis	-151.6	165.8	-0.2	-156.3	2.1	0	0	0	112.1
377	T	34.1	Very low	33.4	Very low	134 Å²	134	139.1 Å²	139.1	82%	0.822	77%	0.766	S	S	*	*			trans	-145.9	121.3	179.8	-69.2	0	0	0	0	110.3
378	D	26.4	Very low	32.5	Very low	129 Å²	129	138.6 Å²	138.6	69%	0.69	76%	0.759	S	S	*	*			trans	-120.8	96.7	-178.7	-163.7	1.2	0	0	0	112.7	Q380	D378-Q380 WeakPolarHBondContact OD1-CG 3.4Å
379	Q	28.1	Very low	31.7	Very low	169 Å²	169	142.9 Å²	142.9	79%	0.79	77%	0.765	S	S	*	*			trans	-148	131.2	135.5	-171.6	143.7	99.4	0	0	109.1
380	Q	34.6	Very low	31.1	Very low	140 Å²	140	139.3 Å²	139.3	65%	0.654	76%	0.764	S	S	*	*			trans	-94.4	145.3	-156.6	-59.2	-175.6	-9.6	0	0	115.5	D378	D378-Q380 WeakPolarHBondContact OD1-CG 3.4Å
381	H	33.6	Very low	30.6	Very low	173 Å²	173	139.8 Å²	139.8	80%	0.801	77%	0.765	S	S	*	*			trans	68.8	144.3	139.7	-75.9	-34.9	0	0	0	120.9
382	A	33.8	Very low	30.4	Very low	63 Å²	63	141.4 Å²	141.4	52%	0.521	77%	0.773	S	S	.	*			cis	-160.9	156.1	-8.6	0	0	0	0	0	114.8
383	M	31.7	Very low	30.2	Very low	179 Å²	179	135.4 Å²	135.4	88%	0.882	76%	0.764	S	S	*	*			trans	55.6	120.3	137.4	75.2	-158.4	173.8	0	0	122.9
384	A	29.1	Very low	30.2	Very low	107 Å²	107	139.5 Å²	139.5	88%	0.884	78%	0.777	S	S	*	*				-145.7	158.5	125.2	0	0	0	0	0	108.6
385	T	30.2	Very low	30.1	Very low	136 Å²	136	135.4 Å²	135.4	83%	0.834	77%	0.772	S	S	*	*			trans	-122	159.2	-167	47.2	0	0	0	0	114.5
386	A	29.6	Very low	29.9	Very low	84 Å²	84	134.9 Å²	134.9	69%	0.694	78%	0.775	S	S	*	*			trans	117.8	137.7	130.3	0	0	0	0	0	118.7
387	R	28.9	Very low	31	Very low	219 Å²	219	133.2 Å²	133.2	83%	0.826	77%	0.772	S	S	*	*			trans	70.4	156.8	147.9	-77.6	-175.8	127.9	108.6	11.8	118.1
388	E	27.7	Very low	30.6	Very low	144 Å²	144	131.8 Å²	131.8	67%	0.673	77%	0.768	S	S	*	*			cis	-158.8	166.4	-15.7	176.4	160.9	100.9	0	0	109
389	N	30.8	Very low	30.9	Very low	161 Å²	161	134.6 Å²	134.6	86%	0.861	78%	0.777	S	S	*	*			trans	-74.2	146.9	178.1	-51.2	-67.4	0	0	0	112.3
390	G	28.3	Very low	31	Very low	73 Å²	73	135.8 Å²	135.8	75%	0.753	78%	0.779	S	S	*	*			trans	-180	66	174.6	0	0	0	0	0	121.7
391	I	29.8	Very low	30.7	Very low	159 Å²	159	133.8 Å²	133.8	82%	0.815	79%	0.786	S	S	*	*				56	132.8	123.6	-107.1	172.3	0	0	0	123.4
392	L	31	Very low	30.5	Very low	163 Å²	163	131.6 Å²	131.6	85%	0.853	79%	0.785	S	S	*	*			trans	56.8	136.6	157.8	-86.8	121.5	0	0	0	123.1
393	G	28.1	Very low	30.2	Very low	63 Å²	63	132.6 Å²	132.6	65%	0.649	80%	0.802	S	S	*	*			trans	156.6	82.3	133.3	0	0	0	0	0	121.6
394	I	29.9	Very low	30.1	Very low	182 Å²	182	128.1 Å²	128.1	93%	0.933	80%	0.801	S	S	*	*			trans	63.9	132	140.6	-55.8	164.8	0	0	0	120.1
395	G	27	Very low	30.2	Very low	69 Å²	69	129.4 Å²	129.4	71%	0.711	80%	0.804	S	S	*	*			trans	148.2	99.4	159.3	0	0	0	0	0	116.9
396	V	30.2	Very low	30.1	Very low	141 Å²	141	126.6 Å²	126.6	86%	0.855	80%	0.802	S	S	*	*			trans	-154.5	161.2	-170.5	172.1	0	0	0	0	108.4
397	P	47.2	Very low	30.4	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	81%	0.814	S	S	*	*			cis	-128.8	176.4	-18.7	36.4	-20	0	0	0	115.6
398	S	26.8	Very low	30.3	Very low	104 Å²	104	125.2 Å²	125.2	73%	0.727	81%	0.809	S	S	*	*			trans	179.6	147.4	132.6	-83.3	0	0	0	0	111
399	Q	33.2	Very low	30.6	Very low	188 Å²	188	130.7 Å²	130.7	88%	0.879	82%	0.823	S	S	*	*			cis	-149.4	-179.1	-6.1	-121.2	-176.1	34	0	0	111.1
400	K	29.8	Very low	30.6	Very low	193 Å²	193	128.2 Å²	128.2	84%	0.839	82%	0.818	S	S	*	*			trans	-94	145	-170.5	-70.3	179.4	175.3	177.3	0	115.7
401	A	28.2	Very low	31	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	83%	0.827	S	S	*	*				-171.6	114.9	129.1	0	0	0	0	0	107.7
402	V	29.1	Very low	31	Very low	128 Å²	128	129.2 Å²	129.2	78%	0.776	83%	0.825	S	S	*	*				73	88.4	54.2	-173.1	0	0	0	0	114.2
403	G	27.6	Very low	31.3	Very low	84 Å²	84	127.2 Å²	127.2	87%	0.866	82%	0.824	S	S	*	*				76.8	117	128.9	0	0	0	0	0	120.3
404	G	29	Very low	31.8	Very low	85 Å²	85	130.1 Å²	130.1	88%	0.876	84%	0.835	S	S	*	*			trans	177	112.2	163.7	0	0	0	0	0	112.8
405	S	30.8	Very low	32.4	Very low	133 Å²	133	125.3 Å²	125.3	93%	0.93	83%	0.83	S	S	*	*			trans	-99	140.4	-179.2	49.7	0	0	0	0	112.6
406	G	29.3	Very low	33.3	Very low	77 Å²	77	124.9 Å²	124.9	79%	0.794	83%	0.825	S	S	*	*			trans	-164.9	135.3	174	0	0	0	0	0	111.4
407	Q	35.2	Very low	34.1	Very low	206 Å²	206	126 Å²	126	96%	0.963	83%	0.825	S	S	*	*			trans	-96.2	125.6	-166.2	-69	165.1	-89.6	0	0	114.3
408	G	27.9	Very low	34.3	Very low	69 Å²	69	129.9 Å²	129.9	71%	0.711	83%	0.832	S	S	*	*				89.5	117.4	116.4	0	0	0	0	0	119.9
409	R	32.8	Very low	35.9	Very low	259 Å²	259	130.1 Å²	130.1	98%	0.977	83%	0.831	S	S	*	*				-157.9	153.8	108.5	-104.7	165.9	-168	-91.2	-1.3	110.9
410	S	31.1	Very low	37.4	Very low	108 Å²	108	123.7 Å²	123.7	76%	0.755	81%	0.805	S	S	*	*			trans	-93.2	139.9	-176.1	175.9	0	0	0	0	111.9
411	L	36.4	Very low	39.4	Very low	180 Å²	180	117.4 Å²	117.4	94%	0.942	78%	0.784	S	S	*	*			trans	-150.4	124.5	131.8	-140.1	75.2	0	0	0	109.2
412	G	30.6	Very low	41.7	Very low	73 Å²	73	118.2 Å²	118.2	75%	0.753	78%	0.781	S	S	*	*			trans	-102.7	135.3	-174.9	0	0	0	0	0	113.4
413	S	37.7	Very low	44.2	Very low	121 Å²	121	114.4 Å²	114.4	85%	0.846	76%	0.756	S	S	*	*			trans	-158.3	81.9	154.4	-168.8	0	0	0	0	109.2	G415	S413-G415 VanDerWaalsContact C-N 3.26Å; S413-G415 PolarHBondContact O-N 2.82Å
414	S	37.6	Very low	46.7	Very low	125 Å²	125	111.5 Å²	111.5	87%	0.874	72%	0.722	S	S	*	*			trans	-79.1	69.4	-174.7	54	0	0	0	0	111.7
415	G	44.1	Very low	48.9	Very low	80 Å²	80	115.2 Å²	115.2	83%	0.825	72%	0.722	S	S	*	*			trans	-101.6	-0	175.8	0	0	0	0	0	114.9	S413	S413-G415 VanDerWaalsContact C-N 3.26Å; S413-G415 PolarHBondContact O-N 2.82Å
416	G	45.7	Very low	51.3	Low	60 Å²	60	112.9 Å²	112.9	62%	0.619	72%	0.718	S	S	*	*			trans	-145.7	106.2	-176	0	0	0	0	0	113.2
417	L	46.4	Very low	54	Low	164 Å²	164	109.8 Å²	109.8	86%	0.859	68%	0.684	S	S	*	*	S	Bend	trans	-129.4	2.5	166.7	-74.4	178.6	0	0	0	113.2
418	F	51.3	Low	56.5	Low	193 Å²	193	102.3 Å²	102.3	85%	0.846	65%	0.653	S	S	*	*	S	Bend	trans	-119	133.5	165.8	-72.5	-82.9	0	0	0	108.8
419	P	59.9	Low	59.4	Low	109 Å²	109	102.5 Å²	102.5	71%	0.708	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-61.8	151.6	162.8	29.7	-33.5	0	0	0	108.9
420	P	65.4	Low	62.2	Low	53 Å²	53	94.1 Å²	94.1	34%	0.344	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-56.5	143.9	171.4	27.5	-35.6	0	0	0	109.3	A486	P420-A486 HydrophobicContact CB-CB 3.65Å
421	P	72.1	Confident	65.1	Low	60 Å²	60	89 Å²	89	39%	0.39	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-54.5	142.6	172.9	25	-33.7	0	0	0	108.9	H483	P421-H483 PolarHBondContact O-CE1 3.3Å; P421-H483 PolarHBondContact O-ND1 2.78Å
422	P	75.4	Confident	67.8	Low	116 Å²	116	83.9 Å²	83.9	75%	0.753	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-56.4	146.4	-176.6	23.8	-33.6	0	0	0	111
423	L	82.8	Confident	70.8	Confident	47 Å²	47	86.8 Å²	86.8	25%	0.246	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-64.4	142.8	168.9	-82.1	169.4	0	0	0	109	D425 L427 I435 H483	L423-D425 PolarHBondContact O-N 2.85Å; L423-L427 HydrophobicContact CB-CD1 4.48Å; L423-L427 HydrophobicContact CD2-CD1 4.14Å; L423-I435 HydrophobicContact CD1-CG2 4.43Å; L423-I435 HydrophobicContact CD2-CD1 4.04Å; L423-I435 HydrophobicContact CD2-CG2 4.32Å; L423-H483 HydrophobicContact CD2-CB 3.89Å; L423-H483 VanDerWaalsContact CD2-CD2 3.49Å; L423-H483 WeakPolarHBondContact CD2-CD2 3.44Å; L423-H483 VanDerWaalsContact CD2-CG 3.48Å
424	P	80.5	Confident	73.5	Confident	24 Å²	24	85 Å²	85	16%	0.156	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-52.4	135.4	168.6	-28.3	35.4	0	0	0	111.9	L427 I476 D479 I480	P424-L427 HydrophobicContact CB-CD1 4.34Å; P424-L427 HydrophobicContact CB-CD2 4.45Å; P424-L427 HydrophobicContact CB-CG 4.24Å; P424-L427 WeakPolarHBondContact O-CG 3.32Å; P424-I476 HydrophobicContact CB-CG2 4.15Å; P424-I476 HydrophobicContact CG-CG2 4.25Å; P424-D479 HydrophobicContact CG-CB 3.59Å; P424-I480 HydrophobicContact CG-CG1 4.45Å
425	D	74.8	Confident	76.2	Confident	163 Å²	163	79.1 Å²	79.1	87%	0.872	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	149.8	172.5	-70.4	-56.3	0	0	0	111	L423	L423-D425 PolarHBondContact O-N 2.85Å
426	G	80.5	Confident	78.6	Confident	83 Å²	83	78.9 Å²	78.9	86%	0.856	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	6.5	176.1	0	0	0	0	0	116.3
427	L	86	Confident	80.9	Confident	13 Å²	13	78.8 Å²	78.8	7%	0.068	45%	0.452	C	S	.	.			trans	-60.7	145.9	175.3	-69.4	176.6	0	0	0	112.9	L423 P424 A429 L431 I432 I476 I480	L423-L427 HydrophobicContact CB-CD1 4.48Å; L423-L427 HydrophobicContact CD2-CD1 4.14Å; P424-L427 HydrophobicContact CB-CD1 4.34Å; P424-L427 HydrophobicContact CB-CD2 4.45Å; P424-L427 HydrophobicContact CB-CG 4.24Å; P424-L427 WeakPolarHBondContact O-CG 3.32Å; L427-A429 PolarHBondContact O-N 3.13Å; L427-L431 HydrophobicContact CD2-CD2 4.39Å; L427-I432 HydrophobicContact CB-CD1 3.96Å; L427-I432 HydrophobicContact CB-CG1 3.67Å; L427-I432 WeakPolarHBondContact O-CD1 3.27Å; L427-I476 HydrophobicContact CD2-CG2 3.52Å; L427-I480 HydrophobicContact CD1-CD1 4.12Å; L427-I480 HydrophobicContact CD1-CG1 4Å; L427-I480 HydrophobicContact CD2-CD1 3.7Å; L427-I480 HydrophobicContact CD2-CG1 4.33Å
428	P	87.9	Confident	83.2	Confident	49 Å²	49	71 Å²	71	32%	0.318	41%	0.411	S	S	.	.			trans	-64.5	133.7	177.5	24	-31.2	0	0	0	111.3	P430 L431 I432	P428-P430 VanDerWaalsContact C-CD 3.43Å; P428-P430 VanDerWaalsContact C-N 3.35Å; P428-L431 HydrophobicContact CG-CB 3.96Å; P428-L431 HydrophobicContact CG-CD2 4.19Å; P428-L431 WeakPolarHBondContact O-CA 3.5Å; P428-L431 WeakPolarHBondContact O-CB 3.34Å; P428-L431 PolarHBondContact O-N 2.93Å; P428-I432 PolarHBondContact O-N 3.35Å; P428-I432 VanDerWaalsContact O-N 3.16Å
429	A	88.8	Confident	85.2	Confident	73 Å²	73	64.1 Å²	64.1	60%	0.603	38%	0.38	S	S	*	.	H	α-helix	trans	-54.3	-36.1	-174.1	0	0	0	0	0	115.5	L427 L431 I432 K433	L427-A429 PolarHBondContact O-N 3.13Å; A429-L431 VanDerWaalsContact C-N 3.28Å; A429-L431 PolarHBondContact O-N 3.11Å; A429-I432 PolarHBondContact O-N 3.04Å; A429-K433 WeakPolarHBondContact O-CB 3.25Å; A429-K433 PolarHBondContact O-N 3.12Å
430	P	91.3	Very high	86.8	Confident	83 Å²	83	62.2 Å²	62.2	54%	0.539	37%	0.366	S	S	.	.	H	α-helix	trans	-60.6	-33.4	172.8	-26.4	37.3	0	0	0	114.1	P428 R434 Q468	P428-P430 VanDerWaalsContact C-CD 3.43Å; P428-P430 VanDerWaalsContact C-N 3.35Å; P430-R434 VanDerWaalsContact O-CG 3.25Å; P430-R434 WeakPolarHBondContact O-CG 3.42Å; P430-R434 PolarHBondContact O-N 2.92Å; P430-R434 VanDerWaalsContact O-N 3.13Å; P430-Q468 VanDerWaalsContact C-OE1 3.26Å
431	L	93	Very high	88	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-76.3	-45.6	178.1	174.6	52.4	0	0	0	111	L427 P428 A429 K433 R434 I435 I465 Q468 V469 Q472 I480	L427-L431 HydrophobicContact CD2-CD2 4.39Å; P428-L431 HydrophobicContact CG-CB 3.96Å; P428-L431 HydrophobicContact CG-CD2 4.19Å; P428-L431 WeakPolarHBondContact O-CA 3.5Å; P428-L431 WeakPolarHBondContact O-CB 3.34Å; P428-L431 PolarHBondContact O-N 2.93Å; A429-L431 VanDerWaalsContact C-N 3.28Å; A429-L431 PolarHBondContact O-N 3.11Å; L431-K433 VanDerWaalsContact C-N 3.29Å; L431-K433 PolarHBondContact O-N 3.45Å; L431-R434 PolarHBondContact O-N 2.99Å; L431-R434 VanDerWaalsContact O-N 3.1Å; L431-I435 HydrophobicContact CD1-CD1 3.86Å; L431-I435 HydrophobicContact CD1-CG1 4.12Å; L431-I435 HydrophobicContact CG-CD1 4.02Å; L431-I435 WeakPolarHBondContact O-CG1 3.24Å; L431-I435 PolarHBondContact O-N 3.24Å; L431-I465 HydrophobicContact CD1-CB 4.48Å; L431-I465 HydrophobicContact CD1-CG1 4.47Å; L431-I465 HydrophobicContact CD1-CG2 4.01Å; L431-Q468 HydrophobicContact CB-CB 4.23Å; L431-Q468 HydrophobicContact CD1-CB 4.08Å; L431-Q468 HydrophobicContact CD2-CB 4.31Å; L431-Q468 HydrophobicContact CG-CB 4.44Å; L431-Q468 VanDerWaalsContact N-OE1 3.13Å; L431-V469 HydrophobicContact CD1-CG2 3.7Å; L431-V469 HydrophobicContact CD2-CG2 4.02Å; L431-V469 HydrophobicContact CG-CG2 4.49Å; L431-Q472 HydrophobicContact CD2-CG 4.28Å; L431-I480 HydrophobicContact CD2-CD1 4.04Å
432	I	92.3	Very high	88.9	Confident	73 Å²	73	58 Å²	58	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-54.7	-48.3	173.1	-60.3	175.5	0	0	0	110	L427 P428 A429 R434 I435 E436	L427-I432 HydrophobicContact CB-CD1 3.96Å; L427-I432 HydrophobicContact CB-CG1 3.67Å; L427-I432 WeakPolarHBondContact O-CD1 3.27Å; P428-I432 PolarHBondContact O-N 3.35Å; P428-I432 VanDerWaalsContact O-N 3.16Å; A429-I432 PolarHBondContact O-N 3.04Å; I432-R434 VanDerWaalsContact C-N 3.33Å; I432-R434 PolarHBondContact O-N 2.97Å; I432-I435 PolarHBondContact O-N 3.29Å; I432-E436 PolarHBondContact O-N 2.72Å
433	K	94.5	Very high	89.5	Confident	134 Å²	134	60 Å²	60	58%	0.583	33%	0.333	S	S	*	.	H	α-helix	trans	-56.3	-47.2	176.8	-179.1	-179.2	173.5	-179.3	0	111.3	A429 L431 I435 E436 D437	A429-K433 WeakPolarHBondContact O-CB 3.25Å; A429-K433 PolarHBondContact O-N 3.12Å; L431-K433 VanDerWaalsContact C-N 3.29Å; L431-K433 PolarHBondContact O-N 3.45Å; K433-I435 VanDerWaalsContact C-N 3.33Å; K433-I435 PolarHBondContact O-N 3.46Å; K433-E436 CarbonylContact O-C 3.56Å; K433-E436 PolarHBondContact O-N 3.07Å; K433-E436 VanDerWaalsContact O-N 3.12Å; K433-D437 VanDerWaalsContact O-CG 3.29Å; K433-D437 PolarHBondContact O-N 3.21Å
434	R	94.4	Very high	89.7	Confident	83 Å²	83	62.6 Å²	62.6	31%	0.313	34%	0.344	S	S	.	.	H	α-helix	trans	-67.5	-32.2	-177.4	-73.5	-74.4	-179.7	80	-41.1	113.3	P430 L431 I432 D437 L438 I461 D464 I465	P430-R434 VanDerWaalsContact O-CG 3.25Å; P430-R434 WeakPolarHBondContact O-CG 3.42Å; P430-R434 PolarHBondContact O-N 2.92Å; P430-R434 VanDerWaalsContact O-N 3.13Å; L431-R434 PolarHBondContact O-N 2.99Å; L431-R434 VanDerWaalsContact O-N 3.1Å; I432-R434 VanDerWaalsContact C-N 3.33Å; I432-R434 PolarHBondContact O-N 2.97Å; R434-D437 IonicContact NE-OD2 3.78Å; R434-D437 PolarHBondContact O-N 2.83Å; R434-L438 WeakPolarHBondContact O-CB 3.19Å; R434-L438 PolarHBondContact O-N 3.42Å; R434-I461 WeakPolarHBondContact O-CG2 3.25Å; R434-D464 IonicContact CZ-OD2 3.76Å; R434-D464 VanDerWaalsContact NH1-CB 3.31Å; R434-D464 IonicContact NH1-OD2 3.99Å; R434-D464 PolarHBondContact NH1-OD2 3.43Å; R434-D464 IonicContact NH2-OD2 2.75Å; R434-D464 PolarHBondContact NH2-OD2 3.44Å; R434-I465 HydrophobicContact CB-CG1 3.83Å
435	I	94.1	Very high	89.9	Confident	1 Å²	1	62 Å²	62	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-66.2	-37.8	171.4	-64.7	163.2	0	0	0	110.8	L423 L431 I432 K433 L438 R439 I465 I480 F487	L423-I435 HydrophobicContact CD1-CG2 4.43Å; L423-I435 HydrophobicContact CD2-CD1 4.04Å; L423-I435 HydrophobicContact CD2-CG2 4.32Å; L431-I435 HydrophobicContact CD1-CD1 3.86Å; L431-I435 HydrophobicContact CD1-CG1 4.12Å; L431-I435 HydrophobicContact CG-CD1 4.02Å; L431-I435 WeakPolarHBondContact O-CG1 3.24Å; L431-I435 PolarHBondContact O-N 3.24Å; I432-I435 PolarHBondContact O-N 3.29Å; K433-I435 VanDerWaalsContact C-N 3.33Å; K433-I435 PolarHBondContact O-N 3.46Å; I435-L438 WeakPolarHBondContact O-CB 3.18Å; I435-L438 PolarHBondContact O-N 3.34Å; I435-R439 WeakPolarHBondContact O-CB 3.4Å; I435-R439 PolarHBondContact O-N 3.19Å; I435-I465 HydrophobicContact CG1-CD1 4.2Å; I435-I465 HydrophobicContact CG1-CG1 4.36Å; I435-I465 HydrophobicContact CG1-CG2 4.48Å; I435-I480 HydrophobicContact CD1-CG2 3.78Å; I435-I480 HydrophobicContact CG1-CG2 4.49Å; I435-F487 HydrophobicContact CG2-CZ 4.04Å
436	E	93.8	Very high	90.2	Very high	75 Å²	75	59.5 Å²	59.5	35%	0.35	33%	0.326	S	S	.	.	H	α-helix	trans	-75.6	-34.6	175	-168.2	58.3	-137.6	0	0	113	I432 K433 L438 R439 T440	I432-E436 PolarHBondContact O-N 2.72Å; K433-E436 CarbonylContact O-C 3.56Å; K433-E436 PolarHBondContact O-N 3.07Å; K433-E436 VanDerWaalsContact O-N 3.12Å; E436-L438 VanDerWaalsContact C-N 3.28Å; E436-L438 PolarHBondContact O-N 2.92Å; E436-R439 PolarHBondContact O-N 3.11Å; E436-R439 WeakPolarHBondContact OE1-CD 3.35Å; E436-R439 IonicContact OE1-NH1 3.84Å; E436-R439 WeakPolarHBondContact OE2-CD 3.43Å; E436-R439 IonicContact OE2-CZ 3.68Å; E436-R439 VanDerWaalsContact OE2-CZ 3.3Å; E436-R439 IonicContact OE2-NE 2.73Å; E436-R439 IonicContact OE2-NH1 2.65Å; E436-R439 PolarHBondContact OE2-NH1 3.5Å; E436-T440 VanDerWaalsContact O-CB 3.32Å; E436-T440 WeakPolarHBondContact O-CB 3.42Å; E436-T440 PolarHBondContact O-N 2.64Å; E436-T440 PolarHBondContact O-OG1 3.42Å
437	D	94.6	Very high	90.2	Very high	58 Å²	58	62.5 Å²	62.5	31%	0.31	32%	0.318	S	S	.	.	H	α-helix	trans	-58	-44.2	168.9	-68	-30.1	0	0	0	109.3	K433 R434 T440 A441 I461	K433-D437 VanDerWaalsContact O-CG 3.29Å; K433-D437 PolarHBondContact O-N 3.21Å; R434-D437 IonicContact NE-OD2 3.78Å; R434-D437 PolarHBondContact O-N 2.83Å; D437-T440 PolarHBondContact O-N 3.47Å; D437-A441 VanDerWaalsContact O-CB 3.27Å; D437-A441 WeakPolarHBondContact O-CB 3.45Å; D437-A441 PolarHBondContact O-N 2.88Å; D437-I461 HydrophobicContact CB-CG2 4.46Å
438	L	94.5	Very high	89.9	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-45.1	175.2	-171.3	77.5	0	0	0	112.1	R434 I435 E436 T440 A441 S442 M458 I461 L462 I465 M484 F487 V488	R434-L438 WeakPolarHBondContact O-CB 3.19Å; R434-L438 PolarHBondContact O-N 3.42Å; I435-L438 WeakPolarHBondContact O-CB 3.18Å; I435-L438 PolarHBondContact O-N 3.34Å; E436-L438 VanDerWaalsContact C-N 3.28Å; E436-L438 PolarHBondContact O-N 2.92Å; L438-T440 VanDerWaalsContact C-N 3.33Å; L438-T440 PolarHBondContact O-N 3.13Å; L438-A441 PolarHBondContact O-N 2.81Å; L438-S442 VanDerWaalsContact O-CB 3.27Å; L438-S442 WeakPolarHBondContact O-CB 3.37Å; L438-S442 PolarHBondContact O-N 3.23Å; L438-M458 HydrophobicContact CD1-SD 3.44Å; L438-M458 WeakPolarHBondContact CD1-SD 3.44Å; L438-M458 HydrophobicContact CG-SD 4.41Å; L438-I461 HydrophobicContact CB-CG2 3.75Å; L438-I461 HydrophobicContact CD1-CB 4.09Å; L438-I461 HydrophobicContact CD1-CG2 3.83Å; L438-I461 HydrophobicContact CG-CG2 4.42Å; L438-L462 HydrophobicContact CD1-CD2 3.67Å; L438-L462 HydrophobicContact CD1-CG 3.75Å; L438-L462 HydrophobicContact CD2-CD2 3.67Å; L438-L462 HydrophobicContact CG-CD2 4.34Å; L438-I465 HydrophobicContact CB-CD1 3.94Å; L438-I465 HydrophobicContact CD2-CD1 3.78Å; L438-I465 HydrophobicContact CG-CD1 4.3Å; L438-M484 HydrophobicContact CD2-CE 3.74Å; L438-M484 HydrophobicContact CD2-CG 4.3Å; L438-F487 HydrophobicContact CB-CE2 4.25Å; L438-F487 HydrophobicContact CD2-CE2 3.83Å; L438-F487 HydrophobicContact CD2-CZ 4.4Å; L438-F487 HydrophobicContact CG-CE2 4.02Å; L438-V488 HydrophobicContact CD2-CG2 4.11Å
439	R	92.4	Very high	89.2	Confident	50 Å²	50	66.9 Å²	66.9	19%	0.189	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-42.6	177.4	-172.7	-168.8	-76.6	169.1	-11.2	111.2	I435 E436 S442 R443 H483 F487	I435-R439 WeakPolarHBondContact O-CB 3.4Å; I435-R439 PolarHBondContact O-N 3.19Å; E436-R439 PolarHBondContact O-N 3.11Å; E436-R439 WeakPolarHBondContact OE1-CD 3.35Å; E436-R439 IonicContact OE1-NH1 3.84Å; E436-R439 WeakPolarHBondContact OE2-CD 3.43Å; E436-R439 IonicContact OE2-CZ 3.68Å; E436-R439 VanDerWaalsContact OE2-CZ 3.3Å; E436-R439 IonicContact OE2-NE 2.73Å; E436-R439 IonicContact OE2-NH1 2.65Å; E436-R439 PolarHBondContact OE2-NH1 3.5Å; R439-S442 PolarHBondContact O-N 3.22Å; R439-R443 WeakPolarHBondContact O-CG 3.47Å; R439-R443 PolarHBondContact O-N 3.3Å; R439-H483 PolarHBondContact NH2-CE1 3.01Å; R439-H483 PolarHBondContact NH2-NE2 2.93Å; R439-F487 VanDerWaalsContact CA-CE2 3.45Å; R439-F487 HydrophobicContact CB-CD2 3.93Å; R439-F487 HydrophobicContact CB-CE1 4.46Å; R439-F487 HydrophobicContact CB-CE2 3.65Å; R439-F487 HydrophobicContact CB-CG 4.44Å; R439-F487 HydrophobicContact CB-CZ 3.94Å; R439-F487 HydrophobicContact CG-CD1 4.39Å; R439-F487 HydrophobicContact CG-CD2 4.1Å; R439-F487 HydrophobicContact CG-CE2 4.26Å; R439-F487 HydrophobicContact CG-CG 4.16Å; R439-F487 HydrophobicContact CG-CZ 4.47Å
440	T	93.3	Very high	88.5	Confident	68 Å²	68	69.6 Å²	69.6	42%	0.417	34%	0.344	S	S	.	.	H	α-helix	trans	-65.9	-49.2	177.4	-60.4	0	0	0	0	110.8	E436 D437 L438 S442 R443 Q444	E436-T440 VanDerWaalsContact O-CB 3.32Å; E436-T440 WeakPolarHBondContact O-CB 3.42Å; E436-T440 PolarHBondContact O-N 2.64Å; E436-T440 PolarHBondContact O-OG1 3.42Å; D437-T440 PolarHBondContact O-N 3.47Å; L438-T440 VanDerWaalsContact C-N 3.33Å; L438-T440 PolarHBondContact O-N 3.13Å; T440-S442 VanDerWaalsContact C-N 3.28Å; T440-S442 PolarHBondContact O-N 3.42Å; T440-R443 PolarHBondContact O-N 3.44Å; T440-Q444 WeakPolarHBondContact O-CG 3.19Å; T440-Q444 PolarHBondContact O-N 3.45Å
441	A	91.2	Very high	87.7	Confident	23 Å²	23	75.5 Å²	75.5	19%	0.19	36%	0.361	C	S	.	.	H	α-helix	trans	-59.5	-38.3	176.5	0	0	0	0	0	112.2	D437 L438 Q444 F445 M458 I461	D437-A441 VanDerWaalsContact O-CB 3.27Å; D437-A441 WeakPolarHBondContact O-CB 3.45Å; D437-A441 PolarHBondContact O-N 2.88Å; L438-A441 PolarHBondContact O-N 2.81Å; A441-Q444 PolarHBondContact O-N 2.82Å; A441-F445 VanDerWaalsContact O-CB 3.3Å; A441-F445 WeakPolarHBondContact O-CB 3.28Å; A441-F445 PolarHBondContact O-N 3.14Å; A441-M458 HydrophobicContact CB-CE 3.87Å; A441-M458 HydrophobicContact CB-SD 4.49Å; A441-I461 HydrophobicContact CB-CD1 4.07Å
442	S	90.8	Very high	87.2	Confident	3 Å²	3	83.8 Å²	83.8	2%	0.021	40%	0.397	C	S	.	.	H	α-helix	trans	-61.2	-52.7	174.5	179.4	0	0	0	0	111.6	L438 R439 T440 Q444 F445 D446 F453 F487	L438-S442 VanDerWaalsContact O-CB 3.27Å; L438-S442 WeakPolarHBondContact O-CB 3.37Å; L438-S442 PolarHBondContact O-N 3.23Å; R439-S442 PolarHBondContact O-N 3.22Å; T440-S442 VanDerWaalsContact C-N 3.28Å; T440-S442 PolarHBondContact O-N 3.42Å; S442-Q444 VanDerWaalsContact C-N 3.3Å; S442-Q444 PolarHBondContact O-N 3.1Å; S442-F445 WeakPolarHBondContact O-CB 3.46Å; S442-F445 PolarHBondContact O-N 3.47Å; S442-D446 PolarHBondContact O-N 3.06Å; S442-F453 WeakPolarHBondContact OG-CE2 3.3Å; S442-F487 WeakPolarHBondContact CB-O 3.09Å; S442-F487 PolarHBondContact OG-O 3.4Å
443	R	89	Confident	87	Confident	157 Å²	157	81 Å²	81	59%	0.592	38%	0.382	S	S	*	.	H	α-helix	trans	-60	-36.9	177.7	-70.4	-177.3	-174.5	-69	2.8	113	R439 T440 Q447	R439-R443 WeakPolarHBondContact O-CG 3.47Å; R439-R443 PolarHBondContact O-N 3.3Å; T440-R443 PolarHBondContact O-N 3.44Å; R443-Q447 WeakPolarHBondContact O-CG 3.19Å; R443-Q447 PolarHBondContact O-N 3.08Å; R443-Q447 PolarHBondContact O-NE2 3.34Å
444	Q	86.1	Confident	86.8	Confident	102 Å²	102	77.1 Å²	77.1	48%	0.477	37%	0.366	S	S	.	.	H	α-helix	trans	-65.6	-44.5	174	-68.9	-62.9	-36.5	0	0	110.9	T440 A441 S442 D446 Q447 E448	T440-Q444 WeakPolarHBondContact O-CG 3.19Å; T440-Q444 PolarHBondContact O-N 3.45Å; A441-Q444 PolarHBondContact O-N 2.82Å; S442-Q444 VanDerWaalsContact C-N 3.3Å; S442-Q444 PolarHBondContact O-N 3.1Å; Q444-D446 VanDerWaalsContact C-N 3.34Å; Q444-D446 PolarHBondContact O-N 3.29Å; Q444-Q447 WeakPolarHBondContact O-CB 3.28Å; Q444-Q447 PolarHBondContact O-N 3.24Å; Q444-Q447 VanDerWaalsContact O-N 3.13Å; Q444-E448 WeakPolarHBondContact O-CG 3.34Å; Q444-E448 PolarHBondContact O-N 3.49Å; Q444-E448 VanDerWaalsContact O-N 3.11Å
445	F	85.4	Confident	86.6	Confident	10 Å²	10	75.1 Å²	75.1	4%	0.044	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-40.7	-178.9	-169	-85.3	0	0	0	113.4	A441 S442 E448 G449 R450 K452 F453 T455	A441-F445 VanDerWaalsContact O-CB 3.3Å; A441-F445 WeakPolarHBondContact O-CB 3.28Å; A441-F445 PolarHBondContact O-N 3.14Å; S442-F445 WeakPolarHBondContact O-CB 3.46Å; S442-F445 PolarHBondContact O-N 3.47Å; F445-E448 WeakPolarHBondContact CA-OE2 2.93Å; F445-E448 PolarHBondContact O-N 3.48Å; F445-G449 PolarHBondContact O-N 3.01Å; F445-R450 HydrophobicContact CD2-CB 4.13Å; F445-R450 HydrophobicContact CE1-CB 3.89Å; F445-R450 WeakPolarHBondContact CE1-O 3.43Å; F445-R450 HydrophobicContact CE2-CB 3.41Å; F445-R450 VanDerWaalsContact CE2-CB 3.41Å; F445-R450 HydrophobicContact CE2-CG 4.35Å; F445-R450 HydrophobicContact CZ-CB 3.23Å; F445-R450 WeakPolarHBondContact CZ-O 3.4Å; F445-K452 WeakPolarHBondContact CE2-O 3.49Å; F445-K452 WeakPolarHBondContact CZ-O 3.44Å; F445-F453 HydrophobicContact CB-CD2 4.45Å; F445-F453 HydrophobicContact CD1-CB 4.27Å; F445-F453 AromaticContact CD1-CD2 3.69Å; F445-F453 HydrophobicContact CD1-CD2 3.69Å; F445-F453 HydrophobicContact CD1-CG 4.4Å; F445-F453 HydrophobicContact CE1-CB 3.99Å; F445-F453 HydrophobicContact CE1-CD2 4.27Å; F445-F453 HydrophobicContact CG-CD2 4.13Å; F445-F453 HydrophobicContact CZ-CB 4.47Å; F445-F453 VanDerWaalsContact CZ-N 3.26Å; F445-T455 HydrophobicContact CD2-CG2 4.3Å; F445-T455 HydrophobicContact CE2-CG2 3.74Å
446	D	81.3	Confident	86.4	Confident	112 Å²	112	81.4 Å²	81.4	60%	0.599	40%	0.395	S	S	*	.	H	α-helix	trans	-63	-42.5	174.7	-73.6	-20	0	0	0	112.1	S442 Q444 E448 G449	S442-D446 PolarHBondContact O-N 3.06Å; Q444-D446 VanDerWaalsContact C-N 3.34Å; Q444-D446 PolarHBondContact O-N 3.29Å; D446-E448 VanDerWaalsContact C-N 3.32Å; D446-E448 PolarHBondContact O-N 2.86Å; D446-G449 PolarHBondContact O-N 3.44Å
447	Q	80.1	Confident	86.2	Confident	145 Å²	145	82.8 Å²	82.8	68%	0.678	41%	0.405	S	S	*	.	H	α-helix	trans	-65.4	-32.2	179	-73.6	169.2	86.8	0	0	112.9	R443 Q444 G449	R443-Q447 WeakPolarHBondContact O-CG 3.19Å; R443-Q447 PolarHBondContact O-N 3.08Å; R443-Q447 PolarHBondContact O-NE2 3.34Å; Q444-Q447 WeakPolarHBondContact O-CB 3.28Å; Q444-Q447 PolarHBondContact O-N 3.24Å; Q444-Q447 VanDerWaalsContact O-N 3.13Å; Q447-G449 VanDerWaalsContact C-N 3.29Å; Q447-G449 PolarHBondContact O-N 2.93Å
448	E	79.3	Confident	86.1	Confident	96 Å²	96	80.2 Å²	80.2	45%	0.449	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.9	178.4	-62.2	165.6	105.9	0	0	113.7	Q444 F445 D446 R450	Q444-E448 WeakPolarHBondContact O-CG 3.34Å; Q444-E448 PolarHBondContact O-N 3.49Å; Q444-E448 VanDerWaalsContact O-N 3.11Å; F445-E448 WeakPolarHBondContact CA-OE2 2.93Å; F445-E448 PolarHBondContact O-N 3.48Å; D446-E448 VanDerWaalsContact C-N 3.32Å; D446-E448 PolarHBondContact O-N 2.86Å; E448-R450 HydrophobicContact CB-CG 3.78Å; E448-R450 VanDerWaalsContact CD-CZ 3.42Å; E448-R450 VanDerWaalsContact CD-NH2 3.25Å; E448-R450 PolarHBondContact O-N 3.4Å; E448-R450 VanDerWaalsContact O-N 3.13Å; E448-R450 IonicContact OE1-CZ 2.9Å; E448-R450 IonicContact OE1-NE 2.67Å; E448-R450 PolarHBondContact OE1-NE 3.46Å; E448-R450 IonicContact OE1-NH1 2.58Å; E448-R450 IonicContact OE1-NH2 2.84Å; E448-R450 PolarHBondContact OE1-NH2 2.78Å; E448-R450 IonicContact OE2-CZ 3.86Å; E448-R450 IonicContact OE2-NE 3.58Å; E448-R450 PolarHBondContact OE2-NE 3.19Å; E448-R450 IonicContact OE2-NH2 3.3Å; E448-R450 PolarHBondContact OE2-NH2 3.31Å
449	G	73.1	Confident	86	Confident	58 Å²	58	81.1 Å²	81.1	60%	0.598	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	21.9	-179.7	0	0	0	0	0	114.5	F445 D446 Q447	F445-G449 PolarHBondContact O-N 3.01Å; D446-G449 PolarHBondContact O-N 3.44Å; Q447-G449 VanDerWaalsContact C-N 3.29Å; Q447-G449 PolarHBondContact O-N 2.93Å
450	R	73.4	Confident	86	Confident	131 Å²	131	82.2 Å²	82.2	49%	0.494	41%	0.406	S	S	.	.			trans	-70	136.7	-175.4	-69.3	-164.6	-75.8	-177.5	-2.4	109.9	F445 E448 K452	F445-R450 HydrophobicContact CD2-CB 4.13Å; F445-R450 HydrophobicContact CE1-CB 3.89Å; F445-R450 WeakPolarHBondContact CE1-O 3.43Å; F445-R450 HydrophobicContact CE2-CB 3.41Å; F445-R450 VanDerWaalsContact CE2-CB 3.41Å; F445-R450 HydrophobicContact CE2-CG 4.35Å; F445-R450 HydrophobicContact CZ-CB 3.23Å; F445-R450 WeakPolarHBondContact CZ-O 3.4Å; E448-R450 HydrophobicContact CB-CG 3.78Å; E448-R450 VanDerWaalsContact CD-CZ 3.42Å; E448-R450 VanDerWaalsContact CD-NH2 3.25Å; E448-R450 PolarHBondContact O-N 3.4Å; E448-R450 VanDerWaalsContact O-N 3.13Å; E448-R450 IonicContact OE1-CZ 2.9Å; E448-R450 IonicContact OE1-NE 2.67Å; E448-R450 PolarHBondContact OE1-NE 3.46Å; E448-R450 IonicContact OE1-NH1 2.58Å; E448-R450 IonicContact OE1-NH2 2.84Å; E448-R450 PolarHBondContact OE1-NH2 2.78Å; E448-R450 IonicContact OE2-CZ 3.86Å; E448-R450 IonicContact OE2-NE 3.58Å; E448-R450 PolarHBondContact OE2-NE 3.19Å; E448-R450 IonicContact OE2-NH2 3.3Å; E448-R450 PolarHBondContact OE2-NH2 3.31Å; R450-K452 PolarHBondContact O-N 2.83Å
451	K	75.1	Confident	86	Confident	206 Å²	206	80 Å²	80	90%	0.896	39%	0.391	S	S	*	.	S	Bend	trans	-89.1	16.1	-169.4	-61.3	-168.8	177.6	-173.3	0	116.1
452	K	83.3	Confident	86.1	Confident	175 Å²	175	79 Å²	79	76%	0.761	38%	0.382	S	S	*	.			trans	-151.2	79.5	-174.4	-68.4	-172.9	179.2	-179.5	0	112.2	F445 R450 F454	F445-K452 WeakPolarHBondContact CE2-O 3.49Å; F445-K452 WeakPolarHBondContact CZ-O 3.44Å; R450-K452 PolarHBondContact O-N 2.83Å; K452-F454 VanDerWaalsContact C-N 3.29Å; K452-F454 PolarHBondContact O-N 3.4Å
453	F	86.9	Confident	86.1	Confident	14 Å²	14	79.8 Å²	79.8	6%	0.061	39%	0.387	C	S	.	.	S	Bend	trans	-47.8	-46.8	-175.3	-175.3	-92.4	0	0	0	114.2	S442 F445 T455 M458 V488 P489	S442-F453 WeakPolarHBondContact OG-CE2 3.3Å; F445-F453 HydrophobicContact CB-CD2 4.45Å; F445-F453 HydrophobicContact CD1-CB 4.27Å; F445-F453 AromaticContact CD1-CD2 3.69Å; F445-F453 HydrophobicContact CD1-CD2 3.69Å; F445-F453 HydrophobicContact CD1-CG 4.4Å; F445-F453 HydrophobicContact CE1-CB 3.99Å; F445-F453 HydrophobicContact CE1-CD2 4.27Å; F445-F453 HydrophobicContact CG-CD2 4.13Å; F445-F453 HydrophobicContact CZ-CB 4.47Å; F445-F453 VanDerWaalsContact CZ-N 3.26Å; F453-T455 PolarHBondContact O-N 2.85Å; F453-M458 HydrophobicContact CD1-CE 4.45Å; F453-M458 HydrophobicContact CD1-CG 3.87Å; F453-M458 HydrophobicContact CD1-SD 4.4Å; F453-M458 HydrophobicContact CD2-CE 4.39Å; F453-M458 HydrophobicContact CE1-CE 3.86Å; F453-M458 HydrophobicContact CE1-CG 3.51Å; F453-M458 HydrophobicContact CE1-SD 3.54Å; F453-M458 VanDerWaalsContact CE1-SD 3.54Å; F453-M458 HydrophobicContact CE2-CE 3.81Å; F453-M458 HydrophobicContact CE2-SD 4.48Å; F453-M458 HydrophobicContact CZ-CE 3.51Å; F453-M458 HydrophobicContact CZ-CG 4.17Å; F453-M458 HydrophobicContact CZ-SD 3.61Å; F453-M458 WeakPolarHBondContact O-CB 3.43Å; F453-V488 HydrophobicContact CD1-CG1 4.45Å; F453-V488 HydrophobicContact CE1-CB 4.46Å; F453-V488 HydrophobicContact CE1-CG1 3.86Å; F453-V488 HydrophobicContact CE1-CG2 4.32Å; F453-V488 HydrophobicContact CZ-CG1 4.41Å; F453-V488 HydrophobicContact CZ-CG2 4.29Å; F453-P489 HydrophobicContact CB-CG 3.6Å; F453-P489 HydrophobicContact CD1-CG 3.85Å; F453-P489 VanDerWaalsContact CD2-CD 3.42Å; F453-P489 HydrophobicContact CD2-CG 3.41Å; F453-P489 VanDerWaalsContact CD2-CG 3.41Å; F453-P489 HydrophobicContact CE1-CG 4.38Å; F453-P489 VanDerWaalsContact CE2-CD 3.42Å; F453-P489 HydrophobicContact CE2-CG 3.97Å; F453-P489 HydrophobicContact CG-CG 3.33Å; F453-P489 HydrophobicContact CZ-CG 4.43Å
454	F	90.3	Very high	86.2	Confident	53 Å²	53	74.8 Å²	74.8	23%	0.232	37%	0.372	C	S	.	.			trans	-79	61.5	-177	-54.1	-73.2	0	0	0	113.4	K452 N459 L462 V488 C490 R498	K452-F454 VanDerWaalsContact C-N 3.29Å; K452-F454 PolarHBondContact O-N 3.4Å; F454-N459 PolarHBondContact O-ND2 3.09Å; F454-L462 HydrophobicContact CD1-CD1 3.84Å; F454-L462 HydrophobicContact CE1-CD1 3.96Å; F454-V488 HydrophobicContact CE1-CG1 3.96Å; F454-V488 HydrophobicContact CZ-CG1 4.03Å; F454-C490 HydrophobicContact CZ-CB 4.11Å; F454-R498 VanDerWaalsContact CB-NH2 3.31Å; F454-R498 VanDerWaalsContact CG-NE 3.33Å
455	T	91.1	Very high	86.5	Confident	41 Å²	41	70 Å²	70	25%	0.252	35%	0.349	S	S	.	.			trans	-58.9	164.1	166.2	65.9	0	0	0	0	111	F445 F453 D457 M458 N459	F445-T455 HydrophobicContact CD2-CG2 4.3Å; F445-T455 HydrophobicContact CE2-CG2 3.74Å; F453-T455 PolarHBondContact O-N 2.85Å; T455-D457 PolarHBondContact O-N 3.37Å; T455-M458 PolarHBondContact O-N 3.11Å; T455-M458 WeakPolarHBondContact OG1-CB 3.49Å; T455-M458 PolarHBondContact OG1-N 3.06Å; T455-M458 VanDerWaalsContact OG1-N 3.11Å; T455-N459 VanDerWaalsContact O-CG 3.24Å; T455-N459 PolarHBondContact O-N 3.12Å; T455-N459 PolarHBondContact O-ND2 3.31Å
456	L	89.6	Confident	86.8	Confident	132 Å²	132	70 Å²	70	69%	0.691	35%	0.349	S	S	*	.	H	α-helix	trans	-55	-44.2	175.4	178.3	59.7	0	0	0	111.4	N459 N460	L456-N459 WeakPolarHBondContact O-CB 3.49Å; L456-N459 PolarHBondContact O-N 2.94Å; L456-N460 PolarHBondContact O-N 2.99Å; L456-N460 PolarHBondContact O-OD1 3.12Å
457	D	90.4	Very high	87.1	Confident	105 Å²	105	67.3 Å²	67.3	56%	0.561	34%	0.335	S	S	*	.	H	α-helix	trans	-58.4	-51.5	177.2	-169.6	42	0	0	0	112.4	T455 N459 N460 I461	T455-D457 PolarHBondContact O-N 3.37Å; D457-N459 VanDerWaalsContact C-N 3.28Å; D457-N459 PolarHBondContact O-N 3.03Å; D457-N460 WeakPolarHBondContact O-CB 3.38Å; D457-N460 PolarHBondContact O-N 3.45Å; D457-I461 PolarHBondContact O-N 3.26Å
458	M	91.3	Very high	87.4	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.02	31%	0.311	C	S	.	.	H	α-helix	trans	-58.7	-38.6	174.5	-170.3	67.1	68.3	0	0	112.2	L438 A441 F453 T455 L462	L438-M458 HydrophobicContact CD1-SD 3.44Å; L438-M458 WeakPolarHBondContact CD1-SD 3.44Å; L438-M458 HydrophobicContact CG-SD 4.41Å; A441-M458 HydrophobicContact CB-CE 3.87Å; A441-M458 HydrophobicContact CB-SD 4.49Å; F453-M458 HydrophobicContact CD1-CE 4.45Å; F453-M458 HydrophobicContact CD1-CG 3.87Å; F453-M458 HydrophobicContact CD1-SD 4.4Å; F453-M458 HydrophobicContact CD2-CE 4.39Å; F453-M458 HydrophobicContact CE1-CE 3.86Å; F453-M458 HydrophobicContact CE1-CG 3.51Å; F453-M458 HydrophobicContact CE1-SD 3.54Å; F453-M458 VanDerWaalsContact CE1-SD 3.54Å; F453-M458 HydrophobicContact CE2-CE 3.81Å; F453-M458 HydrophobicContact CE2-SD 4.48Å; F453-M458 HydrophobicContact CZ-CE 3.51Å; F453-M458 HydrophobicContact CZ-CG 4.17Å; F453-M458 HydrophobicContact CZ-SD 3.61Å; F453-M458 WeakPolarHBondContact O-CB 3.43Å; T455-M458 PolarHBondContact O-N 3.11Å; T455-M458 WeakPolarHBondContact OG1-CB 3.49Å; T455-M458 PolarHBondContact OG1-N 3.06Å; T455-M458 VanDerWaalsContact OG1-N 3.11Å; M458-L462 HydrophobicContact CG-CD1 4.32Å; M458-L462 WeakPolarHBondContact O-CB 3.38Å; M458-L462 WeakPolarHBondContact O-CG 3.47Å; M458-L462 PolarHBondContact O-N 2.91Å
459	N	92.3	Very high	87.9	Confident	18 Å²	18	57.8 Å²	57.8	10%	0.096	29%	0.29	C	S	.	.	H	α-helix	trans	-66.9	-35.7	175.5	-66.9	-53.8	0	0	0	112.2	F454 T455 L456 D457 L463 R498 L502	F454-N459 PolarHBondContact O-ND2 3.09Å; T455-N459 VanDerWaalsContact O-CG 3.24Å; T455-N459 PolarHBondContact O-N 3.12Å; T455-N459 PolarHBondContact O-ND2 3.31Å; L456-N459 WeakPolarHBondContact O-CB 3.49Å; L456-N459 PolarHBondContact O-N 2.94Å; D457-N459 VanDerWaalsContact C-N 3.28Å; D457-N459 PolarHBondContact O-N 3.03Å; N459-L463 WeakPolarHBondContact O-CB 3.22Å; N459-L463 PolarHBondContact O-N 3.02Å; N459-R498 PolarHBondContact ND2-NH2 3.15Å; N459-R498 PolarHBondContact OD1-NE 3.29Å; N459-R498 PolarHBondContact OD1-NH2 2.87Å; N459-L502 HydrophobicContact CB-CD1 4.1Å; N459-L502 HydrophobicContact CB-CD2 3.92Å
460	N	91.9	Very high	88.4	Confident	73 Å²	73	56.6 Å²	56.6	39%	0.39	27%	0.269	S	S	.	.	H	α-helix	trans	-66.7	-44.4	176.8	-63.4	-17.4	0	0	0	111.1	L456 D457 L463 D464	L456-N460 PolarHBondContact O-N 2.99Å; L456-N460 PolarHBondContact O-OD1 3.12Å; D457-N460 WeakPolarHBondContact O-CB 3.38Å; D457-N460 PolarHBondContact O-N 3.45Å; N460-L463 PolarHBondContact O-N 2.79Å; N460-D464 WeakPolarHBondContact O-CB 3.48Å; N460-D464 PolarHBondContact O-N 2.86Å
461	I	93.6	Very high	88.9	Confident	23 Å²	23	58 Å²	58	12%	0.118	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-45.7	176.9	-56.5	168.1	0	0	0	110.3	R434 D437 L438 A441 D457 L463 D464 I465	R434-I461 WeakPolarHBondContact O-CG2 3.25Å; D437-I461 HydrophobicContact CB-CG2 4.46Å; L438-I461 HydrophobicContact CB-CG2 3.75Å; L438-I461 HydrophobicContact CD1-CB 4.09Å; L438-I461 HydrophobicContact CD1-CG2 3.83Å; L438-I461 HydrophobicContact CG-CG2 4.42Å; A441-I461 HydrophobicContact CB-CD1 4.07Å; D457-I461 PolarHBondContact O-N 3.26Å; I461-L463 VanDerWaalsContact C-N 3.29Å; I461-L463 PolarHBondContact O-N 2.94Å; I461-D464 PolarHBondContact O-N 3.47Å; I461-I465 HydrophobicContact CG2-CD1 4.1Å; I461-I465 VanDerWaalsContact O-CG1 3.27Å; I461-I465 WeakPolarHBondContact O-CG1 3.42Å; I461-I465 PolarHBondContact O-N 3.22Å
462	L	93.4	Very high	89.4	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.2	-39.8	175	-74.8	172.7	0	0	0	112.9	L438 F454 M458 I465 E466 M484 L495 L499 L502	L438-L462 HydrophobicContact CD1-CD2 3.67Å; L438-L462 HydrophobicContact CD1-CG 3.75Å; L438-L462 HydrophobicContact CD2-CD2 3.67Å; L438-L462 HydrophobicContact CG-CD2 4.34Å; F454-L462 HydrophobicContact CD1-CD1 3.84Å; F454-L462 HydrophobicContact CE1-CD1 3.96Å; M458-L462 HydrophobicContact CG-CD1 4.32Å; M458-L462 WeakPolarHBondContact O-CB 3.38Å; M458-L462 WeakPolarHBondContact O-CG 3.47Å; M458-L462 PolarHBondContact O-N 2.91Å; L462-I465 PolarHBondContact O-N 3.12Å; L462-E466 PolarHBondContact O-N 3.32Å; L462-M484 HydrophobicContact CD2-CE 3.53Å; L462-L495 HydrophobicContact CD2-CD1 3.87Å; L462-L499 HydrophobicContact CB-CD2 3.84Å; L462-L499 HydrophobicContact CD2-CD2 4.22Å; L462-L499 WeakPolarHBondContact O-CD2 3.36Å; L462-L502 HydrophobicContact CB-CD1 4.22Å
463	L	91.1	Very high	89.4	Confident	21 Å²	21	44.7 Å²	44.7	11%	0.11	23%	0.23	C	C	.	.	H	α-helix	trans	-72.8	-41.8	-178.7	179.5	50.3	0	0	0	112.3	N459 N460 I461 I465 E466 L467 L502 I506	N459-L463 WeakPolarHBondContact O-CB 3.22Å; N459-L463 PolarHBondContact O-N 3.02Å; N460-L463 PolarHBondContact O-N 2.79Å; I461-L463 VanDerWaalsContact C-N 3.29Å; I461-L463 PolarHBondContact O-N 2.94Å; L463-I465 VanDerWaalsContact C-N 3.26Å; L463-I465 PolarHBondContact O-N 3.3Å; L463-E466 PolarHBondContact O-N 2.78Å; L463-L467 WeakPolarHBondContact O-CG 3.41Å; L463-L467 PolarHBondContact O-N 3.14Å; L463-L502 HydrophobicContact CB-CB 4.26Å; L463-L502 HydrophobicContact CD1-CB 3.81Å; L463-L502 HydrophobicContact CD2-CB 4.24Å; L463-L502 HydrophobicContact CG-CB 4.33Å; L463-I506 HydrophobicContact CD1-CD1 3.56Å; L463-I506 HydrophobicContact CD1-CG1 4.07Å; L463-I506 HydrophobicContact CD2-CD1 3.71Å; L463-I506 HydrophobicContact CD2-CG1 3.86Å; L463-I506 HydrophobicContact CG-CD1 3.67Å; L463-I506 HydrophobicContact CG-CG1 4.29Å
464	D	90.5	Very high	89.2	Confident	52 Å²	52	47.6 Å²	47.6	28%	0.278	25%	0.25	S	S	.	.	H	α-helix	trans	-67.2	-26.9	173.3	-84.3	20.9	0	0	0	112.6	R434 N460 I461 Q468	R434-D464 IonicContact CZ-OD2 3.76Å; R434-D464 VanDerWaalsContact NH1-CB 3.31Å; R434-D464 IonicContact NH1-OD2 3.99Å; R434-D464 PolarHBondContact NH1-OD2 3.43Å; R434-D464 IonicContact NH2-OD2 2.75Å; R434-D464 PolarHBondContact NH2-OD2 3.44Å; N460-D464 WeakPolarHBondContact O-CB 3.48Å; N460-D464 PolarHBondContact O-N 2.86Å; I461-D464 PolarHBondContact O-N 3.47Å; D464-Q468 PolarHBondContact O-NE2 2.99Å
465	I	93	Very high	89	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.1	-53.1	167.2	-70.2	164.8	0	0	0	109.5	L431 R434 I435 L438 I461 L462 L463 L467 Q468 V469 M484	L431-I465 HydrophobicContact CD1-CB 4.48Å; L431-I465 HydrophobicContact CD1-CG1 4.47Å; L431-I465 HydrophobicContact CD1-CG2 4.01Å; R434-I465 HydrophobicContact CB-CG1 3.83Å; I435-I465 HydrophobicContact CG1-CD1 4.2Å; I435-I465 HydrophobicContact CG1-CG1 4.36Å; I435-I465 HydrophobicContact CG1-CG2 4.48Å; L438-I465 HydrophobicContact CB-CD1 3.94Å; L438-I465 HydrophobicContact CD2-CD1 3.78Å; L438-I465 HydrophobicContact CG-CD1 4.3Å; I461-I465 HydrophobicContact CG2-CD1 4.1Å; I461-I465 VanDerWaalsContact O-CG1 3.27Å; I461-I465 WeakPolarHBondContact O-CG1 3.42Å; I461-I465 PolarHBondContact O-N 3.22Å; L462-I465 PolarHBondContact O-N 3.12Å; L463-I465 VanDerWaalsContact C-N 3.26Å; L463-I465 PolarHBondContact O-N 3.3Å; I465-L467 VanDerWaalsContact C-N 3.27Å; I465-L467 PolarHBondContact O-N 2.7Å; I465-Q468 PolarHBondContact O-N 3.28Å; I465-Q468 VanDerWaalsContact O-N 3.07Å; I465-V469 HydrophobicContact CG2-CG2 3.6Å; I465-V469 WeakPolarHBondContact O-CB 3.31Å; I465-V469 WeakPolarHBondContact O-CG2 3.25Å; I465-V469 PolarHBondContact O-N 2.88Å; I465-M484 HydrophobicContact CB-CE 4.46Å; I465-M484 HydrophobicContact CD1-CE 4.1Å; I465-M484 HydrophobicContact CG2-CE 3.84Å; I465-M484 HydrophobicContact CG2-SD 3.85Å
466	E	91.5	Very high	88.8	Confident	11 Å²	11	51.3 Å²	51.3	5%	0.051	27%	0.267	C	S	.	.	H	α-helix	trans	-51.7	-45.6	179.7	-177.4	71.6	161	0	0	111.9	L462 L463 Q468 V469 Q470 Y481 L499	L462-E466 PolarHBondContact O-N 3.32Å; L463-E466 PolarHBondContact O-N 2.78Å; E466-Q468 PolarHBondContact O-N 3.13Å; E466-V469 PolarHBondContact O-N 3.08Å; E466-Q470 WeakPolarHBondContact O-CB 3.36Å; E466-Q470 PolarHBondContact O-N 3.3Å; E466-Y481 VanDerWaalsContact OE2-CE1 3.31Å; E466-Y481 WeakPolarHBondContact OE2-CE1 3.33Å; E466-Y481 PolarHBondContact OE2-OH 2.91Å; E466-L499 HydrophobicContact CB-CB 4.39Å; E466-L499 HydrophobicContact CB-CD2 4.09Å; E466-L499 HydrophobicContact CG-CB 4.24Å
467	L	88.1	Confident	88.7	Confident	56 Å²	56	47.6 Å²	47.6	29%	0.293	24%	0.244	S	C	.	.	H	α-helix	trans	-59.8	-41.9	179	-70.2	171.1	0	0	0	113.2	L463 I465 I506 M596	L463-L467 WeakPolarHBondContact O-CG 3.41Å; L463-L467 PolarHBondContact O-N 3.14Å; I465-L467 VanDerWaalsContact C-N 3.27Å; I465-L467 PolarHBondContact O-N 2.7Å; L467-I506 HydrophobicContact CD1-CD1 3.91Å; L467-I506 HydrophobicContact CD2-CD1 4.44Å; L467-M596 HydrophobicContact CD2-SD 4.44Å
468	Q	86.8	Confident	88.6	Confident	40 Å²	40	44.9 Å²	44.9	19%	0.187	23%	0.233	C	C	.	.	H	α-helix	trans	-81.1	-29.6	179.2	-71.1	172.6	77.1	0	0	112.9	P430 L431 D464 I465 E466 Q470	P430-Q468 VanDerWaalsContact C-OE1 3.26Å; L431-Q468 HydrophobicContact CB-CB 4.23Å; L431-Q468 HydrophobicContact CD1-CB 4.08Å; L431-Q468 HydrophobicContact CD2-CB 4.31Å; L431-Q468 HydrophobicContact CG-CB 4.44Å; L431-Q468 VanDerWaalsContact N-OE1 3.13Å; D464-Q468 PolarHBondContact O-NE2 2.99Å; I465-Q468 PolarHBondContact O-N 3.28Å; I465-Q468 VanDerWaalsContact O-N 3.07Å; E466-Q468 PolarHBondContact O-N 3.13Å; Q468-Q470 VanDerWaalsContact C-N 3.34Å
469	V	89.4	Confident	88.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.6	-36.8	173.2	171.9	0	0	0	0	109.8	L431 I465 E466 E471 Q472 R477 I480 Y481	L431-V469 HydrophobicContact CD1-CG2 3.7Å; L431-V469 HydrophobicContact CD2-CG2 4.02Å; L431-V469 HydrophobicContact CG-CG2 4.49Å; I465-V469 HydrophobicContact CG2-CG2 3.6Å; I465-V469 WeakPolarHBondContact O-CB 3.31Å; I465-V469 WeakPolarHBondContact O-CG2 3.25Å; I465-V469 PolarHBondContact O-N 2.88Å; E466-V469 PolarHBondContact O-N 3.08Å; V469-E471 PolarHBondContact O-N 3.42Å; V469-E471 VanDerWaalsContact O-N 3.13Å; V469-Q472 VanDerWaalsContact O-CB 3.29Å; V469-Q472 WeakPolarHBondContact O-CB 3.34Å; V469-Q472 WeakPolarHBondContact O-CG 3.06Å; V469-Q472 PolarHBondContact O-N 2.94Å; V469-R477 HydrophobicContact CG1-CB 3.9Å; V469-R477 HydrophobicContact CG1-CG 3.57Å; V469-R477 WeakPolarHBondContact O-CD 3.45Å; V469-R477 WeakPolarHBondContact O-CG 3.33Å; V469-I480 HydrophobicContact CG1-CD1 4.41Å; V469-I480 HydrophobicContact CG2-CD1 3.92Å; V469-I480 HydrophobicContact CG2-CG2 3.84Å; V469-Y481 HydrophobicContact CG1-CE1 3.85Å; V469-Y481 HydrophobicContact CG1-CE2 4.25Å
470	Q	84.4	Confident	88.5	Confident	33 Å²	33	47.7 Å²	47.7	15%	0.154	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.3	-177.9	-173.5	159.5	5.7	0	0	114.3	E466 Q468 M596	E466-Q470 WeakPolarHBondContact O-CB 3.36Å; E466-Q470 PolarHBondContact O-N 3.3Å; Q468-Q470 VanDerWaalsContact C-N 3.34Å; Q470-M596 PolarHBondContact NE2-O 3.46Å
471	E	83.3	Confident	88.5	Confident	162 Å²	162	44.9 Å²	44.9	76%	0.757	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-11.7	172.5	-60.6	-177.4	158.3	0	0	113.7	V469	V469-E471 PolarHBondContact O-N 3.42Å; V469-E471 VanDerWaalsContact O-N 3.13Å
472	Q	85.1	Confident	88.4	Confident	38 Å²	38	45.5 Å²	45.5	18%	0.178	24%	0.238	C	C	.	.	S	Bend	trans	-89.6	154.2	-174.5	-52.6	-56.8	-50.9	0	0	113.3	L431 V469 I476 R477	L431-Q472 HydrophobicContact CD2-CG 4.28Å; V469-Q472 VanDerWaalsContact O-CB 3.29Å; V469-Q472 WeakPolarHBondContact O-CB 3.34Å; V469-Q472 WeakPolarHBondContact O-CG 3.06Å; V469-Q472 PolarHBondContact O-N 2.94Å; Q472-I476 HydrophobicContact CB-CB 4.46Å; Q472-I476 HydrophobicContact CB-CG2 4.16Å; Q472-R477 HydrophobicContact CB-CG 3.95Å; Q472-R477 WeakPolarHBondContact O-CD 3.46Å; Q472-R477 WeakPolarHBondContact O-CG 3.48Å; Q472-R477 PolarHBondContact O-NE 3.46Å
473	P	83.1	Confident	88.3	Confident	62 Å²	62	45.7 Å²	45.7	40%	0.403	24%	0.239	S	C	.	.			trans	-50.2	141.5	170.4	-28.5	35.7	0	0	0	113.1	E475 I476 R477	P473-E475 PolarHBondContact O-N 2.94Å; P473-E475 VanDerWaalsContact O-N 3.13Å; P473-I476 HydrophobicContact CB-CB 4.5Å; P473-I476 HydrophobicContact CB-CD1 4.39Å; P473-I476 HydrophobicContact CB-CG1 4.38Å; P473-I476 HydrophobicContact CG-CD1 4.08Å; P473-I476 PolarHBondContact O-N 3.4Å; P473-I476 VanDerWaalsContact O-N 3.1Å; P473-R477 WeakPolarHBondContact O-CG 3.34Å; P473-R477 PolarHBondContact O-N 2.89Å
474	P	82.2	Confident	88.3	Confident	75 Å²	75	44.7 Å²	44.7	49%	0.487	23%	0.234	S	C	.	.	H	α-helix	trans	-58.6	-28.5	-173.5	20.8	-29.5	0	0	0	114.4	S478	P474-S478 PolarHBondContact O-N 3.43Å; P474-S478 VanDerWaalsContact O-N 3.1Å
475	E	86.1	Confident	88.4	Confident	124 Å²	124	45.6 Å²	45.6	58%	0.579	24%	0.236	S	C	*	.	H	α-helix	trans	-63.2	-58.3	173.2	-59.2	68.9	-150.9	0	0	110	P473 R477 S478 D479	P473-E475 PolarHBondContact O-N 2.94Å; P473-E475 VanDerWaalsContact O-N 3.13Å; E475-R477 PolarHBondContact O-N 2.92Å; E475-S478 VanDerWaalsContact O-CB 3.31Å; E475-S478 WeakPolarHBondContact O-CB 3.48Å; E475-S478 PolarHBondContact O-N 3.4Å; E475-D479 PolarHBondContact O-N 3.47Å
476	I	87.1	Confident	88.1	Confident	49 Å²	49	48.4 Å²	48.4	25%	0.251	26%	0.26	S	S	.	.	H	α-helix	trans	-57.6	-38.7	178.4	-64.2	-177.9	0	0	0	110.9	P424 L427 Q472 P473 D479 I480	P424-I476 HydrophobicContact CB-CG2 4.15Å; P424-I476 HydrophobicContact CG-CG2 4.25Å; L427-I476 HydrophobicContact CD2-CG2 3.52Å; Q472-I476 HydrophobicContact CB-CB 4.46Å; Q472-I476 HydrophobicContact CB-CG2 4.16Å; P473-I476 HydrophobicContact CB-CB 4.5Å; P473-I476 HydrophobicContact CB-CD1 4.39Å; P473-I476 HydrophobicContact CB-CG1 4.38Å; P473-I476 HydrophobicContact CG-CD1 4.08Å; P473-I476 PolarHBondContact O-N 3.4Å; P473-I476 VanDerWaalsContact O-N 3.1Å; I476-D479 PolarHBondContact O-N 3.47Å; I476-I480 HydrophobicContact CG2-CD1 4.04Å; I476-I480 VanDerWaalsContact O-CG1 3.31Å; I476-I480 WeakPolarHBondContact O-CG1 3.11Å; I476-I480 PolarHBondContact O-N 3.12Å; I476-I480 VanDerWaalsContact O-N 3.07Å
477	R	89.3	Confident	88	Confident	54 Å²	54	49.2 Å²	49.2	20%	0.204	26%	0.263	C	S	.	.	H	α-helix	trans	-59.5	-47.5	173.6	-67.8	-166.7	-88.4	149.4	-3.7	112.3	V469 Q472 P473 E475 D479 I480 Y481	V469-R477 HydrophobicContact CG1-CB 3.9Å; V469-R477 HydrophobicContact CG1-CG 3.57Å; V469-R477 WeakPolarHBondContact O-CD 3.45Å; V469-R477 WeakPolarHBondContact O-CG 3.33Å; Q472-R477 HydrophobicContact CB-CG 3.95Å; Q472-R477 WeakPolarHBondContact O-CD 3.46Å; Q472-R477 WeakPolarHBondContact O-CG 3.48Å; Q472-R477 PolarHBondContact O-NE 3.46Å; P473-R477 WeakPolarHBondContact O-CG 3.34Å; P473-R477 PolarHBondContact O-N 2.89Å; E475-R477 PolarHBondContact O-N 2.92Å; R477-D479 VanDerWaalsContact C-N 3.25Å; R477-D479 PolarHBondContact O-N 2.71Å; R477-I480 PolarHBondContact O-N 2.81Å; R477-Y481 HydrophobicContact CB-CE2 3.97Å; R477-Y481 WeakPolarHBondContact O-CD2 3.43Å; R477-Y481 WeakPolarHBondContact O-CE2 3.24Å; R477-Y481 VanDerWaalsContact O-CG 3.31Å; R477-Y481 PolarHBondContact O-N 3.23Å; R477-Y481 VanDerWaalsContact O-N 3.09Å
478	S	88.3	Confident	88.1	Confident	48 Å²	48	47 Å²	47	34%	0.336	25%	0.252	S	S	.	.	H	α-helix	trans	-55.2	-43.4	177.2	171.1	0	0	0	0	111.7	P474 E475 Y481 S482 K492	P474-S478 PolarHBondContact O-N 3.43Å; P474-S478 VanDerWaalsContact O-N 3.1Å; E475-S478 VanDerWaalsContact O-CB 3.31Å; E475-S478 WeakPolarHBondContact O-CB 3.48Å; E475-S478 PolarHBondContact O-N 3.4Å; S478-Y481 PolarHBondContact O-N 3.05Å; S478-S482 PolarHBondContact O-N 3.35Å; S478-K492 WeakPolarHBondContact O-CE 3.43Å; S478-K492 PolarHBondContact O-NZ 2.94Å; S478-K492 PolarHBondContact OG-NZ 2.8Å
479	D	89.8	Confident	88.1	Confident	80 Å²	80	49 Å²	49	43%	0.428	27%	0.268	S	S	.	.	H	α-helix	trans	-71.8	-39.1	-175.3	-63.5	-19.6	0	0	0	111.8	P424 E475 I476 R477 Y481 S482 H483	P424-D479 HydrophobicContact CG-CB 3.59Å; E475-D479 PolarHBondContact O-N 3.47Å; I476-D479 PolarHBondContact O-N 3.47Å; R477-D479 VanDerWaalsContact C-N 3.25Å; R477-D479 PolarHBondContact O-N 2.71Å; D479-Y481 PolarHBondContact O-N 3.49Å; D479-S482 CarbonylContact O-C 3.58Å; D479-S482 WeakPolarHBondContact O-CB 3.21Å; D479-S482 PolarHBondContact O-N 3.09Å; D479-S482 VanDerWaalsContact O-N 3.15Å; D479-H483 PolarHBondContact O-N 3.4Å
480	I	91.8	Very high	88	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.2	-45.9	171.4	-64	165.8	0	0	0	111	P424 L427 L431 I435 V469 I476 R477 S482 H483 M484	P424-I480 HydrophobicContact CG-CG1 4.45Å; L427-I480 HydrophobicContact CD1-CD1 4.12Å; L427-I480 HydrophobicContact CD1-CG1 4Å; L427-I480 HydrophobicContact CD2-CD1 3.7Å; L427-I480 HydrophobicContact CD2-CG1 4.33Å; L431-I480 HydrophobicContact CD2-CD1 4.04Å; I435-I480 HydrophobicContact CD1-CG2 3.78Å; I435-I480 HydrophobicContact CG1-CG2 4.49Å; V469-I480 HydrophobicContact CG1-CD1 4.41Å; V469-I480 HydrophobicContact CG2-CD1 3.92Å; V469-I480 HydrophobicContact CG2-CG2 3.84Å; I476-I480 HydrophobicContact CG2-CD1 4.04Å; I476-I480 VanDerWaalsContact O-CG1 3.31Å; I476-I480 WeakPolarHBondContact O-CG1 3.11Å; I476-I480 PolarHBondContact O-N 3.12Å; I476-I480 VanDerWaalsContact O-N 3.07Å; R477-I480 PolarHBondContact O-N 2.81Å; I480-S482 VanDerWaalsContact C-N 3.28Å; I480-S482 PolarHBondContact O-N 3.12Å; I480-H483 WeakPolarHBondContact O-CB 3.21Å; I480-H483 PolarHBondContact O-N 3.29Å; I480-H483 VanDerWaalsContact O-N 3.13Å; I480-M484 HydrophobicContact CG2-CG 4.46Å; I480-M484 HydrophobicContact CG2-SD 3.9Å; I480-M484 VanDerWaalsContact O-CG 3.3Å; I480-M484 WeakPolarHBondContact O-CG 3.4Å; I480-M484 PolarHBondContact O-N 3.06Å
481	Y	91.8	Very high	88.2	Confident	14 Å²	14	53 Å²	53	6%	0.055	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-31.4	177.3	-57.8	-49.4	0	0	0	112.6	E466 V469 R477 S478 D479 M484 E485 L496 L499	E466-Y481 VanDerWaalsContact OE2-CE1 3.31Å; E466-Y481 WeakPolarHBondContact OE2-CE1 3.33Å; E466-Y481 PolarHBondContact OE2-OH 2.91Å; V469-Y481 HydrophobicContact CG1-CE1 3.85Å; V469-Y481 HydrophobicContact CG1-CE2 4.25Å; R477-Y481 HydrophobicContact CB-CE2 3.97Å; R477-Y481 WeakPolarHBondContact O-CD2 3.43Å; R477-Y481 WeakPolarHBondContact O-CE2 3.24Å; R477-Y481 VanDerWaalsContact O-CG 3.31Å; R477-Y481 PolarHBondContact O-N 3.23Å; R477-Y481 VanDerWaalsContact O-N 3.09Å; S478-Y481 PolarHBondContact O-N 3.05Å; D479-Y481 PolarHBondContact O-N 3.49Å; Y481-M484 HydrophobicContact CD1-SD 4.18Å; Y481-E485 PolarHBondContact O-N 2.73Å; Y481-L496 HydrophobicContact CD1-CD2 4.27Å; Y481-L496 HydrophobicContact CD2-CD2 3.57Å; Y481-L496 HydrophobicContact CD2-CG 4.4Å; Y481-L496 HydrophobicContact CE1-CD2 4.21Å; Y481-L496 HydrophobicContact CE2-CD2 3.51Å; Y481-L496 HydrophobicContact CG-CD2 3.96Å; Y481-L496 HydrophobicContact CG-CG 4.5Å; Y481-L499 HydrophobicContact CD1-CD1 3.72Å; Y481-L499 HydrophobicContact CE1-CD1 3.56Å
482	S	90.6	Very high	88.5	Confident	36 Å²	36	47.2 Å²	47.2	25%	0.252	27%	0.265	S	S	.	.	H	α-helix	trans	-69.1	-36.9	171.3	-106.6	0	0	0	0	112.5	S478 D479 I480 K492	S478-S482 PolarHBondContact O-N 3.35Å; D479-S482 CarbonylContact O-C 3.58Å; D479-S482 WeakPolarHBondContact O-CB 3.21Å; D479-S482 PolarHBondContact O-N 3.09Å; D479-S482 VanDerWaalsContact O-N 3.15Å; I480-S482 VanDerWaalsContact C-N 3.28Å; I480-S482 PolarHBondContact O-N 3.12Å; S482-K492 PolarHBondContact OG-NZ 2.94Å; S482-K492 VanDerWaalsContact OG-NZ 3.11Å
483	H	90.9	Very high	88.7	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.019	28%	0.279	C	S	.	.	H	α-helix	trans	-65.1	-42.9	175	-170.7	79.5	0	0	0	111.6	P421 L423 R439 D479 I480 A486 F487	P421-H483 PolarHBondContact O-CE1 3.3Å; P421-H483 PolarHBondContact O-ND1 2.78Å; L423-H483 HydrophobicContact CD2-CB 3.89Å; L423-H483 VanDerWaalsContact CD2-CD2 3.49Å; L423-H483 WeakPolarHBondContact CD2-CD2 3.44Å; L423-H483 VanDerWaalsContact CD2-CG 3.48Å; R439-H483 PolarHBondContact NH2-CE1 3.01Å; R439-H483 PolarHBondContact NH2-NE2 2.93Å; D479-H483 PolarHBondContact O-N 3.4Å; I480-H483 WeakPolarHBondContact O-CB 3.21Å; I480-H483 PolarHBondContact O-N 3.29Å; I480-H483 VanDerWaalsContact O-N 3.13Å; H483-A486 PolarHBondContact O-N 3.16Å; H483-F487 AromaticContact CD2-CE1 3.59Å; H483-F487 AromaticContact NE2-CE1 3.75Å; H483-F487 WeakPolarHBondContact O-CD1 3.39Å; H483-F487 WeakPolarHBondContact O-CE1 3.32Å
484	M	90.9	Very high	89.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.5	-35.9	178.6	-66.3	164	75.9	0	0	113	L438 L462 I465 I480 Y481 A486 F487 V488 L495 L499	L438-M484 HydrophobicContact CD2-CE 3.74Å; L438-M484 HydrophobicContact CD2-CG 4.3Å; L462-M484 HydrophobicContact CD2-CE 3.53Å; I465-M484 HydrophobicContact CB-CE 4.46Å; I465-M484 HydrophobicContact CD1-CE 4.1Å; I465-M484 HydrophobicContact CG2-CE 3.84Å; I465-M484 HydrophobicContact CG2-SD 3.85Å; I480-M484 HydrophobicContact CG2-CG 4.46Å; I480-M484 HydrophobicContact CG2-SD 3.9Å; I480-M484 VanDerWaalsContact O-CG 3.3Å; I480-M484 WeakPolarHBondContact O-CG 3.4Å; I480-M484 PolarHBondContact O-N 3.06Å; Y481-M484 HydrophobicContact CD1-SD 4.18Å; M484-A486 PolarHBondContact O-N 2.93Å; M484-F487 PolarHBondContact O-N 3.37Å; M484-V488 WeakPolarHBondContact O-CB 3.35Å; M484-V488 WeakPolarHBondContact O-CG2 3.33Å; M484-V488 PolarHBondContact O-N 2.93Å; M484-V488 VanDerWaalsContact O-N 3.13Å; M484-L495 HydrophobicContact CB-CD2 3.64Å; M484-L495 HydrophobicContact CE-CD2 4.29Å; M484-L499 HydrophobicContact CE-CD1 4.45Å; M484-L499 HydrophobicContact CE-CD2 4.48Å
485	E	92.4	Very high	89.5	Confident	71 Å²	71	45.6 Å²	45.6	33%	0.332	25%	0.252	S	S	.	.	H	α-helix	trans	-55.6	-36.4	177.4	173.9	168.4	-134	0	0	112.5	Y481 F487 N491 K492	Y481-E485 PolarHBondContact O-N 2.73Å; E485-F487 PolarHBondContact O-N 3.47Å; E485-F487 VanDerWaalsContact O-N 3.09Å; E485-N491 WeakPolarHBondContact OE1-CA 3.45Å; E485-N491 VanDerWaalsContact OE1-CB 3.25Å; E485-N491 WeakPolarHBondContact OE1-CB 3.27Å; E485-K492 HydrophobicContact CB-CB 4.25Å; E485-K492 HydrophobicContact CG-CB 4.41Å; E485-K492 PolarHBondContact OE1-N 2.85Å; E485-K492 VanDerWaalsContact OE2-CB 3.29Å; E485-K492 WeakPolarHBondContact OE2-CB 3.38Å
486	A	88.2	Confident	89.7	Confident	60 Å²	60	41.1 Å²	41.1	50%	0.496	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-7	-178	0	0	0	0	0	115.1	P420 H483 M484	P420-A486 HydrophobicContact CB-CB 3.65Å; H483-A486 PolarHBondContact O-N 3.16Å; M484-A486 PolarHBondContact O-N 2.93Å
487	F	88.8	Confident	89.9	Confident	28 Å²	28	45.1 Å²	45.1	12%	0.123	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.4	18	175.7	61.5	-92.9	0	0	0	114.3	I435 L438 R439 S442 H483 M484 E485	I435-F487 HydrophobicContact CG2-CZ 4.04Å; L438-F487 HydrophobicContact CB-CE2 4.25Å; L438-F487 HydrophobicContact CD2-CE2 3.83Å; L438-F487 HydrophobicContact CD2-CZ 4.4Å; L438-F487 HydrophobicContact CG-CE2 4.02Å; R439-F487 VanDerWaalsContact CA-CE2 3.45Å; R439-F487 HydrophobicContact CB-CD2 3.93Å; R439-F487 HydrophobicContact CB-CE1 4.46Å; R439-F487 HydrophobicContact CB-CE2 3.65Å; R439-F487 HydrophobicContact CB-CG 4.44Å; R439-F487 HydrophobicContact CB-CZ 3.94Å; R439-F487 HydrophobicContact CG-CD1 4.39Å; R439-F487 HydrophobicContact CG-CD2 4.1Å; R439-F487 HydrophobicContact CG-CE2 4.26Å; R439-F487 HydrophobicContact CG-CG 4.16Å; R439-F487 HydrophobicContact CG-CZ 4.47Å; S442-F487 WeakPolarHBondContact CB-O 3.09Å; S442-F487 PolarHBondContact OG-O 3.4Å; H483-F487 AromaticContact CD2-CE1 3.59Å; H483-F487 AromaticContact NE2-CE1 3.75Å; H483-F487 WeakPolarHBondContact O-CD1 3.39Å; H483-F487 WeakPolarHBondContact O-CE1 3.32Å; M484-F487 PolarHBondContact O-N 3.37Å; E485-F487 PolarHBondContact O-N 3.47Å; E485-F487 VanDerWaalsContact O-N 3.09Å
488	V	90.6	Very high	89.9	Confident	9 Å²	9	46.2 Å²	46.2	6%	0.055	25%	0.252	C	S	.	.	S	Bend	trans	-117.5	132.1	171.3	172.4	0	0	0	0	108.1	L438 F453 F454 M484 C490 L495	L438-V488 HydrophobicContact CD2-CG2 4.11Å; F453-V488 HydrophobicContact CD1-CG1 4.45Å; F453-V488 HydrophobicContact CE1-CB 4.46Å; F453-V488 HydrophobicContact CE1-CG1 3.86Å; F453-V488 HydrophobicContact CE1-CG2 4.32Å; F453-V488 HydrophobicContact CZ-CG1 4.41Å; F453-V488 HydrophobicContact CZ-CG2 4.29Å; F454-V488 HydrophobicContact CE1-CG1 3.96Å; F454-V488 HydrophobicContact CZ-CG1 4.03Å; M484-V488 WeakPolarHBondContact O-CB 3.35Å; M484-V488 WeakPolarHBondContact O-CG2 3.33Å; M484-V488 PolarHBondContact O-N 2.93Å; M484-V488 VanDerWaalsContact O-N 3.13Å; V488-C490 PolarHBondContact O-N 3.31Å; V488-L495 HydrophobicContact CG1-CD1 4.28Å
489	P	86.8	Confident	90	Very high	81 Å²	81	44 Å²	44	53%	0.526	24%	0.236	S	C	.	.	S	Bend	trans	-77.2	50.8	-178.3	32.6	-36.7	0	0	0	113	F453	F453-P489 HydrophobicContact CB-CG 3.6Å; F453-P489 HydrophobicContact CD1-CG 3.85Å; F453-P489 VanDerWaalsContact CD2-CD 3.42Å; F453-P489 HydrophobicContact CD2-CG 3.41Å; F453-P489 VanDerWaalsContact CD2-CG 3.41Å; F453-P489 HydrophobicContact CE1-CG 4.38Å; F453-P489 VanDerWaalsContact CE2-CD 3.42Å; F453-P489 HydrophobicContact CE2-CG 3.97Å; F453-P489 HydrophobicContact CG-CG 3.33Å; F453-P489 HydrophobicContact CZ-CG 4.43Å
490	C	86	Confident	89.8	Confident	28 Å²	28	45.2 Å²	45.2	19%	0.189	24%	0.238	C	C	.	.	S	Bend	trans	-156.1	146.7	161	72	0	0	0	0	109.8	F454 V488 A494	F454-C490 HydrophobicContact CZ-CB 4.11Å; V488-C490 PolarHBondContact O-N 3.31Å; C490-A494 HydrophobicContact CB-CB 3.86Å
491	N	90.3	Very high	89.7	Confident	91 Å²	91	52.8 Å²	52.8	49%	0.487	27%	0.271	S	S	.	.			trans	-63	161.2	177.7	66.3	8.6	0	0	0	112.8	E485 E493 A494 L495	E485-N491 WeakPolarHBondContact OE1-CA 3.45Å; E485-N491 VanDerWaalsContact OE1-CB 3.25Å; E485-N491 WeakPolarHBondContact OE1-CB 3.27Å; N491-E493 PolarHBondContact O-N 2.75Å; N491-E493 VanDerWaalsContact O-N 3.11Å; N491-A494 PolarHBondContact O-N 2.9Å; N491-A494 WeakPolarHBondContact OD1-CB 3.24Å; N491-A494 PolarHBondContact OD1-N 3.43Å; N491-L495 WeakPolarHBondContact O-CB 3.45Å; N491-L495 PolarHBondContact O-N 3.13Å
492	K	88.6	Confident	89.4	Confident	39 Å²	39	53.2 Å²	53.2	17%	0.17	27%	0.274	C	S	.	.	H	α-helix	trans	-51	-37.1	-178.8	172.7	166.3	171.4	168.7	0	112.2	S478 S482 E485 L495 L496	S478-K492 WeakPolarHBondContact O-CE 3.43Å; S478-K492 PolarHBondContact O-NZ 2.94Å; S478-K492 PolarHBondContact OG-NZ 2.8Å; S482-K492 PolarHBondContact OG-NZ 2.94Å; S482-K492 VanDerWaalsContact OG-NZ 3.11Å; E485-K492 HydrophobicContact CB-CB 4.25Å; E485-K492 HydrophobicContact CG-CB 4.41Å; E485-K492 PolarHBondContact OE1-N 2.85Å; E485-K492 VanDerWaalsContact OE2-CB 3.29Å; E485-K492 WeakPolarHBondContact OE2-CB 3.38Å; K492-L495 PolarHBondContact O-N 3.25Å; K492-L496 HydrophobicContact CG-CD1 4.09Å; K492-L496 VanDerWaalsContact O-CB 3.27Å; K492-L496 WeakPolarHBondContact O-CB 3.23Å; K492-L496 VanDerWaalsContact O-CG 3.24Å; K492-L496 WeakPolarHBondContact O-CG 3.4Å; K492-L496 PolarHBondContact O-N 3.46Å
493	E	89.4	Confident	89.1	Confident	101 Å²	101	51.9 Å²	51.9	47%	0.472	27%	0.265	S	S	.	.	H	α-helix	trans	-66.2	-42.4	175.2	-80.8	-58.1	122.2	0	0	114.4	N491 K497	N491-E493 PolarHBondContact O-N 2.75Å; N491-E493 VanDerWaalsContact O-N 3.11Å; E493-K497 WeakPolarHBondContact O-CB 3.26Å; E493-K497 VanDerWaalsContact O-CD 3.25Å; E493-K497 WeakPolarHBondContact O-CD 3.48Å; E493-K497 WeakPolarHBondContact O-CG 3.38Å; E493-K497 PolarHBondContact O-N 3.44Å; E493-K497 VanDerWaalsContact O-N 3.12Å; E493-K497 IonicContact OE2-NZ 3.54Å; E493-K497 PolarHBondContact OE2-NZ 2.97Å
494	A	91.2	Very high	88.6	Confident	40 Å²	40	56.4 Å²	56.4	33%	0.331	29%	0.289	S	S	.	.	H	α-helix	trans	-74.3	-33.8	174.9	0	0	0	0	0	111.7	C490 N491 K497 R498	C490-A494 HydrophobicContact CB-CB 3.86Å; N491-A494 PolarHBondContact O-N 2.9Å; N491-A494 WeakPolarHBondContact OD1-CB 3.24Å; N491-A494 PolarHBondContact OD1-N 3.43Å; A494-K497 PolarHBondContact O-N 2.84Å; A494-R498 WeakPolarHBondContact O-CB 3.3Å; A494-R498 PolarHBondContact O-N 3.45Å
495	L	91.8	Very high	88.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.5	-52.3	173.7	-178.3	55.1	0	0	0	110.4	L462 M484 V488 N491 K492 K497 R498 L499	L462-L495 HydrophobicContact CD2-CD1 3.87Å; M484-L495 HydrophobicContact CB-CD2 3.64Å; M484-L495 HydrophobicContact CE-CD2 4.29Å; V488-L495 HydrophobicContact CG1-CD1 4.28Å; N491-L495 WeakPolarHBondContact O-CB 3.45Å; N491-L495 PolarHBondContact O-N 3.13Å; K492-L495 PolarHBondContact O-N 3.25Å; L495-K497 PolarHBondContact O-N 3.26Å; L495-R498 CarbonylContact O-C 3.54Å; L495-R498 WeakPolarHBondContact O-CA 3.46Å; L495-R498 WeakPolarHBondContact O-CB 3.3Å; L495-R498 PolarHBondContact O-N 2.9Å; L495-L499 HydrophobicContact CD1-CD1 4.02Å; L495-L499 HydrophobicContact CD1-CG 4.12Å; L495-L499 HydrophobicContact CG-CD1 3.79Å; L495-L499 HydrophobicContact CG-CG 4.36Å; L495-L499 VanDerWaalsContact O-CG 3.29Å; L495-L499 WeakPolarHBondContact O-CG 3.25Å; L495-L499 PolarHBondContact O-N 3.5Å
496	L	89.4	Confident	87.5	Confident	30 Å²	30	59.1 Å²	59.1	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-55.9	-46.1	173.5	-79.8	168.1	0	0	0	112.4	Y481 K492 R498 L499 K500	Y481-L496 HydrophobicContact CD1-CD2 4.27Å; Y481-L496 HydrophobicContact CD2-CD2 3.57Å; Y481-L496 HydrophobicContact CD2-CG 4.4Å; Y481-L496 HydrophobicContact CE1-CD2 4.21Å; Y481-L496 HydrophobicContact CE2-CD2 3.51Å; Y481-L496 HydrophobicContact CG-CD2 3.96Å; Y481-L496 HydrophobicContact CG-CG 4.5Å; K492-L496 HydrophobicContact CG-CD1 4.09Å; K492-L496 VanDerWaalsContact O-CB 3.27Å; K492-L496 WeakPolarHBondContact O-CB 3.23Å; K492-L496 VanDerWaalsContact O-CG 3.24Å; K492-L496 WeakPolarHBondContact O-CG 3.4Å; K492-L496 PolarHBondContact O-N 3.46Å; L496-R498 PolarHBondContact O-N 2.94Å; L496-L499 PolarHBondContact O-N 3.49Å; L496-K500 WeakPolarHBondContact O-CB 3.23Å; L496-K500 VanDerWaalsContact O-CG 3.32Å; L496-K500 WeakPolarHBondContact O-CG 3.3Å; L496-K500 PolarHBondContact O-N 3.3Å
497	K	90.6	Very high	86.8	Confident	134 Å²	134	56.8 Å²	56.8	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-62.4	-28.4	175.7	-73.5	163.3	-170	126.7	0	112.4	E493 A494 L495 K501	E493-K497 WeakPolarHBondContact O-CB 3.26Å; E493-K497 VanDerWaalsContact O-CD 3.25Å; E493-K497 WeakPolarHBondContact O-CD 3.48Å; E493-K497 WeakPolarHBondContact O-CG 3.38Å; E493-K497 PolarHBondContact O-N 3.44Å; E493-K497 VanDerWaalsContact O-N 3.12Å; E493-K497 IonicContact OE2-NZ 3.54Å; E493-K497 PolarHBondContact OE2-NZ 2.97Å; A494-K497 PolarHBondContact O-N 2.84Å; L495-K497 PolarHBondContact O-N 3.26Å; K497-K501 WeakPolarHBondContact O-CB 3.27Å; K497-K501 PolarHBondContact O-N 3.27Å
498	R	89.5	Confident	86.4	Confident	77 Å²	77	59.6 Å²	59.6	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-78.5	-48.4	174	-169.2	178.4	-166.2	84.1	15.9	112.5	F454 N459 A494 L495 L496 K501 L502	F454-R498 VanDerWaalsContact CB-NH2 3.31Å; F454-R498 VanDerWaalsContact CG-NE 3.33Å; N459-R498 PolarHBondContact ND2-NH2 3.15Å; N459-R498 PolarHBondContact OD1-NE 3.29Å; N459-R498 PolarHBondContact OD1-NH2 2.87Å; A494-R498 WeakPolarHBondContact O-CB 3.3Å; A494-R498 PolarHBondContact O-N 3.45Å; L495-R498 CarbonylContact O-C 3.54Å; L495-R498 WeakPolarHBondContact O-CA 3.46Å; L495-R498 WeakPolarHBondContact O-CB 3.3Å; L495-R498 PolarHBondContact O-N 2.9Å; L496-R498 PolarHBondContact O-N 2.94Å; R498-K501 CarbonylContact O-C 3.57Å; R498-K501 WeakPolarHBondContact O-CA 3.39Å; R498-K501 WeakPolarHBondContact O-CB 3.45Å; R498-K501 PolarHBondContact O-N 2.72Å; R498-K501 VanDerWaalsContact O-N 3.08Å; R498-L502 HydrophobicContact CG-CD1 4.16Å; R498-L502 HydrophobicContact CG-CG 4.49Å; R498-L502 WeakPolarHBondContact O-CG 3.44Å; R498-L502 PolarHBondContact O-N 3.06Å
499	L	90.4	Very high	86	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-58.6	-49.7	179.2	-67.9	164.5	0	0	0	110.7	L462 E466 Y481 M484 L495 L496 K501 L502 S503	L462-L499 HydrophobicContact CB-CD2 3.84Å; L462-L499 HydrophobicContact CD2-CD2 4.22Å; L462-L499 WeakPolarHBondContact O-CD2 3.36Å; E466-L499 HydrophobicContact CB-CB 4.39Å; E466-L499 HydrophobicContact CB-CD2 4.09Å; E466-L499 HydrophobicContact CG-CB 4.24Å; Y481-L499 HydrophobicContact CD1-CD1 3.72Å; Y481-L499 HydrophobicContact CE1-CD1 3.56Å; M484-L499 HydrophobicContact CE-CD1 4.45Å; M484-L499 HydrophobicContact CE-CD2 4.48Å; L495-L499 HydrophobicContact CD1-CD1 4.02Å; L495-L499 HydrophobicContact CD1-CG 4.12Å; L495-L499 HydrophobicContact CG-CD1 3.79Å; L495-L499 HydrophobicContact CG-CG 4.36Å; L495-L499 VanDerWaalsContact O-CG 3.29Å; L495-L499 WeakPolarHBondContact O-CG 3.25Å; L495-L499 PolarHBondContact O-N 3.5Å; L496-L499 PolarHBondContact O-N 3.49Å; L499-K501 VanDerWaalsContact C-N 3.26Å; L499-K501 PolarHBondContact O-N 2.95Å; L499-L502 PolarHBondContact O-N 2.8Å; L499-S503 PolarHBondContact O-N 3.11Å
500	K	86.4	Confident	85.9	Confident	107 Å²	107	63.2 Å²	63.2	47%	0.465	31%	0.307	S	S	.	.	H	α-helix	trans	-57	-37.5	173.2	-69.7	-175.4	174.8	-161.7	0	112.6	L496 L504	L496-K500 WeakPolarHBondContact O-CB 3.23Å; L496-K500 VanDerWaalsContact O-CG 3.32Å; L496-K500 WeakPolarHBondContact O-CG 3.3Å; L496-K500 PolarHBondContact O-N 3.3Å; K500-L504 WeakPolarHBondContact O-CB 3.32Å; K500-L504 PolarHBondContact O-N 3.19Å
501	K	88.3	Confident	86.1	Confident	159 Å²	159	62.2 Å²	62.2	69%	0.691	30%	0.3	S	S	*	.	H	α-helix	trans	-70.4	-33.7	175.7	-178.9	170.8	-179.5	171.5	0	113.1	K497 R498 L499 N505	K497-K501 WeakPolarHBondContact O-CB 3.27Å; K497-K501 PolarHBondContact O-N 3.27Å; R498-K501 CarbonylContact O-C 3.57Å; R498-K501 WeakPolarHBondContact O-CA 3.39Å; R498-K501 WeakPolarHBondContact O-CB 3.45Å; R498-K501 PolarHBondContact O-N 2.72Å; R498-K501 VanDerWaalsContact O-N 3.08Å; L499-K501 VanDerWaalsContact C-N 3.26Å; L499-K501 PolarHBondContact O-N 2.95Å; K501-N505 WeakPolarHBondContact O-CB 3.35Å; K501-N505 PolarHBondContact O-N 3.03Å; K501-N505 VanDerWaalsContact O-N 3.12Å
502	L	86.9	Confident	86.2	Confident	22 Å²	22	65.2 Å²	65.2	12%	0.115	31%	0.305	C	S	.	.	H	α-helix	trans	-72.8	-44.2	175.9	-67.7	169	0	0	0	110.9	N459 L462 L463 R498 L499 N505 I506	N459-L502 HydrophobicContact CB-CD1 4.1Å; N459-L502 HydrophobicContact CB-CD2 3.92Å; L462-L502 HydrophobicContact CB-CD1 4.22Å; L463-L502 HydrophobicContact CB-CB 4.26Å; L463-L502 HydrophobicContact CD1-CB 3.81Å; L463-L502 HydrophobicContact CD2-CB 4.24Å; L463-L502 HydrophobicContact CG-CB 4.33Å; R498-L502 HydrophobicContact CG-CD1 4.16Å; R498-L502 HydrophobicContact CG-CG 4.49Å; R498-L502 WeakPolarHBondContact O-CG 3.44Å; R498-L502 PolarHBondContact O-N 3.06Å; L499-L502 PolarHBondContact O-N 2.8Å; L502-N505 WeakPolarHBondContact O-CB 3.39Å; L502-N505 PolarHBondContact O-N 3.32Å; L502-N505 VanDerWaalsContact O-N 3.15Å; L502-I506 PolarHBondContact O-N 3.39Å; L502-I506 VanDerWaalsContact O-N 3.09Å
503	S	83.6	Confident	86.4	Confident	8 Å²	8	65.9 Å²	65.9	6%	0.056	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-45.3	173.8	-178.4	0	0	0	0	111.9	L499 N505 I506 Q507	L499-S503 PolarHBondContact O-N 3.11Å; S503-N505 VanDerWaalsContact C-N 3.27Å; S503-N505 PolarHBondContact O-N 3.4Å; S503-I506 WeakPolarHBondContact O-CB 3.5Å; S503-I506 PolarHBondContact O-N 3.27Å; S503-I506 VanDerWaalsContact O-N 3.12Å; S503-Q507 PolarHBondContact O-N 3.36Å; S503-Q507 VanDerWaalsContact O-N 3.11Å
504	L	81.1	Confident	86.6	Confident	100 Å²	100	62.3 Å²	62.3	52%	0.524	30%	0.303	S	S	.	.	H	α-helix	trans	-61.8	-32.5	174.2	-172.4	66.6	0	0	0	112.8	K500 Q507 D508	K500-L504 WeakPolarHBondContact O-CB 3.32Å; K500-L504 PolarHBondContact O-N 3.19Å; L504-Q507 PolarHBondContact O-N 3.03Å; L504-D508 PolarHBondContact O-N 3.06Å
505	N	79.4	Confident	86.8	Confident	81 Å²	81	62.2 Å²	62.2	43%	0.433	30%	0.296	S	S	.	.	H	α-helix	trans	-69.7	-36.5	174.5	179.7	-162.1	0	0	0	112.1	K501 L502 S503 Q507 D508 D509	K501-N505 WeakPolarHBondContact O-CB 3.35Å; K501-N505 PolarHBondContact O-N 3.03Å; K501-N505 VanDerWaalsContact O-N 3.12Å; L502-N505 WeakPolarHBondContact O-CB 3.39Å; L502-N505 PolarHBondContact O-N 3.32Å; L502-N505 VanDerWaalsContact O-N 3.15Å; S503-N505 VanDerWaalsContact C-N 3.27Å; S503-N505 PolarHBondContact O-N 3.4Å; N505-Q507 VanDerWaalsContact C-N 3.29Å; N505-Q507 PolarHBondContact O-N 3.04Å; N505-D508 PolarHBondContact O-N 3.1Å; N505-D509 PolarHBondContact ND2-OD2 3.42Å; N505-D509 PolarHBondContact O-N 3.48Å
506	I	80.4	Confident	86.9	Confident	47 Å²	47	66.8 Å²	66.8	24%	0.241	32%	0.321	C	S	.	.	H	α-helix	trans	-57.4	-45.3	167.8	-71.4	-173.9	0	0	0	110.4	L463 L467 L502 S503 D508 D509 R510	L463-I506 HydrophobicContact CD1-CD1 3.56Å; L463-I506 HydrophobicContact CD1-CG1 4.07Å; L463-I506 HydrophobicContact CD2-CD1 3.71Å; L463-I506 HydrophobicContact CD2-CG1 3.86Å; L463-I506 HydrophobicContact CG-CD1 3.67Å; L463-I506 HydrophobicContact CG-CG1 4.29Å; L467-I506 HydrophobicContact CD1-CD1 3.91Å; L467-I506 HydrophobicContact CD2-CD1 4.44Å; L502-I506 PolarHBondContact O-N 3.39Å; L502-I506 VanDerWaalsContact O-N 3.09Å; S503-I506 WeakPolarHBondContact O-CB 3.5Å; S503-I506 PolarHBondContact O-N 3.27Å; S503-I506 VanDerWaalsContact O-N 3.12Å; I506-D508 PolarHBondContact O-N 3.21Å; I506-D509 PolarHBondContact O-N 3.49Å; I506-R510 HydrophobicContact CG2-CG 4.03Å; I506-R510 WeakPolarHBondContact O-CB 3.36Å; I506-R510 VanDerWaalsContact O-CG 3.28Å; I506-R510 WeakPolarHBondContact O-CG 3.25Å; I506-R510 PolarHBondContact O-N 2.91Å
507	Q	72.6	Confident	87.3	Confident	10 Å²	10	71.8 Å²	71.8	5%	0.047	34%	0.341	C	S	.	.	H	α-helix	trans	-61.5	-43.6	-179.3	-63.1	-166	12.2	0	0	112	S503 L504 N505 R510 L511 C593 M596	S503-Q507 PolarHBondContact O-N 3.36Å; S503-Q507 VanDerWaalsContact O-N 3.11Å; L504-Q507 PolarHBondContact O-N 3.03Å; N505-Q507 VanDerWaalsContact C-N 3.29Å; N505-Q507 PolarHBondContact O-N 3.04Å; Q507-R510 PolarHBondContact O-N 3.2Å; Q507-L511 WeakPolarHBondContact O-CB 3.47Å; Q507-L511 WeakPolarHBondContact O-CD1 3.47Å; Q507-L511 VanDerWaalsContact O-CG 3.3Å; Q507-L511 WeakPolarHBondContact O-CG 3.42Å; Q507-L511 PolarHBondContact O-N 3.36Å; Q507-L511 VanDerWaalsContact O-N 3.08Å; Q507-C593 HydrophobicContact CG-CB 4.25Å; Q507-M596 HydrophobicContact CG-CE 4.09Å
508	D	80.4	Confident	87.6	Confident	88 Å²	88	65.4 Å²	65.4	47%	0.471	31%	0.313	S	S	.	.	H	α-helix	trans	-60.6	-52.4	175	-172.9	59.7	0	0	0	111.4	L504 N505 I506 R510 L511 R512	L504-D508 PolarHBondContact O-N 3.06Å; N505-D508 PolarHBondContact O-N 3.1Å; I506-D508 PolarHBondContact O-N 3.21Å; D508-R510 VanDerWaalsContact C-N 3.33Å; D508-R510 PolarHBondContact O-N 3.37Å; D508-L511 PolarHBondContact O-N 2.9Å; D508-R512 WeakPolarHBondContact O-CB 3.49Å; D508-R512 PolarHBondContact O-N 3.41Å
509	D	83.3	Confident	87.9	Confident	70 Å²	70	66.8 Å²	66.8	37%	0.374	32%	0.321	S	S	.	.	H	α-helix	trans	-66.2	-31.2	-179.2	-82.5	-51	0	0	0	112.9	N505 I506 R512	N505-D509 PolarHBondContact ND2-OD2 3.42Å; N505-D509 PolarHBondContact O-N 3.48Å; I506-D509 PolarHBondContact O-N 3.49Å; D509-R512 WeakPolarHBondContact OD1-CD 3.47Å; D509-R512 IonicContact OD1-CZ 2.63Å; D509-R512 IonicContact OD1-NE 3.76Å; D509-R512 IonicContact OD1-NH1 2.93Å; D509-R512 PolarHBondContact OD1-NH1 3.19Å
510	R	85.3	Confident	88.2	Confident	96 Å²	96	72 Å²	72	36%	0.362	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-40.4	169.6	-77.6	178.4	79.1	-148.6	7.5	112.1	I506 Q507 D508 P514 V589 S592	I506-R510 HydrophobicContact CG2-CG 4.03Å; I506-R510 WeakPolarHBondContact O-CB 3.36Å; I506-R510 VanDerWaalsContact O-CG 3.28Å; I506-R510 WeakPolarHBondContact O-CG 3.25Å; I506-R510 PolarHBondContact O-N 2.91Å; Q507-R510 PolarHBondContact O-N 3.2Å; D508-R510 VanDerWaalsContact C-N 3.33Å; D508-R510 PolarHBondContact O-N 3.37Å; R510-P514 WeakPolarHBondContact O-CD 3.39Å; R510-P514 WeakPolarHBondContact O-CG 3.41Å; R510-V589 HydrophobicContact CB-CG1 4.05Å; R510-S592 PolarHBondContact NH1-OG 3.04Å; R510-S592 PolarHBondContact NH2-OG 2.81Å
511	L	89.9	Confident	88.7	Confident	7 Å²	7	67.3 Å²	67.3	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-78.2	-34.3	179.8	-72.8	164.8	0	0	0	112.7	Q507 D508 A513 P514 L515 L586 V589 K590 F611	Q507-L511 WeakPolarHBondContact O-CB 3.47Å; Q507-L511 WeakPolarHBondContact O-CD1 3.47Å; Q507-L511 VanDerWaalsContact O-CG 3.3Å; Q507-L511 WeakPolarHBondContact O-CG 3.42Å; Q507-L511 PolarHBondContact O-N 3.36Å; Q507-L511 VanDerWaalsContact O-N 3.08Å; D508-L511 PolarHBondContact O-N 2.9Å; L511-A513 PolarHBondContact O-N 2.86Å; L511-P514 VanDerWaalsContact O-CD 3.28Å; L511-P514 WeakPolarHBondContact O-CD 3.22Å; L511-L515 WeakPolarHBondContact O-CB 3.36Å; L511-L515 PolarHBondContact O-N 2.84Å; L511-L586 HydrophobicContact CD2-CD1 4.04Å; L511-V589 HydrophobicContact CD2-CB 4.21Å; L511-V589 HydrophobicContact CD2-CG1 3.81Å; L511-V589 HydrophobicContact CG-CG1 4.19Å; L511-K590 HydrophobicContact CD1-CD 3.81Å; L511-K590 HydrophobicContact CD2-CB 3.84Å; L511-K590 HydrophobicContact CD2-CD 4.15Å; L511-F611 HydrophobicContact CD2-CE2 4.46Å; L511-F611 HydrophobicContact CD2-CZ 4.33Å
512	R	91.4	Very high	89.2	Confident	154 Å²	154	59.8 Å²	59.8	58%	0.581	30%	0.297	S	S	*	.	H	α-helix	trans	-57.6	-40.4	-173.3	-174.3	176.4	178.5	-159.5	2.2	113.8	D508 D509 L516	D508-R512 WeakPolarHBondContact O-CB 3.49Å; D508-R512 PolarHBondContact O-N 3.41Å; D509-R512 WeakPolarHBondContact OD1-CD 3.47Å; D509-R512 IonicContact OD1-CZ 2.63Å; D509-R512 IonicContact OD1-NE 3.76Å; D509-R512 IonicContact OD1-NH1 2.93Å; D509-R512 PolarHBondContact OD1-NH1 3.19Å; R512-L516 VanDerWaalsContact O-CB 3.23Å; R512-L516 WeakPolarHBondContact O-CB 3.26Å; R512-L516 PolarHBondContact O-N 3.08Å
513	A	92.6	Very high	89.6	Confident	52 Å²	52	62.2 Å²	62.2	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-73	-48	178.7	0	0	0	0	0	113.4	L511 L516 K517	L511-A513 PolarHBondContact O-N 2.86Å; A513-L516 PolarHBondContact O-N 3.24Å; A513-K517 WeakPolarHBondContact O-CG 3.38Å; A513-K517 PolarHBondContact O-N 2.88Å
514	P	93.6	Very high	90.2	Very high	26 Å²	26	65.6 Å²	65.6	17%	0.169	34%	0.339	C	S	.	.	H	α-helix	trans	-54.9	-45.7	166.8	-27.9	34.8	0	0	0	113.8	R510 L511 L516 K517 L518 L586 V589	R510-P514 WeakPolarHBondContact O-CD 3.39Å; R510-P514 WeakPolarHBondContact O-CG 3.41Å; L511-P514 VanDerWaalsContact O-CD 3.28Å; L511-P514 WeakPolarHBondContact O-CD 3.22Å; P514-L516 PolarHBondContact O-N 2.83Å; P514-K517 PolarHBondContact O-N 3.25Å; P514-L518 PolarHBondContact O-N 2.55Å; P514-L586 HydrophobicContact CB-CB 4.27Å; P514-L586 HydrophobicContact CB-CD1 3.86Å; P514-V589 HydrophobicContact CG-CG2 4.27Å
515	L	95.3	Very high	90.9	Very high	38 Å²	38	62.2 Å²	62.2	20%	0.199	32%	0.322	C	S	.	.	H	α-helix	trans	-63.8	-41.8	-179.1	-175.1	68	0	0	0	111.5	L511 L518 K519 L586 V616 L619	L511-L515 WeakPolarHBondContact O-CB 3.36Å; L511-L515 PolarHBondContact O-N 2.84Å; L515-L518 PolarHBondContact O-N 2.95Å; L515-K519 VanDerWaalsContact O-CB 3.3Å; L515-K519 WeakPolarHBondContact O-CB 3.45Å; L515-K519 PolarHBondContact O-N 3.4Å; L515-L586 HydrophobicContact CB-CD1 3.98Å; L515-L586 HydrophobicContact CD1-CD1 4.43Å; L515-L586 HydrophobicContact CD1-CD2 3.71Å; L515-V616 HydrophobicContact CD1-CG2 4.41Å; L515-L619 HydrophobicContact CD1-CD1 4.02Å
516	L	95.4	Very high	91.7	Very high	97 Å²	97	59 Å²	59	51%	0.508	31%	0.305	S	S	.	.	H	α-helix	trans	-64.8	-40.4	174.1	-179.2	60.3	0	0	0	112.1	R512 A513 P514 K519 L520	R512-L516 VanDerWaalsContact O-CB 3.23Å; R512-L516 WeakPolarHBondContact O-CB 3.26Å; R512-L516 PolarHBondContact O-N 3.08Å; A513-L516 PolarHBondContact O-N 3.24Å; P514-L516 PolarHBondContact O-N 2.83Å; L516-K519 PolarHBondContact O-N 2.58Å; L516-L520 HydrophobicContact CD1-CD1 4.19Å; L516-L520 HydrophobicContact CD1-CG 4.14Å; L516-L520 HydrophobicContact CG-CD1 4.08Å; L516-L520 HydrophobicContact CG-CG 4.46Å; L516-L520 WeakPolarHBondContact O-CB 3.21Å; L516-L520 VanDerWaalsContact O-CG 3.3Å; L516-L520 WeakPolarHBondContact O-CG 3.38Å; L516-L520 PolarHBondContact O-N 3.2Å
517	K	96	Very high	92.5	Very high	134 Å²	134	60.6 Å²	60.6	58%	0.583	32%	0.318	S	S	*	.	H	α-helix	trans	-62.4	-44.2	175.3	-72.8	170.9	-179.5	178.1	0	111.6	A513 P514 A521 L582	A513-K517 WeakPolarHBondContact O-CG 3.38Å; A513-K517 PolarHBondContact O-N 2.88Å; P514-K517 PolarHBondContact O-N 3.25Å; K517-A521 PolarHBondContact O-N 3.04Å; K517-A521 VanDerWaalsContact O-N 3.1Å; K517-L582 HydrophobicContact CB-CD2 3.85Å
518	L	97.3	Very high	93.6	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62.2	-47.7	174.3	-179.3	61.4	0	0	0	111.2	P514 L515 L520 A521 V522 L579 L582 L583 L586 V616 L619	P514-L518 PolarHBondContact O-N 2.55Å; L515-L518 PolarHBondContact O-N 2.95Å; L518-L520 PolarHBondContact O-N 3.29Å; L518-A521 PolarHBondContact O-N 2.87Å; L518-V522 HydrophobicContact CD1-CG2 4.24Å; L518-V522 HydrophobicContact CG-CG2 4.47Å; L518-V522 WeakPolarHBondContact O-CG2 3.35Å; L518-V522 PolarHBondContact O-N 2.81Å; L518-L579 HydrophobicContact CD1-CD2 4.05Å; L518-L582 HydrophobicContact CB-CB 4.37Å; L518-L582 HydrophobicContact CD1-CB 3.91Å; L518-L583 HydrophobicContact CD2-CD1 4.17Å; L518-L586 HydrophobicContact CD2-CD2 3.61Å; L518-V616 HydrophobicContact CD2-CG1 3.92Å; L518-L619 HydrophobicContact CB-CD1 4.4Å; L518-L619 HydrophobicContact CD2-CD1 3.84Å; L518-L619 HydrophobicContact CG-CD1 3.87Å
519	K	96.8	Very high	94.3	Very high	106 Å²	106	62 Å²	62	46%	0.461	32%	0.322	S	S	.	.	H	α-helix	trans	-56.1	-48	177.5	-176.9	166	-171	166.6	0	112.5	L515 L516 A521 V522 C523 L619	L515-K519 VanDerWaalsContact O-CB 3.3Å; L515-K519 WeakPolarHBondContact O-CB 3.45Å; L515-K519 PolarHBondContact O-N 3.4Å; L516-K519 PolarHBondContact O-N 2.58Å; K519-A521 VanDerWaalsContact C-N 3.34Å; K519-A521 PolarHBondContact O-N 3.39Å; K519-V522 PolarHBondContact O-N 3.44Å; K519-C523 WeakPolarHBondContact O-CB 3.48Å; K519-C523 PolarHBondContact O-N 2.81Å; K519-C523 PolarHBondContact O-SG 3.06Å; K519-L619 HydrophobicContact CB-CD1 4.38Å; K519-L619 HydrophobicContact CB-CD2 3.8Å; K519-L619 HydrophobicContact CD-CD2 3.77Å; K519-L619 HydrophobicContact CG-CD2 3.8Å
520	L	97.3	Very high	94.8	Very high	109 Å²	109	61.3 Å²	61.3	57%	0.571	32%	0.318	S	S	*	.	H	α-helix	trans	-63.2	-39.8	178.1	-71.3	170.5	0	0	0	111.9	L516 L518 C523 S524	L516-L520 HydrophobicContact CD1-CD1 4.19Å; L516-L520 HydrophobicContact CD1-CG 4.14Å; L516-L520 HydrophobicContact CG-CD1 4.08Å; L516-L520 HydrophobicContact CG-CG 4.46Å; L516-L520 WeakPolarHBondContact O-CB 3.21Å; L516-L520 VanDerWaalsContact O-CG 3.3Å; L516-L520 WeakPolarHBondContact O-CG 3.38Å; L516-L520 PolarHBondContact O-N 3.2Å; L518-L520 PolarHBondContact O-N 3.29Å; L520-C523 PolarHBondContact O-N 3.44Å; L520-S524 PolarHBondContact O-N 3.25Å; L520-S524 PolarHBondContact O-OG 2.6Å
521	A	96.9	Very high	95.3	Very high	10 Å²	10	59.1 Å²	59.1	8%	0.083	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-48.4	174.7	0	0	0	0	0	111.7	K517 L518 K519 C523 S524 V525 L579 L582	K517-A521 PolarHBondContact O-N 3.04Å; K517-A521 VanDerWaalsContact O-N 3.1Å; L518-A521 PolarHBondContact O-N 2.87Å; K519-A521 VanDerWaalsContact C-N 3.34Å; K519-A521 PolarHBondContact O-N 3.39Å; A521-C523 PolarHBondContact O-N 2.83Å; A521-S524 PolarHBondContact O-N 3.1Å; A521-S524 VanDerWaalsContact O-N 3.1Å; A521-S524 PolarHBondContact O-OG 2.67Å; A521-V525 PolarHBondContact O-N 3.13Å; A521-V525 VanDerWaalsContact O-N 3.13Å; A521-L579 HydrophobicContact CB-CD2 3.63Å; A521-L579 HydrophobicContact CB-CG 4.33Å; A521-L582 HydrophobicContact CB-CD1 3.61Å
522	V	96.9	Very high	95.5	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-59.5	-45.9	176.6	175.6	0	0	0	0	110.9	L518 K519 S524 V525 M526 L579 L619 W620	L518-V522 HydrophobicContact CD1-CG2 4.24Å; L518-V522 HydrophobicContact CG-CG2 4.47Å; L518-V522 WeakPolarHBondContact O-CG2 3.35Å; L518-V522 PolarHBondContact O-N 2.81Å; K519-V522 PolarHBondContact O-N 3.44Å; V522-S524 VanDerWaalsContact C-N 3.27Å; V522-S524 PolarHBondContact O-N 3.22Å; V522-V525 PolarHBondContact O-N 3.25Å; V522-M526 HydrophobicContact CG1-CG 3.8Å; V522-M526 VanDerWaalsContact O-CB 3.26Å; V522-M526 WeakPolarHBondContact O-CB 3.18Å; V522-M526 WeakPolarHBondContact O-CG 3.38Å; V522-M526 PolarHBondContact O-N 3.46Å; V522-L579 HydrophobicContact CG2-CD2 3.66Å; V522-L619 WeakPolarHBondContact CG1-O 3.42Å; V522-W620 HydrophobicContact CG1-CD2 4.09Å; V522-W620 HydrophobicContact CG1-CG 4.17Å; V522-W620 HydrophobicContact CG1-CZ2 4.46Å; V522-W620 HydrophobicContact CG2-CD2 4.43Å; V522-W620 HydrophobicContact CG2-CH2 3.8Å; V522-W620 HydrophobicContact CG2-CZ2 3.48Å; V522-W620 VanDerWaalsContact CG2-CZ2 3.48Å; V522-W620 HydrophobicContact CG2-CZ3 4.39Å
523	C	95.4	Very high	95.6	Very high	73 Å²	73	59.4 Å²	59.4	49%	0.493	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-29.8	176	-69.8	0	0	0	0	113.6	K519 L520 A521 P527	K519-C523 WeakPolarHBondContact O-CB 3.48Å; K519-C523 PolarHBondContact O-N 2.81Å; K519-C523 PolarHBondContact O-SG 3.06Å; L520-C523 PolarHBondContact O-N 3.44Å; A521-C523 PolarHBondContact O-N 2.83Å; C523-P527 VanDerWaalsContact O-CD 3.28Å; C523-P527 WeakPolarHBondContact O-CD 3.28Å
524	S	96.6	Very high	95.6	Very high	80 Å²	80	60.8 Å²	60.8	56%	0.559	33%	0.325	S	S	*	.	H	α-helix	trans	-75.5	-33.7	176	68	0	0	0	0	113.6	L520 A521 V522	L520-S524 PolarHBondContact O-N 3.25Å; L520-S524 PolarHBondContact O-OG 2.6Å; A521-S524 PolarHBondContact O-N 3.1Å; A521-S524 VanDerWaalsContact O-N 3.1Å; A521-S524 PolarHBondContact O-OG 2.67Å; V522-S524 VanDerWaalsContact C-N 3.27Å; V522-S524 PolarHBondContact O-N 3.22Å
525	V	96.4	Very high	95.6	Very high	28 Å²	28	65.6 Å²	65.6	17%	0.17	35%	0.347	C	S	.	.	H	α-helix	trans	-92.5	-29.4	-174.6	175.1	0	0	0	0	112.5	A521 V522 E528 Q529 D576 L579	A521-V525 PolarHBondContact O-N 3.13Å; A521-V525 VanDerWaalsContact O-N 3.13Å; V522-V525 PolarHBondContact O-N 3.25Å; V525-E528 PolarHBondContact O-N 3.31Å; V525-Q529 HydrophobicContact CG1-CG 4.15Å; V525-Q529 PolarHBondContact O-N 2.69Å; V525-D576 WeakPolarHBondContact CG2-OD2 3.25Å; V525-L579 HydrophobicContact CB-CD1 4.29Å; V525-L579 HydrophobicContact CG1-CD1 4.3Å; V525-L579 HydrophobicContact CG2-CD1 4.06Å
526	M	96.4	Very high	95.4	Very high	13 Å²	13	68.1 Å²	68.1	6%	0.064	36%	0.357	C	S	.	.	H	α-helix	trans	-51.4	-47.4	179.9	-90	-74.6	107.2	0	0	115.4	V522 E528 Q529 I530 F573 P621 W624	V522-M526 HydrophobicContact CG1-CG 3.8Å; V522-M526 VanDerWaalsContact O-CB 3.26Å; V522-M526 WeakPolarHBondContact O-CB 3.18Å; V522-M526 WeakPolarHBondContact O-CG 3.38Å; V522-M526 PolarHBondContact O-N 3.46Å; M526-E528 VanDerWaalsContact C-N 3.32Å; M526-E528 PolarHBondContact O-N 2.99Å; M526-Q529 PolarHBondContact O-N 3.49Å; M526-I530 HydrophobicContact CB-CD1 4.34Å; M526-I530 WeakPolarHBondContact O-CD1 3.24Å; M526-I530 VanDerWaalsContact O-CG1 3.28Å; M526-I530 WeakPolarHBondContact O-CG1 3.38Å; M526-I530 PolarHBondContact O-N 2.9Å; M526-I530 HydrophobicContact SD-CD1 4.18Å; M526-F573 HydrophobicContact CE-CD2 3.27Å; M526-F573 HydrophobicContact CE-CE2 3.42Å; M526-F573 VanDerWaalsContact CE-CE2 3.42Å; M526-F573 HydrophobicContact CE-CG 4.46Å; M526-P621 WeakPolarHBondContact SD-CD 3.48Å; M526-P621 HydrophobicContact SD-CG 3.77Å; M526-W624 HydrophobicContact CE-CD2 4.33Å; M526-W624 HydrophobicContact CE-CE3 4.03Å
527	P	96.3	Very high	95.2	Very high	81 Å²	81	65.2 Å²	65.2	53%	0.526	35%	0.345	S	S	.	.	H	α-helix	trans	-59.6	-40.4	-175	-25.6	35.6	0	0	0	113.2	C523 A531	C523-P527 VanDerWaalsContact O-CD 3.28Å; C523-P527 WeakPolarHBondContact O-CD 3.28Å; P527-A531 WeakPolarHBondContact O-CB 3.32Å; P527-A531 PolarHBondContact O-N 3.1Å
528	E	95.4	Very high	94.9	Very high	116 Å²	116	64.8 Å²	64.8	54%	0.542	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-43.5	176.9	-73.7	-166.2	-153	0	0	112.6	V525 M526 I530 A531 K532	V525-E528 PolarHBondContact O-N 3.31Å; M526-E528 VanDerWaalsContact C-N 3.32Å; M526-E528 PolarHBondContact O-N 2.99Å; E528-I530 VanDerWaalsContact C-N 3.34Å; E528-A531 PolarHBondContact O-N 3.44Å; E528-K532 WeakPolarHBondContact O-CB 3.48Å; E528-K532 WeakPolarHBondContact O-CD 3.4Å; E528-K532 VanDerWaalsContact O-CG 3.24Å; E528-K532 WeakPolarHBondContact O-CG 3.32Å; E528-K532 PolarHBondContact O-N 3.08Å; E528-K532 IonicContact OE2-NZ 3.07Å; E528-K532 PolarHBondContact OE2-NZ 2.91Å
529	Q	95.3	Very high	94.6	Very high	12 Å²	12	67.2 Å²	67.2	6%	0.056	37%	0.366	C	S	.	.	H	α-helix	trans	-66.8	-38.6	-179.4	-63.8	-165.8	19.9	0	0	111.2	V525 M526 K532 Y533 I574 W624	V525-Q529 HydrophobicContact CG1-CG 4.15Å; V525-Q529 PolarHBondContact O-N 2.69Å; M526-Q529 PolarHBondContact O-N 3.49Å; Q529-K532 PolarHBondContact O-N 3.04Å; Q529-Y533 VanDerWaalsContact O-CB 3.32Å; Q529-Y533 WeakPolarHBondContact O-CB 3.46Å; Q529-Y533 PolarHBondContact O-N 3.4Å; Q529-I574 PolarHBondContact NE2-O 2.78Å; Q529-W624 HydrophobicContact CB-CH2 4.29Å; Q529-W624 HydrophobicContact CB-CZ3 4Å; Q529-W624 WeakPolarHBondContact O-CH2 3.38Å
530	I	94.8	Very high	94.1	Very high	56 Å²	56	65.9 Å²	65.9	29%	0.287	36%	0.361	S	S	.	.	H	α-helix	trans	-63.4	-43.3	173.1	-66.1	163.5	0	0	0	110.7	M526 E528 Y533 N534 P621 W624	M526-I530 HydrophobicContact CB-CD1 4.34Å; M526-I530 WeakPolarHBondContact O-CD1 3.24Å; M526-I530 VanDerWaalsContact O-CG1 3.28Å; M526-I530 WeakPolarHBondContact O-CG1 3.38Å; M526-I530 PolarHBondContact O-N 2.9Å; M526-I530 HydrophobicContact SD-CD1 4.18Å; E528-I530 VanDerWaalsContact C-N 3.34Å; I530-Y533 PolarHBondContact O-N 3.25Å; I530-N534 WeakPolarHBondContact O-CB 3.28Å; I530-N534 PolarHBondContact O-N 2.88Å; I530-N534 PolarHBondContact O-ND2 3.46Å; I530-P621 HydrophobicContact CD1-CG 4.46Å; I530-W624 HydrophobicContact CB-CZ2 4.34Å; I530-W624 HydrophobicContact CG1-CH2 4.23Å; I530-W624 HydrophobicContact CG1-CZ2 3.68Å
531	A	95.3	Very high	93.6	Very high	50 Å²	50	63.2 Å²	63.2	41%	0.413	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-46.7	176	0	0	0	0	0	112.2	P527 E528 Y533 N534 M535	P527-A531 WeakPolarHBondContact O-CB 3.32Å; P527-A531 PolarHBondContact O-N 3.1Å; E528-A531 PolarHBondContact O-N 3.44Å; A531-Y533 PolarHBondContact O-N 3.13Å; A531-N534 PolarHBondContact O-N 3.07Å; A531-M535 WeakPolarHBondContact O-CG 3.4Å; A531-M535 PolarHBondContact O-N 3.22Å
532	K	93.3	Very high	93.1	Very high	119 Å²	119	65.3 Å²	65.3	52%	0.517	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-44.3	176.6	-73.1	159.5	179.1	162.7	0	111.5	E528 Q529 M535 E536	E528-K532 WeakPolarHBondContact O-CB 3.48Å; E528-K532 WeakPolarHBondContact O-CD 3.4Å; E528-K532 VanDerWaalsContact O-CG 3.24Å; E528-K532 WeakPolarHBondContact O-CG 3.32Å; E528-K532 PolarHBondContact O-N 3.08Å; E528-K532 IonicContact OE2-NZ 3.07Å; E528-K532 PolarHBondContact OE2-NZ 2.91Å; Q529-K532 PolarHBondContact O-N 3.04Å; K532-M535 PolarHBondContact O-N 3.02Å; K532-E536 PolarHBondContact O-N 3.47Å
533	Y	94.4	Very high	92.4	Very high	47 Å²	47	72.1 Å²	72.1	18%	0.184	40%	0.395	C	S	.	.	H	α-helix	trans	-62.2	-46.6	174.1	171.7	-88.1	0	0	0	112.6	Q529 I530 A531 M535 E536 C537 P569 K571 W624	Q529-Y533 VanDerWaalsContact O-CB 3.32Å; Q529-Y533 WeakPolarHBondContact O-CB 3.46Å; Q529-Y533 PolarHBondContact O-N 3.4Å; I530-Y533 PolarHBondContact O-N 3.25Å; A531-Y533 PolarHBondContact O-N 3.13Å; Y533-M535 VanDerWaalsContact C-N 3.28Å; Y533-M535 PolarHBondContact O-N 3.48Å; Y533-E536 PolarHBondContact O-N 3.04Å; Y533-E536 VanDerWaalsContact O-N 3.11Å; Y533-C537 VanDerWaalsContact CE1-SG 3.56Å; Y533-C537 PolarHBondContact O-N 3.31Å; Y533-C537 PolarHBondContact O-SG 3.01Å; Y533-C537 VanDerWaalsContact O-SG 3.34Å; Y533-P569 HydrophobicContact CD2-CB 4.04Å; Y533-P569 HydrophobicContact CE2-CB 3.81Å; Y533-P569 VanDerWaalsContact CE2-O 3.24Å; Y533-P569 WeakPolarHBondContact CE2-O 3.45Å; Y533-P569 PolarHBondContact OH-O 2.86Å; Y533-K571 HydrophobicContact CD2-CG 4.21Å; Y533-K571 HydrophobicContact CE1-CG 4.33Å; Y533-K571 HydrophobicContact CE2-CB 4.25Å; Y533-K571 HydrophobicContact CE2-CG 3.51Å; Y533-W624 HydrophobicContact CD1-CZ2 4.31Å; Y533-W624 HydrophobicContact CD2-CH2 4.36Å; Y533-W624 HydrophobicContact CG-CH2 4.02Å; Y533-W624 HydrophobicContact CG-CZ2 4.05Å
534	N	92.9	Very high	91.7	Very high	81 Å²	81	72.8 Å²	72.8	43%	0.433	39%	0.392	S	S	.	.	H	α-helix	trans	-62.4	-36.5	177.9	-70.9	-13.2	0	0	0	111.7	I530 A531 C537 M538	I530-N534 WeakPolarHBondContact O-CB 3.28Å; I530-N534 PolarHBondContact O-N 2.88Å; I530-N534 PolarHBondContact O-ND2 3.46Å; A531-N534 PolarHBondContact O-N 3.07Å; N534-C537 WeakPolarHBondContact O-CB 3.41Å; N534-C537 PolarHBondContact O-N 3.42Å; N534-M538 WeakPolarHBondContact O-CG 3.41Å; N534-M538 PolarHBondContact O-N 2.86Å
535	M	93	Very high	90.5	Very high	128 Å²	128	74.6 Å²	74.6	63%	0.631	39%	0.391	S	S	*	.	H	α-helix	trans	-66.2	-40	172.1	-71.6	-177.1	71.5	0	0	112.5	A531 K532 Y533 C537 M538 A539	A531-M535 WeakPolarHBondContact O-CG 3.4Å; A531-M535 PolarHBondContact O-N 3.22Å; K532-M535 PolarHBondContact O-N 3.02Å; Y533-M535 VanDerWaalsContact C-N 3.28Å; Y533-M535 PolarHBondContact O-N 3.48Å; M535-C537 VanDerWaalsContact C-N 3.31Å; M535-C537 PolarHBondContact O-N 3.45Å; M535-M538 HydrophobicContact CG-CE 4.14Å; M535-M538 PolarHBondContact O-N 2.65Å; M535-A539 VanDerWaalsContact O-CB 3.23Å; M535-A539 WeakPolarHBondContact O-CB 3.23Å; M535-A539 PolarHBondContact O-N 2.82Å
536	E	91.3	Very high	89.3	Confident	90 Å²	90	77 Å²	77	42%	0.421	41%	0.409	S	S	.	.	H	α-helix	trans	-63.3	-38	173.7	-159.9	-161.8	137.4	0	0	111.6	K532 Y533 A539 K540 P569	K532-E536 PolarHBondContact O-N 3.47Å; Y533-E536 PolarHBondContact O-N 3.04Å; Y533-E536 VanDerWaalsContact O-N 3.11Å; E536-A539 PolarHBondContact O-N 2.92Å; E536-K540 PolarHBondContact O-N 2.73Å; E536-K540 VanDerWaalsContact OE1-CE 3.25Å; E536-K540 WeakPolarHBondContact OE1-CE 3.25Å; E536-K540 IonicContact OE1-NZ 3.73Å; E536-K540 PolarHBondContact OE1-NZ 2.97Å; E536-P569 HydrophobicContact CB-CB 4.26Å; E536-P569 HydrophobicContact CB-CG 3.84Å; E536-P569 HydrophobicContact CG-CB 4.21Å; E536-P569 HydrophobicContact CG-CG 3.76Å; E536-P569 WeakPolarHBondContact OE1-CB 3.33Å; E536-P569 WeakPolarHBondContact OE1-CG 3.24Å
537	C	90.9	Very high	87.5	Confident	37 Å²	37	83 Å²	83	25%	0.25	44%	0.437	C	S	.	.	H	α-helix	trans	-61.5	-52.2	175.1	-68.8	0	0	0	0	111.1	Y533 N534 M535 A539 K540 V541 P569	Y533-C537 VanDerWaalsContact CE1-SG 3.56Å; Y533-C537 PolarHBondContact O-N 3.31Å; Y533-C537 PolarHBondContact O-SG 3.01Å; Y533-C537 VanDerWaalsContact O-SG 3.34Å; N534-C537 WeakPolarHBondContact O-CB 3.41Å; N534-C537 PolarHBondContact O-N 3.42Å; M535-C537 VanDerWaalsContact C-N 3.31Å; M535-C537 PolarHBondContact O-N 3.45Å; C537-A539 VanDerWaalsContact C-N 3.32Å; C537-A539 PolarHBondContact O-N 3.29Å; C537-K540 PolarHBondContact O-N 2.95Å; C537-V541 PolarHBondContact O-N 3.48Å; C537-V541 VanDerWaalsContact O-N 3.14Å; C537-P569 HydrophobicContact CB-CG 4.38Å; C537-P569 VanDerWaalsContact SG-CG 3.6Å
538	M	89.4	Confident	85.3	Confident	124 Å²	124	86.5 Å²	86.5	61%	0.611	45%	0.447	S	S	*	.	H	α-helix	trans	-61.6	-39.7	177.4	-68.9	-175.8	-65.2	0	0	112	N534 M535 K540 V541 A542	N534-M538 WeakPolarHBondContact O-CG 3.41Å; N534-M538 PolarHBondContact O-N 2.86Å; M535-M538 HydrophobicContact CG-CE 4.14Å; M535-M538 PolarHBondContact O-N 2.65Å; M538-K540 PolarHBondContact O-N 3.2Å; M538-V541 PolarHBondContact O-N 2.92Å; M538-A542 WeakPolarHBondContact O-CB 3.12Å; M538-A542 PolarHBondContact O-N 2.64Å
539	A	91.1	Very high	83.2	Confident	51 Å²	51	83.2 Å²	83.2	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-66	-34.8	178.7	0	0	0	0	0	112.9	M535 E536 C537 K543	M535-A539 VanDerWaalsContact O-CB 3.23Å; M535-A539 WeakPolarHBondContact O-CB 3.23Å; M535-A539 PolarHBondContact O-N 2.82Å; E536-A539 PolarHBondContact O-N 2.92Å; C537-A539 VanDerWaalsContact C-N 3.32Å; C537-A539 PolarHBondContact O-N 3.29Å; A539-K543 WeakPolarHBondContact O-CB 3.48Å; A539-K543 WeakPolarHBondContact O-CG 3.42Å; A539-K543 PolarHBondContact O-N 3.23Å
540	K	86.1	Confident	81	Confident	78 Å²	78	89.9 Å²	89.9	34%	0.339	48%	0.48	S	S	.	.	H	α-helix	trans	-71.2	-41	174.2	-78.8	179.2	178.6	163.6	0	112.6	E536 C537 M538 A542 K543 Q544 P569	E536-K540 PolarHBondContact O-N 2.73Å; E536-K540 VanDerWaalsContact OE1-CE 3.25Å; E536-K540 WeakPolarHBondContact OE1-CE 3.25Å; E536-K540 IonicContact OE1-NZ 3.73Å; E536-K540 PolarHBondContact OE1-NZ 2.97Å; C537-K540 PolarHBondContact O-N 2.95Å; M538-K540 PolarHBondContact O-N 3.2Å; K540-A542 VanDerWaalsContact C-N 3.35Å; K540-K543 PolarHBondContact O-N 3.25Å; K540-Q544 WeakPolarHBondContact O-CG 3.46Å; K540-Q544 PolarHBondContact O-N 3.21Å; K540-P569 HydrophobicContact CD-CG 3.94Å
541	V	86.6	Confident	78.8	Confident	54 Å²	54	97 Å²	97	33%	0.327	50%	0.503	S	S	.	.	H	α-helix	trans	-62	-43.9	173.6	174.8	0	0	0	0	110.8	C537 M538 K543 Q544 Q545	C537-V541 PolarHBondContact O-N 3.48Å; C537-V541 VanDerWaalsContact O-N 3.14Å; M538-V541 PolarHBondContact O-N 2.92Å; V541-K543 PolarHBondContact O-N 3.32Å; V541-Q544 PolarHBondContact O-N 3.39Å; V541-Q545 WeakPolarHBondContact O-CG 3.36Å; V541-Q545 PolarHBondContact O-N 2.98Å
542	A	87.3	Confident	76.4	Confident	53 Å²	53	101.9 Å²	101.9	44%	0.438	52%	0.522	S	S	.	.	H	α-helix	trans	-62.2	-41.3	175.7	0	0	0	0	0	112.5	M538 K540 Q545 S546	M538-A542 WeakPolarHBondContact O-CB 3.12Å; M538-A542 PolarHBondContact O-N 2.64Å; K540-A542 VanDerWaalsContact C-N 3.35Å; A542-Q545 PolarHBondContact O-N 3.27Å; A542-S546 PolarHBondContact O-N 3.32Å; A542-S546 PolarHBondContact O-OG 2.92Å
543	K	83.1	Confident	74.2	Confident	143 Å²	143	99.9 Å²	99.9	62%	0.622	54%	0.535	S	S	*	.	H	α-helix	trans	-63.4	-43.9	175.6	-81.3	-169.9	173.6	-158.6	0	112.9	A539 K540 V541 Q545 S546 E547	A539-K543 WeakPolarHBondContact O-CB 3.48Å; A539-K543 WeakPolarHBondContact O-CG 3.42Å; A539-K543 PolarHBondContact O-N 3.23Å; K540-K543 PolarHBondContact O-N 3.25Å; V541-K543 PolarHBondContact O-N 3.32Å; K543-Q545 VanDerWaalsContact C-N 3.3Å; K543-Q545 PolarHBondContact O-N 2.63Å; K543-S546 WeakPolarHBondContact CA-OG 3.46Å; K543-S546 PolarHBondContact O-N 2.93Å; K543-S546 VanDerWaalsContact O-N 3.16Å; K543-S546 PolarHBondContact O-OG 3.37Å; K543-E547 WeakPolarHBondContact O-CB 3.42Å; K543-E547 PolarHBondContact O-N 2.85Å
544	Q	79.4	Confident	71.7	Confident	88 Å²	88	102 Å²	102	41%	0.411	56%	0.557	S	S	.	*	H	α-helix	trans	-58.7	-43.4	174.3	-73.8	173.5	-31.1	0	0	111.2	K540 V541 S546 E547 E548	K540-Q544 WeakPolarHBondContact O-CG 3.46Å; K540-Q544 PolarHBondContact O-N 3.21Å; V541-Q544 PolarHBondContact O-N 3.39Å; Q544-S546 VanDerWaalsContact C-N 3.3Å; Q544-S546 PolarHBondContact O-N 3.37Å; Q544-E547 PolarHBondContact O-N 2.99Å; Q544-E548 WeakPolarHBondContact O-CB 3.39Å; Q544-E548 PolarHBondContact O-N 3.26Å
545	Q	72.4	Confident	69	Low	118 Å²	118	106.7 Å²	106.7	55%	0.551	58%	0.576	S	S	*	*	H	α-helix	trans	-65.9	-26.9	177.1	-71.2	175.3	-8.3	0	0	114.1	V541 A542 K543	V541-Q545 WeakPolarHBondContact O-CG 3.36Å; V541-Q545 PolarHBondContact O-N 2.98Å; A542-Q545 PolarHBondContact O-N 3.27Å; K543-Q545 VanDerWaalsContact C-N 3.3Å; K543-Q545 PolarHBondContact O-N 2.63Å
546	S	70.8	Confident	66.3	Low	79 Å²	79	108.6 Å²	108.6	55%	0.552	58%	0.584	S	S	*	*	H	α-helix	trans	-82.5	-35.9	171.5	53.5	0	0	0	0	113.5	A542 K543 Q544 G549	A542-S546 PolarHBondContact O-N 3.32Å; A542-S546 PolarHBondContact O-OG 2.92Å; K543-S546 WeakPolarHBondContact CA-OG 3.46Å; K543-S546 PolarHBondContact O-N 2.93Å; K543-S546 VanDerWaalsContact O-N 3.16Å; K543-S546 PolarHBondContact O-OG 3.37Å; Q544-S546 VanDerWaalsContact C-N 3.3Å; Q544-S546 PolarHBondContact O-N 3.37Å; S546-G549 PolarHBondContact O-N 3.47Å
547	E	57.8	Low	63.9	Low	137 Å²	137	112.9 Å²	112.9	64%	0.64	60%	0.603	S	S	*	*	H	α-helix	trans	-75.9	-31.1	-175.1	-163.6	174.9	134.2	0	0	112.3	K543 Q544 G549	K543-E547 WeakPolarHBondContact O-CB 3.42Å; K543-E547 PolarHBondContact O-N 2.85Å; Q544-E547 PolarHBondContact O-N 2.99Å; E547-G549 PolarHBondContact O-N 3.45Å
548	E	50.8	Low	61.8	Low	156 Å²	156	117.7 Å²	117.7	73%	0.729	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-66	-25.3	170	-158.9	85	-120	0	0	112.3	Q544	Q544-E548 WeakPolarHBondContact O-CB 3.39Å; Q544-E548 PolarHBondContact O-N 3.26Å
549	G	50.5	Low	59.7	Low	46 Å²	46	118.4 Å²	118.4	47%	0.474	63%	0.633	S	S	.	*	G	3₁₀ helix	trans	-78.3	-23.3	-172	0	0	0	0	0	115.7	S546 E547	S546-G549 PolarHBondContact O-N 3.47Å; E547-G549 PolarHBondContact O-N 3.45Å
550	D	49.4	Very low	57.6	Low	153 Å²	153	122.8 Å²	122.8	82%	0.818	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-97.5	-2.5	-173.4	-125	-3.7	0	0	0	113.3	N552	D550-N552 PolarHBondContact O-N 2.91Å
551	R	49.6	Very low	55.5	Low	206 Å²	206	127 Å²	127	78%	0.777	66%	0.663	S	S	*	*			trans	-81.9	49.8	-178.9	-73.1	-171	165.4	-146	-7.1	113.7
552	N	43.4	Very low	53.4	Low	152 Å²	152	131.3 Å²	131.3	81%	0.813	69%	0.692	S	S	*	*			trans	-100.2	72.5	177.1	-82.8	-55.4	0	0	0	113.5	D550	D550-N552 PolarHBondContact O-N 2.91Å
553	G	48.8	Very low	51.6	Low	77 Å²	77	131.5 Å²	131.5	79%	0.794	70%	0.7	S	S	*	*			trans	88.3	80.7	133.7	0	0	0	0	0	121.1
554	S	42.2	Very low	50	Low	92 Å²	92	132.1 Å²	132.1	64%	0.643	70%	0.702	S	S	*	*				-158.3	151.9	129.7	60	0	0	0	0	110.3
555	E	35.8	Very low	48.7	Very low	179 Å²	179	138.8 Å²	138.8	84%	0.836	72%	0.724	S	S	*	*			trans	49.9	172.7	161.5	77.3	-142.6	-157.5	0	0	119.3
556	E	34.8	Very low	47.6	Very low	168 Å²	168	138.3 Å²	138.3	79%	0.785	73%	0.728	S	S	*	*				-158.4	151.6	-50.8	171.5	161.4	-150.2	0	0	106.6
557	E	40.8	Very low	47.1	Very low	179 Å²	179	140.8 Å²	140.8	84%	0.836	73%	0.733	S	S	*	*			trans	56.7	180	178.4	-78.3	-176.3	137.2	0	0	115.2
558	D	47.5	Very low	47.8	Very low	139 Å²	139	136.1 Å²	136.1	74%	0.743	72%	0.722	S	S	*	*				-144.6	165	-54	-174.5	30.1	0	0	0	108.6
559	D	45.7	Very low	49.4	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	69%	0.69	S	S	*	*			trans	20.2	93.9	165	-141.6	-11.8	0	0	0	120.7
560	E	47.4	Very low	51	Low	142 Å²	142	136.1 Å²	136.1	66%	0.664	70%	0.702	S	S	*	*			trans	-150.7	95.2	145.8	-125.3	-149.4	147.7	0	0	116.1	K564	E560-K564 IonicContact OE1-NZ 3.21Å; E560-K564 PolarHBondContact OE1-NZ 3.46Å; E560-K564 IonicContact OE2-NZ 3.03Å; E560-K564 PolarHBondContact OE2-NZ 3.39Å
561	K	41.4	Very low	53.1	Low	167 Å²	167	133 Å²	133	73%	0.726	68%	0.681	S	S	*	*			trans	34.2	95.7	133.5	-162.2	167.8	-168	162.1	0	118.7	G563	K561-G563 PolarHBondContact O-N 3.45Å
562	P	43.5	Very low	55	Low	144 Å²	144	130.7 Å²	130.7	94%	0.935	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	85.4	177.4	31.2	-35.9	0	0	0	112.4
563	G	49.6	Very low	57.5	Low	58 Å²	58	124.4 Å²	124.4	60%	0.598	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.5	-23.7	-174.8	0	0	0	0	0	117.7	K561 R565	K561-G563 PolarHBondContact O-N 3.45Å; G563-R565 PolarHBondContact O-N 2.94Å
564	K	47.9	Very low	59.6	Low	156 Å²	156	125.9 Å²	125.9	68%	0.678	63%	0.631	S	S	*	*			trans	-79.5	64.7	-177.7	-64.5	169.2	-165.7	156.3	0	111.4	E560 V566	E560-K564 IonicContact OE1-NZ 3.21Å; E560-K564 PolarHBondContact OE1-NZ 3.46Å; E560-K564 IonicContact OE2-NZ 3.03Å; E560-K564 PolarHBondContact OE2-NZ 3.39Å; K564-V566 PolarHBondContact O-N 3.43Å
565	R	52.1	Low	62.1	Low	228 Å²	228	122.5 Å²	122.5	86%	0.86	60%	0.604	S	S	*	*			trans	-51.1	116.6	168.8	-76.8	-169.7	-77.2	-171.3	-3.8	108.5	G563 M567	G563-R565 PolarHBondContact O-N 2.94Å; R565-M567 PolarHBondContact O-N 3Å
566	V	49.3	Very low	64.9	Low	107 Å²	107	117.2 Å²	117.2	65%	0.648	58%	0.581	S	S	*	*			trans	-69	86.5	177.2	-179.4	0	0	0	0	108.2	K564 G568	K564-V566 PolarHBondContact O-N 3.43Å; V566-G568 PolarHBondContact O-N 3.11Å
567	M	61.1	Low	67.8	Low	131 Å²	131	114.6 Å²	114.6	65%	0.645	57%	0.573	S	S	*	*			trans	-56.6	134.9	176.5	-169	64.6	69.7	0	0	108.6	R565	R565-M567 PolarHBondContact O-N 3Å
568	G	72.7	Confident	70.4	Confident	40 Å²	40	113.5 Å²	113.5	41%	0.412	57%	0.565	S	S	.	*			trans	-58.1	174.1	178.6	0	0	0	0	0	112.9	V566 R570	V566-G568 PolarHBondContact O-N 3.11Å; G568-R570 PolarHBondContact O-N 3.41Å
569	P	83.1	Confident	72.7	Confident	9 Å²	9	107 Å²	107	6%	0.058	53%	0.53	C	S	.	.			trans	-44.6	133	167.7	-26.4	36.8	0	0	0	110.5	Y533 E536 C537 K540	Y533-P569 HydrophobicContact CD2-CB 4.04Å; Y533-P569 HydrophobicContact CE2-CB 3.81Å; Y533-P569 VanDerWaalsContact CE2-O 3.24Å; Y533-P569 WeakPolarHBondContact CE2-O 3.45Å; Y533-P569 PolarHBondContact OH-O 2.86Å; E536-P569 HydrophobicContact CB-CB 4.26Å; E536-P569 HydrophobicContact CB-CG 3.84Å; E536-P569 HydrophobicContact CG-CB 4.21Å; E536-P569 HydrophobicContact CG-CG 3.76Å; E536-P569 WeakPolarHBondContact OE1-CB 3.33Å; E536-P569 WeakPolarHBondContact OE1-CG 3.24Å; C537-P569 HydrophobicContact CB-CG 4.38Å; C537-P569 VanDerWaalsContact SG-CG 3.6Å; K540-P569 HydrophobicContact CD-CG 3.94Å
570	R	85.9	Confident	75.1	Confident	193 Å²	193	104 Å²	104	73%	0.728	51%	0.509	S	S	*	.			trans	-85	127.7	174.7	-71.2	-169.7	178.3	-162.9	0.2	108.6	G568 K572	G568-R570 PolarHBondContact O-N 3.41Å; R570-K572 PolarHBondContact O-N 3.34Å; R570-K572 VanDerWaalsContact O-N 3.08Å
571	K	91.6	Very high	77.4	Confident	87 Å²	87	100.9 Å²	100.9	38%	0.378	50%	0.499	S	S	.	.			trans	-53.9	115.6	171.6	-64.4	167	-171.8	162.6	0	108	Y533 G623 W624	Y533-K571 HydrophobicContact CD2-CG 4.21Å; Y533-K571 HydrophobicContact CE1-CG 4.33Å; Y533-K571 HydrophobicContact CE2-CB 4.25Å; Y533-K571 HydrophobicContact CE2-CG 3.51Å; K571-G623 WeakPolarHBondContact CB-O 3.26Å; K571-W624 HydrophobicContact CB-CD2 4.26Å; K571-W624 HydrophobicContact CB-CG 4.49Å; K571-W624 HydrophobicContact CG-CZ2 4.44Å
572	K	90.7	Very high	80	Confident	157 Å²	157	94.3 Å²	94.3	68%	0.683	47%	0.472	S	S	*	.			trans	-137.4	118.4	-179.8	-75.5	179	179.9	-179.9	0	107.5	R570 I574	R570-K572 PolarHBondContact O-N 3.34Å; R570-K572 VanDerWaalsContact O-N 3.08Å; K572-I574 PolarHBondContact O-N 3.41Å
573	F	94.8	Very high	82.6	Confident	20 Å²	20	87.4 Å²	87.4	9%	0.088	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-70	127.4	171.1	-173	-120.1	0	0	0	110.3	M526 W575 L579 W620 M625	M526-F573 HydrophobicContact CE-CD2 3.27Å; M526-F573 HydrophobicContact CE-CE2 3.42Å; M526-F573 VanDerWaalsContact CE-CE2 3.42Å; M526-F573 HydrophobicContact CE-CG 4.46Å; F573-W575 AromaticContact CD1-CD1 3.9Å; F573-W575 AromaticContact CD1-CD2 3.74Å; F573-W575 HydrophobicContact CD1-CD2 3.74Å; F573-W575 AromaticContact CD1-CE2 3.57Å; F573-W575 HydrophobicContact CD1-CE3 4.33Å; F573-W575 AromaticContact CD1-CG 3.95Å; F573-W575 HydrophobicContact CD1-CG 3.95Å; F573-W575 HydrophobicContact CD1-CZ2 4.02Å; F573-W575 AromaticContact CD1-NE1 3.69Å; F573-W575 AromaticContact CE1-CD2 3.7Å; F573-W575 HydrophobicContact CE1-CD2 3.7Å; F573-W575 AromaticContact CE1-CE2 3.88Å; F573-W575 AromaticContact CE1-CE3 3.83Å; F573-W575 HydrophobicContact CE1-CE3 3.83Å; F573-W575 HydrophobicContact CE1-CG 4.18Å; F573-W575 HydrophobicContact CE1-CH2 4.22Å; F573-W575 HydrophobicContact CE1-CZ2 4.15Å; F573-W575 HydrophobicContact CE1-CZ3 4.08Å; F573-L579 HydrophobicContact CE1-CD1 4.17Å; F573-L579 HydrophobicContact CZ-CD1 3.62Å; F573-W620 HydrophobicContact CD1-CZ2 4.25Å; F573-W620 AromaticContact CD1-NE1 3.41Å; F573-W620 AromaticContact CD2-CD1 3.79Å; F573-W620 AromaticContact CD2-NE1 3.35Å; F573-W620 VanDerWaalsContact CD2-NE1 3.35Å; F573-W620 AromaticContact CE1-CE2 3.83Å; F573-W620 AromaticContact CE1-CZ2 3.71Å; F573-W620 HydrophobicContact CE1-CZ2 3.71Å; F573-W620 AromaticContact CE1-NE1 3.34Å; F573-W620 VanDerWaalsContact CE1-NE1 3.34Å; F573-W620 AromaticContact CE2-NE1 3.29Å; F573-W620 VanDerWaalsContact CE2-NE1 3.29Å; F573-W620 AromaticContact CG-CD1 3.98Å; F573-W620 AromaticContact CG-NE1 3.39Å; F573-W620 AromaticContact CZ-CE2 3.95Å; F573-W620 HydrophobicContact CZ-CZ2 4.04Å; F573-W620 AromaticContact CZ-NE1 3.25Å; F573-W620 VanDerWaalsContact CZ-NE1 3.25Å; F573-M625 HydrophobicContact CB-CE 3.67Å; F573-M625 HydrophobicContact CD1-CE 3.43Å; F573-M625 VanDerWaalsContact CD1-CE 3.43Å; F573-M625 HydrophobicContact CE1-CE 4.27Å; F573-M625 HydrophobicContact CG-CE 3.79Å
574	I	93.4	Very high	84.8	Confident	108 Å²	108	85.5 Å²	85.5	55%	0.554	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-84.9	129	168.9	-56.7	173.4	0	0	0	107	Q529 K572	Q529-I574 PolarHBondContact NE2-O 2.78Å; K572-I574 PolarHBondContact O-N 3.41Å
575	W	95.2	Very high	87	Confident	22 Å²	22	82.1 Å²	82.1	8%	0.083	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-99	116.6	-176.7	-81.1	97.8	0	0	0	111.1	F573 L579 R580 L583 W620 M625 L630 E633	F573-W575 AromaticContact CD1-CD1 3.9Å; F573-W575 AromaticContact CD1-CD2 3.74Å; F573-W575 HydrophobicContact CD1-CD2 3.74Å; F573-W575 AromaticContact CD1-CE2 3.57Å; F573-W575 HydrophobicContact CD1-CE3 4.33Å; F573-W575 AromaticContact CD1-CG 3.95Å; F573-W575 HydrophobicContact CD1-CG 3.95Å; F573-W575 HydrophobicContact CD1-CZ2 4.02Å; F573-W575 AromaticContact CD1-NE1 3.69Å; F573-W575 AromaticContact CE1-CD2 3.7Å; F573-W575 HydrophobicContact CE1-CD2 3.7Å; F573-W575 AromaticContact CE1-CE2 3.88Å; F573-W575 AromaticContact CE1-CE3 3.83Å; F573-W575 HydrophobicContact CE1-CE3 3.83Å; F573-W575 HydrophobicContact CE1-CG 4.18Å; F573-W575 HydrophobicContact CE1-CH2 4.22Å; F573-W575 HydrophobicContact CE1-CZ2 4.15Å; F573-W575 HydrophobicContact CE1-CZ3 4.08Å; W575-L579 HydrophobicContact CE3-CB 3.93Å; W575-L579 HydrophobicContact CZ3-CB 4.08Å; W575-R580 HydrophobicContact CB-CG 4.33Å; W575-R580 HydrophobicContact CE3-CG 4.02Å; W575-R580 PolarHBondContact O-NH1 3.3Å; W575-R580 PolarHBondContact O-NH2 3.06Å; W575-L583 HydrophobicContact CH2-CD2 3.73Å; W575-L583 HydrophobicContact CZ2-CD2 4.43Å; W575-L583 HydrophobicContact CZ3-CB 4.34Å; W575-L583 HydrophobicContact CZ3-CD2 4.13Å; W575-W620 AromaticContact CH2-CH2 3.83Å; W575-W620 HydrophobicContact CH2-CH2 3.83Å; W575-W620 AromaticContact CH2-CZ2 3.64Å; W575-W620 HydrophobicContact CH2-CZ2 3.64Å; W575-W620 HydrophobicContact CZ2-CZ2 4.13Å; W575-W620 HydrophobicContact CZ3-CZ2 4.25Å; W575-M625 HydrophobicContact CH2-CE 4.31Å; W575-M625 HydrophobicContact CZ2-CE 3.4Å; W575-M625 HydrophobicContact CZ2-SD 4.03Å; W575-L630 HydrophobicContact CH2-CD2 3.83Å; W575-L630 HydrophobicContact CZ2-CD2 3.89Å; W575-E633 HydrophobicContact CD2-CG 4.19Å; W575-E633 HydrophobicContact CG-CG 4.37Å; W575-E633 HydrophobicContact CZ2-CB 4.46Å; W575-E633 HydrophobicContact CZ2-CG 4.23Å
576	D	94.4	Very high	89.1	Confident	67 Å²	67	71.2 Å²	71.2	36%	0.358	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-82.2	149.6	167.5	-48.9	-35.8	0	0	0	110	V525 K578 L579 R580	V525-D576 WeakPolarHBondContact CG2-OD2 3.25Å; D576-K578 VanDerWaalsContact C-N 3.28Å; D576-K578 PolarHBondContact O-N 3.2Å; D576-L579 HydrophobicContact CB-CD1 4.1Å; D576-L579 WeakPolarHBondContact O-CA 3.43Å; D576-L579 WeakPolarHBondContact O-CB 3.28Å; D576-L579 PolarHBondContact O-N 2.86Å; D576-R580 PolarHBondContact O-N 3.34Å
577	D	95.3	Very high	91.2	Very high	114 Å²	114	66.1 Å²	66.1	61%	0.61	32%	0.322	S	S	*	.	H	α-helix	trans	-65	-33.4	-177.4	-57.9	-52.8	0	0	0	112.5	L579 R580 T581	D577-L579 VanDerWaalsContact C-N 3.26Å; D577-L579 PolarHBondContact O-N 2.58Å; D577-R580 WeakPolarHBondContact O-CB 3.37Å; D577-R580 PolarHBondContact O-N 2.86Å; D577-R580 VanDerWaalsContact O-N 3.16Å; D577-R580 IonicContact OD1-CZ 2.74Å; D577-R580 IonicContact OD1-NH1 2.72Å; D577-R580 PolarHBondContact OD1-NH1 2.81Å; D577-T581 PolarHBondContact O-N 3.35Å; D577-T581 PolarHBondContact O-OG1 2.9Å
578	K	95	Very high	92.7	Very high	156 Å²	156	62.2 Å²	62.2	68%	0.678	31%	0.307	S	S	*	.	H	α-helix	trans	-56.7	-37.9	169.8	-176.6	179.9	178.6	-177.4	0	112.6	D576 L582	D576-K578 VanDerWaalsContact C-N 3.28Å; D576-K578 PolarHBondContact O-N 3.2Å; K578-L582 HydrophobicContact CG-CD1 4.36Å; K578-L582 WeakPolarHBondContact O-CB 3.18Å; K578-L582 VanDerWaalsContact O-CG 3.24Å; K578-L582 WeakPolarHBondContact O-CG 3.14Å; K578-L582 PolarHBondContact O-N 3.15Å
579	L	96.3	Very high	93.6	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-73.9	-39.5	176.7	-81.3	158.4	0	0	0	111.5	L518 A521 V522 V525 F573 W575 D576 D577 L582 L583	L518-L579 HydrophobicContact CD1-CD2 4.05Å; A521-L579 HydrophobicContact CB-CD2 3.63Å; A521-L579 HydrophobicContact CB-CG 4.33Å; V522-L579 HydrophobicContact CG2-CD2 3.66Å; V525-L579 HydrophobicContact CB-CD1 4.29Å; V525-L579 HydrophobicContact CG1-CD1 4.3Å; V525-L579 HydrophobicContact CG2-CD1 4.06Å; F573-L579 HydrophobicContact CE1-CD1 4.17Å; F573-L579 HydrophobicContact CZ-CD1 3.62Å; W575-L579 HydrophobicContact CE3-CB 3.93Å; W575-L579 HydrophobicContact CZ3-CB 4.08Å; D576-L579 HydrophobicContact CB-CD1 4.1Å; D576-L579 WeakPolarHBondContact O-CA 3.43Å; D576-L579 WeakPolarHBondContact O-CB 3.28Å; D576-L579 PolarHBondContact O-N 2.86Å; D577-L579 VanDerWaalsContact C-N 3.26Å; D577-L579 PolarHBondContact O-N 2.58Å; L579-L582 PolarHBondContact O-N 3.29Å; L579-L583 WeakPolarHBondContact O-CB 3.41Å; L579-L583 PolarHBondContact O-N 3.47Å
580	R	96.3	Very high	94	Very high	76 Å²	76	62.6 Å²	62.6	29%	0.287	30%	0.299	S	S	.	.	H	α-helix	trans	-59.4	-49.3	171.5	-65.5	-176.1	177.3	96.7	5.9	111.2	W575 D576 D577 L582 L583 C584 E633	W575-R580 HydrophobicContact CB-CG 4.33Å; W575-R580 HydrophobicContact CE3-CG 4.02Å; W575-R580 PolarHBondContact O-NH1 3.3Å; W575-R580 PolarHBondContact O-NH2 3.06Å; D576-R580 PolarHBondContact O-N 3.34Å; D577-R580 WeakPolarHBondContact O-CB 3.37Å; D577-R580 PolarHBondContact O-N 2.86Å; D577-R580 VanDerWaalsContact O-N 3.16Å; D577-R580 IonicContact OD1-CZ 2.74Å; D577-R580 IonicContact OD1-NH1 2.72Å; D577-R580 PolarHBondContact OD1-NH1 2.81Å; R580-L582 VanDerWaalsContact C-N 3.34Å; R580-L582 PolarHBondContact O-N 3.44Å; R580-L583 PolarHBondContact O-N 2.8Å; R580-C584 WeakPolarHBondContact O-CB 3.12Å; R580-C584 PolarHBondContact O-N 3.18Å; R580-C584 PolarHBondContact O-SG 2.14Å; R580-E633 IonicContact CZ-OE2 2.7Å; R580-E633 IonicContact NE-OE2 3.75Å; R580-E633 PolarHBondContact NE-OE2 2.85Å; R580-E633 IonicContact NH2-OE2 3.08Å
581	T	96.4	Very high	94.2	Very high	76 Å²	76	54.8 Å²	54.8	47%	0.466	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-41.3	177.2	-53.5	0	0	0	0	112.1	D577 C584 N585	D577-T581 PolarHBondContact O-N 3.35Å; D577-T581 PolarHBondContact O-OG1 2.9Å; T581-C584 PolarHBondContact O-N 2.97Å; T581-N585 WeakPolarHBondContact O-CB 3.19Å; T581-N585 PolarHBondContact O-N 3.48Å; T581-N585 PolarHBondContact O-ND2 2.88Å; T581-N585 PolarHBondContact O-OD1 3.3Å
582	L	96.6	Very high	93.9	Very high	29 Å²	29	52.4 Å²	52.4	15%	0.152	27%	0.266	C	S	.	.	H	α-helix	trans	-67	-38.7	176.5	-75.4	170.6	0	0	0	112.8	K517 L518 A521 K578 L579 R580 L586	K517-L582 HydrophobicContact CB-CD2 3.85Å; L518-L582 HydrophobicContact CB-CB 4.37Å; L518-L582 HydrophobicContact CD1-CB 3.91Å; A521-L582 HydrophobicContact CB-CD1 3.61Å; K578-L582 HydrophobicContact CG-CD1 4.36Å; K578-L582 WeakPolarHBondContact O-CB 3.18Å; K578-L582 VanDerWaalsContact O-CG 3.24Å; K578-L582 WeakPolarHBondContact O-CG 3.14Å; K578-L582 PolarHBondContact O-N 3.15Å; L579-L582 PolarHBondContact O-N 3.29Å; R580-L582 VanDerWaalsContact C-N 3.34Å; R580-L582 PolarHBondContact O-N 3.44Å; L582-L586 WeakPolarHBondContact O-CB 3.39Å; L582-L586 PolarHBondContact O-N 3.16Å; L582-L586 VanDerWaalsContact O-N 3.1Å
583	L	96.6	Very high	93.6	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-48.7	172.5	177.9	70.1	0	0	0	111.1	L518 W575 L579 R580 N585 L586 V587 L612 V616 L630 E633	L518-L583 HydrophobicContact CD2-CD1 4.17Å; W575-L583 HydrophobicContact CH2-CD2 3.73Å; W575-L583 HydrophobicContact CZ2-CD2 4.43Å; W575-L583 HydrophobicContact CZ3-CB 4.34Å; W575-L583 HydrophobicContact CZ3-CD2 4.13Å; L579-L583 WeakPolarHBondContact O-CB 3.41Å; L579-L583 PolarHBondContact O-N 3.47Å; R580-L583 PolarHBondContact O-N 2.8Å; L583-N585 PolarHBondContact O-N 3.42Å; L583-L586 WeakPolarHBondContact O-CB 3.47Å; L583-L586 PolarHBondContact O-N 3.42Å; L583-V587 HydrophobicContact CD1-CG2 4.44Å; L583-V587 WeakPolarHBondContact O-CG2 3.07Å; L583-V587 PolarHBondContact O-N 3.38Å; L583-L612 HydrophobicContact CD1-CD2 4.2Å; L583-V616 HydrophobicContact CD1-CG1 3.85Å; L583-L630 HydrophobicContact CD1-CD2 4.13Å; L583-L630 HydrophobicContact CD2-CD2 4.26Å; L583-E633 HydrophobicContact CD2-CB 4.1Å
584	C	95.8	Very high	93.1	Very high	18 Å²	18	46.4 Å²	46.4	12%	0.122	24%	0.239	C	C	.	.	H	α-helix	trans	-55.8	-51.4	176.5	-73.3	0	0	0	0	110.9	R580 T581 L586 V587 S588 V637	R580-C584 WeakPolarHBondContact O-CB 3.12Å; R580-C584 PolarHBondContact O-N 3.18Å; R580-C584 PolarHBondContact O-SG 2.14Å; T581-C584 PolarHBondContact O-N 2.97Å; C584-L586 VanDerWaalsContact C-N 3.3Å; C584-L586 PolarHBondContact O-N 2.98Å; C584-V587 CarbonylContact O-C 3.54Å; C584-V587 PolarHBondContact O-N 3.14Å; C584-S588 PolarHBondContact O-N 2.84Å; C584-S588 PolarHBondContact O-OG 3.11Å; C584-S588 VanDerWaalsContact O-OG 3.04Å; C584-V637 HydrophobicContact CB-CG2 3.56Å
585	N	94.9	Very high	92.5	Very high	84 Å²	84	47.9 Å²	47.9	45%	0.449	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-38.4	179	-69.6	-10.3	0	0	0	112.9	T581 L583 S588 V589	T581-N585 WeakPolarHBondContact O-CB 3.19Å; T581-N585 PolarHBondContact O-N 3.48Å; T581-N585 PolarHBondContact O-ND2 2.88Å; T581-N585 PolarHBondContact O-OD1 3.3Å; L583-N585 PolarHBondContact O-N 3.42Å; N585-S588 PolarHBondContact O-N 3.38Å; N585-V589 WeakPolarHBondContact O-CG2 3.43Å; N585-V589 PolarHBondContact O-N 3.02Å; N585-V589 VanDerWaalsContact O-N 3.14Å
586	L	95.3	Very high	91.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.4	-43.9	174.2	177.1	65	0	0	0	111.6	L511 P514 L515 L518 L582 L583 C584 V589 K590 F611 V616	L511-L586 HydrophobicContact CD2-CD1 4.04Å; P514-L586 HydrophobicContact CB-CB 4.27Å; P514-L586 HydrophobicContact CB-CD1 3.86Å; L515-L586 HydrophobicContact CB-CD1 3.98Å; L515-L586 HydrophobicContact CD1-CD1 4.43Å; L515-L586 HydrophobicContact CD1-CD2 3.71Å; L518-L586 HydrophobicContact CD2-CD2 3.61Å; L582-L586 WeakPolarHBondContact O-CB 3.39Å; L582-L586 PolarHBondContact O-N 3.16Å; L582-L586 VanDerWaalsContact O-N 3.1Å; L583-L586 WeakPolarHBondContact O-CB 3.47Å; L583-L586 PolarHBondContact O-N 3.42Å; C584-L586 VanDerWaalsContact C-N 3.3Å; C584-L586 PolarHBondContact O-N 2.98Å; L586-V589 PolarHBondContact O-N 3.1Å; L586-K590 PolarHBondContact O-N 3.31Å; L586-F611 HydrophobicContact CD1-CZ 3.92Å; L586-F611 HydrophobicContact CD2-CE1 4.31Å; L586-F611 HydrophobicContact CD2-CZ 4.03Å; L586-F611 HydrophobicContact CG-CE1 4.09Å; L586-F611 HydrophobicContact CG-CZ 3.78Å; L586-V616 HydrophobicContact CD2-CG1 4.47Å; L586-V616 HydrophobicContact CD2-CG2 3.73Å
587	V	94.8	Very high	90.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.5	-37.5	176.6	170.4	0	0	0	0	111.7	L583 C584 V589 K590 L591 L608 L612 V637 H638	L583-V587 HydrophobicContact CD1-CG2 4.44Å; L583-V587 WeakPolarHBondContact O-CG2 3.07Å; L583-V587 PolarHBondContact O-N 3.38Å; C584-V587 CarbonylContact O-C 3.54Å; C584-V587 PolarHBondContact O-N 3.14Å; V587-V589 PolarHBondContact O-N 3.39Å; V587-K590 PolarHBondContact O-N 3.13Å; V587-L591 WeakPolarHBondContact O-CB 3.25Å; V587-L591 PolarHBondContact O-N 3.37Å; V587-L608 HydrophobicContact CB-CD1 4.46Å; V587-L608 HydrophobicContact CG1-CD1 3.83Å; V587-L608 HydrophobicContact CG1-CD2 3.88Å; V587-L608 HydrophobicContact CG2-CD1 4.08Å; V587-L612 HydrophobicContact CG2-CD2 4.08Å; V587-V637 HydrophobicContact CG1-CB 4.34Å; V587-V637 HydrophobicContact CG1-CG1 4.13Å; V587-H638 HydrophobicContact CG1-CB 4.46Å
588	S	92.9	Very high	88.4	Confident	48 Å²	48	49.5 Å²	49.5	34%	0.336	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-44.2	174.1	-55.3	0	0	0	0	111.8	C584 N585 L591 S592 V637	C584-S588 PolarHBondContact O-N 2.84Å; C584-S588 PolarHBondContact O-OG 3.11Å; C584-S588 VanDerWaalsContact O-OG 3.04Å; N585-S588 PolarHBondContact O-N 3.38Å; S588-L591 PolarHBondContact O-N 2.96Å; S588-S592 PolarHBondContact O-N 3.04Å; S588-V637 VanDerWaalsContact OG-CG1 3.26Å; S588-V637 WeakPolarHBondContact OG-CG1 3.33Å; S588-V637 WeakPolarHBondContact OG-CG2 3.47Å
589	V	91.4	Very high	86.4	Confident	32 Å²	32	47.2 Å²	47.2	19%	0.194	24%	0.243	C	C	.	.	H	α-helix	trans	-66.1	-41	176.2	175.5	0	0	0	0	110.7	R510 L511 P514 N585 L586 V587 L591 S592 C593	R510-V589 HydrophobicContact CB-CG1 4.05Å; L511-V589 HydrophobicContact CD2-CB 4.21Å; L511-V589 HydrophobicContact CD2-CG1 3.81Å; L511-V589 HydrophobicContact CG-CG1 4.19Å; P514-V589 HydrophobicContact CG-CG2 4.27Å; N585-V589 WeakPolarHBondContact O-CG2 3.43Å; N585-V589 PolarHBondContact O-N 3.02Å; N585-V589 VanDerWaalsContact O-N 3.14Å; L586-V589 PolarHBondContact O-N 3.1Å; V587-V589 PolarHBondContact O-N 3.39Å; V589-L591 VanDerWaalsContact C-N 3.32Å; V589-L591 PolarHBondContact O-N 3.25Å; V589-S592 PolarHBondContact O-N 3.29Å; V589-C593 PolarHBondContact O-N 3.37Å; V589-C593 PolarHBondContact O-SG 3.33Å; V589-C593 VanDerWaalsContact O-SG 3.38Å
590	K	90.7	Very high	84.6	Confident	25 Å²	25	48.7 Å²	48.7	11%	0.109	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-34.1	176.7	-171.7	57	170.8	163	0	112.8	L511 L586 V587 C593 Y594 Y607 F611	L511-K590 HydrophobicContact CD1-CD 3.81Å; L511-K590 HydrophobicContact CD2-CB 3.84Å; L511-K590 HydrophobicContact CD2-CD 4.15Å; L586-K590 PolarHBondContact O-N 3.31Å; V587-K590 PolarHBondContact O-N 3.13Å; K590-C593 WeakPolarHBondContact O-CB 3.37Å; K590-C593 PolarHBondContact O-N 2.69Å; K590-Y594 PolarHBondContact O-N 3.05Å; K590-Y594 VanDerWaalsContact O-N 3.12Å; K590-Y607 HydrophobicContact CD-CE1 3.87Å; K590-Y607 VanDerWaalsContact CE-CE1 3.42Å; K590-Y607 HydrophobicContact CG-CE1 3.98Å; K590-Y607 PolarHBondContact NZ-OH 2.75Å; K590-F611 HydrophobicContact CB-CD1 4.27Å; K590-F611 HydrophobicContact CB-CE1 4Å; K590-F611 HydrophobicContact CB-CZ 4.15Å; K590-F611 HydrophobicContact CD-CD2 3.83Å; K590-F611 HydrophobicContact CD-CE2 4.04Å; K590-F611 HydrophobicContact CD-CG 4.1Å; K590-F611 HydrophobicContact CD-CZ 4.48Å; K590-F611 HydrophobicContact CG-CB 4.31Å; K590-F611 HydrophobicContact CG-CD1 3.77Å; K590-F611 HydrophobicContact CG-CD2 3.95Å; K590-F611 HydrophobicContact CG-CE1 3.98Å; K590-F611 HydrophobicContact CG-CE2 4.15Å; K590-F611 HydrophobicContact CG-CG 3.74Å; K590-F611 HydrophobicContact CG-CZ 4.16Å
591	L	90.7	Very high	83.2	Confident	30 Å²	30	51.9 Å²	51.9	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-72.4	-39.3	176	-167.6	62.3	0	0	0	111.9	V587 S588 V589 C593 Y594 E595 V604 H638 L641	V587-L591 WeakPolarHBondContact O-CB 3.25Å; V587-L591 PolarHBondContact O-N 3.37Å; S588-L591 PolarHBondContact O-N 2.96Å; V589-L591 VanDerWaalsContact C-N 3.32Å; V589-L591 PolarHBondContact O-N 3.25Å; L591-C593 PolarHBondContact O-N 3.47Å; L591-Y594 WeakPolarHBondContact O-CB 3.46Å; L591-Y594 PolarHBondContact O-N 3.42Å; L591-E595 PolarHBondContact O-N 3.27Å; L591-V604 HydrophobicContact CD1-CG1 3.67Å; L591-H638 HydrophobicContact CD2-CB 4.21Å; L591-L641 HydrophobicContact CD1-CD2 4.11Å; L591-L641 HydrophobicContact CD2-CD2 4.42Å
592	S	84.3	Confident	82.4	Confident	37 Å²	37	52.5 Å²	52.5	26%	0.259	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-30.3	169.2	169.6	0	0	0	0	112.6	R510 S588 V589 M596	R510-S592 PolarHBondContact NH1-OG 3.04Å; R510-S592 PolarHBondContact NH2-OG 2.81Å; S588-S592 PolarHBondContact O-N 3.04Å; V589-S592 PolarHBondContact O-N 3.29Å; S592-M596 WeakPolarHBondContact O-CB 3.46Å; S592-M596 PolarHBondContact O-N 3.36Å
593	C	83.8	Confident	82	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-70.4	-39.5	170.7	-68.7	0	0	0	0	112.4	Q507 V589 K590 L591 M596 E597	Q507-C593 HydrophobicContact CG-CB 4.25Å; V589-C593 PolarHBondContact O-N 3.37Å; V589-C593 PolarHBondContact O-SG 3.33Å; V589-C593 VanDerWaalsContact O-SG 3.38Å; K590-C593 WeakPolarHBondContact O-CB 3.37Å; K590-C593 PolarHBondContact O-N 2.69Å; L591-C593 PolarHBondContact O-N 3.47Å; C593-M596 PolarHBondContact O-N 2.77Å; C593-E597 WeakPolarHBondContact O-CB 3.28Å; C593-E597 PolarHBondContact O-N 2.96Å
594	Y	84.8	Confident	81.6	Confident	50 Å²	50	54.9 Å²	54.9	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-62.8	-45.3	175.5	178.4	-83.1	0	0	0	112.3	K590 L591 M596 E597 C600 L602 V604 Y607	K590-Y594 PolarHBondContact O-N 3.05Å; K590-Y594 VanDerWaalsContact O-N 3.12Å; L591-Y594 WeakPolarHBondContact O-CB 3.46Å; L591-Y594 PolarHBondContact O-N 3.42Å; Y594-M596 VanDerWaalsContact C-N 3.34Å; Y594-M596 PolarHBondContact O-N 2.76Å; Y594-E597 CarbonylContact O-C 3.25Å; Y594-E597 VanDerWaalsContact O-C 3.25Å; Y594-E597 WeakPolarHBondContact O-CA 3.24Å; Y594-E597 PolarHBondContact O-N 3.44Å; Y594-E597 VanDerWaalsContact O-N 3.09Å; Y594-C600 HydrophobicContact CD2-CB 4.05Å; Y594-C600 HydrophobicContact CE2-CB 3.7Å; Y594-L602 PolarHBondContact OH-O 3.12Å; Y594-L602 VanDerWaalsContact OH-O 3.09Å; Y594-V604 HydrophobicContact CD1-CG2 4.13Å; Y594-V604 HydrophobicContact CE1-CG2 3.46Å; Y594-V604 VanDerWaalsContact CE1-CG2 3.46Å; Y594-V604 HydrophobicContact CE2-CG2 4.28Å; Y594-Y607 AromaticContact CD2-CD1 3.67Å; Y594-Y607 HydrophobicContact CD2-CD1 3.67Å; Y594-Y607 AromaticContact CD2-CD2 3.87Å; Y594-Y607 HydrophobicContact CD2-CD2 3.87Å; Y594-Y607 HydrophobicContact CD2-CE1 4.02Å; Y594-Y607 HydrophobicContact CD2-CE2 4.17Å; Y594-Y607 AromaticContact CD2-CG 3.59Å; Y594-Y607 HydrophobicContact CD2-CG 3.59Å; Y594-Y607 HydrophobicContact CE2-CD2 4.44Å; Y594-Y607 HydrophobicContact CE2-CG 4.19Å; Y594-Y607 HydrophobicContact CG-CD1 4.3Å; Y594-Y607 HydrophobicContact CG-CE1 4.37Å
595	E	81.7	Confident	81.4	Confident	140 Å²	140	56.4 Å²	56.4	65%	0.654	31%	0.305	S	S	*	.	H	α-helix	trans	-61.3	-40.6	178.2	179.5	176.7	-138.5	0	0	112.2	L591 N598	L591-E595 PolarHBondContact O-N 3.27Å; E595-N598 PolarHBondContact O-ND2 2.8Å; E595-N598 PolarHBondContact O-OD1 3.03Å
596	M	70.2	Confident	81.2	Confident	47 Å²	47	55.9 Å²	55.9	23%	0.232	30%	0.302	C	S	.	.	H	α-helix	trans	-69.6	-35.3	173.1	-163	169.7	70.4	0	0	111.3	L467 Q470 Q507 S592 C593 Y594 N598	L467-M596 HydrophobicContact CD2-SD 4.44Å; Q470-M596 PolarHBondContact NE2-O 3.46Å; Q507-M596 HydrophobicContact CG-CE 4.09Å; S592-M596 WeakPolarHBondContact O-CB 3.46Å; S592-M596 PolarHBondContact O-N 3.36Å; C593-M596 PolarHBondContact O-N 2.77Å; Y594-M596 VanDerWaalsContact C-N 3.34Å; Y594-M596 PolarHBondContact O-N 2.76Å; M596-N598 PolarHBondContact O-N 3.06Å
597	E	70	Confident	81	Confident	60 Å²	60	57 Å²	57	28%	0.28	31%	0.306	S	S	.	.			trans	-76.3	57.3	175.2	-167	167.8	-144.4	0	0	112.2	C593 Y594 Q599 C600 Y607	C593-E597 WeakPolarHBondContact O-CB 3.28Å; C593-E597 PolarHBondContact O-N 2.96Å; Y594-E597 CarbonylContact O-C 3.25Å; Y594-E597 VanDerWaalsContact O-C 3.25Å; Y594-E597 WeakPolarHBondContact O-CA 3.24Å; Y594-E597 PolarHBondContact O-N 3.44Å; Y594-E597 VanDerWaalsContact O-N 3.09Å; E597-Q599 PolarHBondContact O-N 2.88Å; E597-C600 HydrophobicContact CG-CB 4.43Å; E597-C600 PolarHBondContact O-N 3.31Å; E597-Y607 WeakPolarHBondContact OE2-CE2 3.34Å; E597-Y607 PolarHBondContact OE2-OH 3.12Å
598	N	58.3	Low	81	Confident	130 Å²	130	57.2 Å²	57.2	70%	0.695	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	15.6	175.3	-82	-49	0	0	0	116.1	E595 M596	E595-N598 PolarHBondContact O-ND2 2.8Å; E595-N598 PolarHBondContact O-OD1 3.03Å; M596-N598 PolarHBondContact O-N 3.06Å
599	Q	53.7	Low	81.1	Confident	107 Å²	107	58.3 Å²	58.3	50%	0.5	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	4.6	176	-75.9	150.1	81.9	0	0	111.9	E597 T601	E597-Q599 PolarHBondContact O-N 2.88Å; Q599-T601 PolarHBondContact O-N 3.11Å
600	C	58.3	Low	81.2	Confident	34 Å²	34	58.8 Å²	58.8	23%	0.23	31%	0.314	C	S	.	.			trans	-68.8	118.8	179.9	-152.6	0	0	0	0	111.2	Y594 E597 L602 Y607	Y594-C600 HydrophobicContact CD2-CB 4.05Å; Y594-C600 HydrophobicContact CE2-CB 3.7Å; E597-C600 HydrophobicContact CG-CB 4.43Å; E597-C600 PolarHBondContact O-N 3.31Å; C600-L602 VanDerWaalsContact C-N 3.33Å; C600-Y607 WeakPolarHBondContact SG-CD2 3.43Å
601	T	66.7	Low	81.4	Confident	142 Å²	142	57.9 Å²	57.9	87%	0.871	31%	0.31	S	S	*	.			trans	-86	-4.8	177.8	53.2	0	0	0	0	113.6	Q599	Q599-T601 PolarHBondContact O-N 3.11Å
602	L	78.8	Confident	81.6	Confident	89 Å²	89	56.4 Å²	56.4	47%	0.466	30%	0.302	S	S	.	.	S	Bend	trans	-87.6	148.7	177.8	-61.7	176.4	0	0	0	110.4	Y594 C600	Y594-L602 PolarHBondContact OH-O 3.12Å; Y594-L602 VanDerWaalsContact OH-O 3.09Å; C600-L602 VanDerWaalsContact C-N 3.33Å
603	S	88.3	Confident	82.2	Confident	63 Å²	63	58.3 Å²	58.3	44%	0.441	31%	0.307	S	S	.	.			trans	-57.5	143.3	163.8	176.5	0	0	0	0	110.5	E605 D606 Y607	S603-E605 PolarHBondContact O-N 3.03Å; S603-E605 VanDerWaalsContact O-N 3.13Å; S603-E605 PolarHBondContact OG-N 2.97Å; S603-D606 PolarHBondContact O-N 2.92Å; S603-Y607 PolarHBondContact O-N 2.79Å
604	V	88.8	Confident	82.7	Confident	16 Å²	16	64 Å²	64	10%	0.097	34%	0.337	C	S	.	.	H	α-helix	trans	-46.5	-42.4	170.8	179.1	0	0	0	0	111.2	L591 Y594 L608 L641 T642	L591-V604 HydrophobicContact CD1-CG1 3.67Å; Y594-V604 HydrophobicContact CD1-CG2 4.13Å; Y594-V604 HydrophobicContact CE1-CG2 3.46Å; Y594-V604 VanDerWaalsContact CE1-CG2 3.46Å; Y594-V604 HydrophobicContact CE2-CG2 4.28Å; V604-L608 WeakPolarHBondContact O-CB 3.2Å; V604-L608 PolarHBondContact O-N 3.42Å; V604-L641 HydrophobicContact CB-CD2 4.45Å; V604-L641 HydrophobicContact CB-CG 4.34Å; V604-L641 HydrophobicContact CG1-CD2 3.83Å; V604-L641 HydrophobicContact CG1-CG 3.99Å; V604-L641 HydrophobicContact CG2-CD1 4.48Å; V604-L641 HydrophobicContact CG2-CD2 3.92Å; V604-L641 HydrophobicContact CG2-CG 3.99Å; V604-T642 HydrophobicContact CB-CG2 4.48Å; V604-T642 HydrophobicContact CG1-CG2 4.08Å
605	E	90.9	Very high	83.1	Confident	50 Å²	50	65 Å²	65	23%	0.234	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-42.9	-179.3	175.8	171.8	167.4	0	0	111.8	S603 K609 F631 T642	S603-E605 PolarHBondContact O-N 3.03Å; S603-E605 VanDerWaalsContact O-N 3.13Å; S603-E605 PolarHBondContact OG-N 2.97Å; E605-K609 VanDerWaalsContact CD-NZ 3.33Å; E605-K609 HydrophobicContact CG-CD 4.28Å; E605-K609 VanDerWaalsContact CG-NZ 3.33Å; E605-K609 VanDerWaalsContact O-CG 3.25Å; E605-K609 WeakPolarHBondContact O-CG 3.46Å; E605-K609 PolarHBondContact O-N 2.75Å; E605-K609 WeakPolarHBondContact OE1-CE 3.48Å; E605-K609 IonicContact OE1-NZ 2.64Å; E605-K609 PolarHBondContact OE1-NZ 3.36Å; E605-F631 HydrophobicContact CB-CZ 4.49Å; E605-F631 HydrophobicContact CG-CE2 4.02Å; E605-F631 HydrophobicContact CG-CZ 3.73Å; E605-T642 HydrophobicContact CB-CG2 3.81Å
606	D	91.7	Very high	83.8	Confident	74 Å²	74	58.4 Å²	58.4	40%	0.396	31%	0.313	S	S	.	.	H	α-helix	trans	-83.4	-33.3	-175.6	-58.9	-43.9	0	0	0	112.4	S603 L608 K609 A610	S603-D606 PolarHBondContact O-N 2.92Å; D606-L608 VanDerWaalsContact C-N 3.31Å; D606-L608 PolarHBondContact O-N 3.33Å; D606-K609 PolarHBondContact O-N 2.9Å; D606-K609 WeakPolarHBondContact OD1-CD 3.5Å; D606-K609 IonicContact OD1-NZ 3.07Å; D606-K609 PolarHBondContact OD1-NZ 3.43Å; D606-A610 WeakPolarHBondContact O-CB 3.21Å; D606-A610 PolarHBondContact O-N 3.02Å
607	Y	91.2	Very high	85.1	Confident	23 Å²	23	59.4 Å²	59.4	9%	0.09	32%	0.316	C	S	.	.	H	α-helix	trans	-55.4	-47.2	166.2	-177.7	-94.2	0	0	0	111	K590 Y594 E597 C600 S603 F611	K590-Y607 HydrophobicContact CD-CE1 3.87Å; K590-Y607 VanDerWaalsContact CE-CE1 3.42Å; K590-Y607 HydrophobicContact CG-CE1 3.98Å; K590-Y607 PolarHBondContact NZ-OH 2.75Å; Y594-Y607 AromaticContact CD2-CD1 3.67Å; Y594-Y607 HydrophobicContact CD2-CD1 3.67Å; Y594-Y607 AromaticContact CD2-CD2 3.87Å; Y594-Y607 HydrophobicContact CD2-CD2 3.87Å; Y594-Y607 HydrophobicContact CD2-CE1 4.02Å; Y594-Y607 HydrophobicContact CD2-CE2 4.17Å; Y594-Y607 AromaticContact CD2-CG 3.59Å; Y594-Y607 HydrophobicContact CD2-CG 3.59Å; Y594-Y607 HydrophobicContact CE2-CD2 4.44Å; Y594-Y607 HydrophobicContact CE2-CG 4.19Å; Y594-Y607 HydrophobicContact CG-CD1 4.3Å; Y594-Y607 HydrophobicContact CG-CE1 4.37Å; E597-Y607 WeakPolarHBondContact OE2-CE2 3.34Å; E597-Y607 PolarHBondContact OE2-OH 3.12Å; C600-Y607 WeakPolarHBondContact SG-CD2 3.43Å; S603-Y607 PolarHBondContact O-N 2.79Å; Y607-F611 PolarHBondContact O-N 3.31Å; Y607-F611 VanDerWaalsContact O-N 3.12Å
608	L	93.7	Very high	86.3	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-71	-40.4	179.4	-175.3	61.5	0	0	0	112.4	V587 V604 D606 A610 F611 L612 F631 H638	V587-L608 HydrophobicContact CB-CD1 4.46Å; V587-L608 HydrophobicContact CG1-CD1 3.83Å; V587-L608 HydrophobicContact CG1-CD2 3.88Å; V587-L608 HydrophobicContact CG2-CD1 4.08Å; V604-L608 WeakPolarHBondContact O-CB 3.2Å; V604-L608 PolarHBondContact O-N 3.42Å; D606-L608 VanDerWaalsContact C-N 3.31Å; D606-L608 PolarHBondContact O-N 3.33Å; L608-A610 VanDerWaalsContact C-N 3.35Å; L608-A610 PolarHBondContact O-N 2.87Å; L608-F611 HydrophobicContact CD1-CD1 4.04Å; L608-F611 PolarHBondContact O-N 2.83Å; L608-L612 HydrophobicContact CD1-CD1 4.25Å; L608-L612 HydrophobicContact CD1-CG 4.12Å; L608-L612 HydrophobicContact CG-CD1 3.98Å; L608-L612 HydrophobicContact CG-CG 4.28Å; L608-L612 WeakPolarHBondContact O-CB 3.31Å; L608-L612 VanDerWaalsContact O-CG 3.27Å; L608-L612 WeakPolarHBondContact O-CG 3.23Å; L608-L612 PolarHBondContact O-N 3.45Å; L608-F631 HydrophobicContact CB-CE2 4.45Å; L608-F631 HydrophobicContact CD2-CD2 4.27Å; L608-F631 HydrophobicContact CD2-CE2 4.08Å; L608-F631 HydrophobicContact CG-CD2 4.42Å; L608-F631 HydrophobicContact CG-CE2 4.41Å; L608-H638 HydrophobicContact CD2-CB 4.15Å; L608-H638 WeakPolarHBondContact CD2-CD2 3.38Å; L608-H638 VanDerWaalsContact CD2-CG 3.46Å
609	K	94.3	Very high	88.1	Confident	71 Å²	71	55.6 Å²	55.6	31%	0.309	30%	0.302	S	S	.	.	H	α-helix	trans	-57.8	-46.3	172.9	-75.9	167.8	-167.8	156.9	0	111.7	E605 D606 F611 L612 E613 F631	E605-K609 VanDerWaalsContact CD-NZ 3.33Å; E605-K609 HydrophobicContact CG-CD 4.28Å; E605-K609 VanDerWaalsContact CG-NZ 3.33Å; E605-K609 VanDerWaalsContact O-CG 3.25Å; E605-K609 WeakPolarHBondContact O-CG 3.46Å; E605-K609 PolarHBondContact O-N 2.75Å; E605-K609 WeakPolarHBondContact OE1-CE 3.48Å; E605-K609 IonicContact OE1-NZ 2.64Å; E605-K609 PolarHBondContact OE1-NZ 3.36Å; D606-K609 PolarHBondContact O-N 2.9Å; D606-K609 WeakPolarHBondContact OD1-CD 3.5Å; D606-K609 IonicContact OD1-NZ 3.07Å; D606-K609 PolarHBondContact OD1-NZ 3.43Å; K609-F611 PolarHBondContact O-N 2.88Å; K609-L612 PolarHBondContact O-N 3.17Å; K609-E613 WeakPolarHBondContact O-CB 3.33Å; K609-E613 PolarHBondContact O-N 3.24Å; K609-F631 HydrophobicContact CG-CD2 4.01Å; K609-F631 HydrophobicContact CG-CE2 4.11Å
610	A	94.1	Very high	90.1	Very high	43 Å²	43	51.2 Å²	51.2	36%	0.355	28%	0.281	S	S	.	.	H	α-helix	trans	-61.8	-44.1	-179.9	0	0	0	0	0	111.8	D606 L608 N614	D606-A610 WeakPolarHBondContact O-CB 3.21Å; D606-A610 PolarHBondContact O-N 3.02Å; L608-A610 VanDerWaalsContact C-N 3.35Å; L608-A610 PolarHBondContact O-N 2.87Å; A610-N614 VanDerWaalsContact O-CB 3.24Å; A610-N614 WeakPolarHBondContact O-CB 3.41Å; A610-N614 PolarHBondContact O-N 3.47Å; A610-N614 PolarHBondContact O-ND2 3.42Å
611	F	94.3	Very high	91.9	Very high	5 Å²	5	52.3 Å²	52.3	2%	0.022	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-47.6	172.5	170	-105.8	0	0	0	112.6	L511 L586 K590 Y607 L608 K609 E613 N614 E615 V616	L511-F611 HydrophobicContact CD2-CE2 4.46Å; L511-F611 HydrophobicContact CD2-CZ 4.33Å; L586-F611 HydrophobicContact CD1-CZ 3.92Å; L586-F611 HydrophobicContact CD2-CE1 4.31Å; L586-F611 HydrophobicContact CD2-CZ 4.03Å; L586-F611 HydrophobicContact CG-CE1 4.09Å; L586-F611 HydrophobicContact CG-CZ 3.78Å; K590-F611 HydrophobicContact CB-CD1 4.27Å; K590-F611 HydrophobicContact CB-CE1 4Å; K590-F611 HydrophobicContact CB-CZ 4.15Å; K590-F611 HydrophobicContact CD-CD2 3.83Å; K590-F611 HydrophobicContact CD-CE2 4.04Å; K590-F611 HydrophobicContact CD-CG 4.1Å; K590-F611 HydrophobicContact CD-CZ 4.48Å; K590-F611 HydrophobicContact CG-CB 4.31Å; K590-F611 HydrophobicContact CG-CD1 3.77Å; K590-F611 HydrophobicContact CG-CD2 3.95Å; K590-F611 HydrophobicContact CG-CE1 3.98Å; K590-F611 HydrophobicContact CG-CE2 4.15Å; K590-F611 HydrophobicContact CG-CG 3.74Å; K590-F611 HydrophobicContact CG-CZ 4.16Å; Y607-F611 PolarHBondContact O-N 3.31Å; Y607-F611 VanDerWaalsContact O-N 3.12Å; L608-F611 HydrophobicContact CD1-CD1 4.04Å; L608-F611 PolarHBondContact O-N 2.83Å; K609-F611 PolarHBondContact O-N 2.88Å; F611-E613 VanDerWaalsContact C-N 3.35Å; F611-E613 PolarHBondContact O-N 2.82Å; F611-N614 PolarHBondContact O-N 3.31Å; F611-E615 HydrophobicContact CD2-CB 4.13Å; F611-E615 HydrophobicContact CD2-CG 4.24Å; F611-E615 WeakPolarHBondContact CD2-OE1 3.47Å; F611-E615 HydrophobicContact CE2-CB 4.08Å; F611-E615 HydrophobicContact CE2-CG 4.42Å; F611-E615 WeakPolarHBondContact CE2-OE2 3.31Å; F611-E615 PolarHBondContact O-N 3.24Å; F611-V616 HydrophobicContact CD1-CG2 4.07Å; F611-V616 HydrophobicContact CE1-CG2 3.55Å; F611-V616 HydrophobicContact CE2-CG2 4.4Å; F611-V616 HydrophobicContact CZ-CG2 3.75Å; F611-V616 PolarHBondContact O-N 3.44Å
612	L	96	Very high	93.1	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.277	C	S	.	.	I	π-helix	trans	-67.5	-33.4	-178.2	-70.6	178.6	0	0	0	112.7	L583 V587 L608 K609 V616 K617 T627 L630 F631	L583-L612 HydrophobicContact CD1-CD2 4.2Å; V587-L612 HydrophobicContact CG2-CD2 4.08Å; L608-L612 HydrophobicContact CD1-CD1 4.25Å; L608-L612 HydrophobicContact CD1-CG 4.12Å; L608-L612 HydrophobicContact CG-CD1 3.98Å; L608-L612 HydrophobicContact CG-CG 4.28Å; L608-L612 WeakPolarHBondContact O-CB 3.31Å; L608-L612 VanDerWaalsContact O-CG 3.27Å; L608-L612 WeakPolarHBondContact O-CG 3.23Å; L608-L612 PolarHBondContact O-N 3.45Å; K609-L612 PolarHBondContact O-N 3.17Å; L612-V616 HydrophobicContact CD2-CB 3.94Å; L612-V616 HydrophobicContact CD2-CG1 4.14Å; L612-V616 HydrophobicContact CD2-CG2 3.85Å; L612-K617 VanDerWaalsContact O-CB 3.27Å; L612-K617 WeakPolarHBondContact O-CB 3.47Å; L612-K617 PolarHBondContact O-N 3.02Å; L612-T627 HydrophobicContact CB-CG2 3.85Å; L612-L630 HydrophobicContact CB-CB 4.36Å; L612-L630 HydrophobicContact CB-CD1 4.44Å; L612-L630 HydrophobicContact CD1-CB 4.09Å; L612-L630 HydrophobicContact CD2-CB 4.19Å; L612-L630 HydrophobicContact CG-CB 4.46Å; L612-F631 HydrophobicContact CD1-CB 4.06Å; L612-F631 HydrophobicContact CD1-CD2 4.19Å
613	E	95.8	Very high	93.7	Very high	77 Å²	77	50.7 Å²	50.7	36%	0.36	28%	0.279	S	S	.	.	I	π-helix	trans	-73.3	-43.2	174.8	179.8	63.1	-141.3	0	0	112.2	K609 F611 K617 T627	K609-E613 WeakPolarHBondContact O-CB 3.33Å; K609-E613 PolarHBondContact O-N 3.24Å; F611-E613 VanDerWaalsContact C-N 3.35Å; F611-E613 PolarHBondContact O-N 2.82Å; E613-K617 WeakPolarHBondContact OE1-CD 3.44Å; E613-K617 WeakPolarHBondContact OE1-CE 3.05Å; E613-K617 IonicContact OE1-NZ 3.72Å; E613-K617 PolarHBondContact OE1-NZ 3.37Å; E613-K617 WeakPolarHBondContact OE2-CD 3.44Å; E613-K617 IonicContact OE2-NZ 2.85Å; E613-K617 PolarHBondContact OE2-NZ 3.42Å; E613-T627 WeakPolarHBondContact CA-OG1 3.48Å; E613-T627 HydrophobicContact CB-CG2 4.06Å; E613-T627 WeakPolarHBondContact OE2-CB 3.5Å; E613-T627 PolarHBondContact OE2-OG1 2.9Å
614	N	95.3	Very high	94	Very high	118 Å²	118	48.8 Å²	48.8	63%	0.631	26%	0.262	S	S	*	.	I	π-helix	trans	-88.8	-35.6	-170.1	-65.7	-9	0	0	0	114.2	A610 F611 P618	A610-N614 VanDerWaalsContact O-CB 3.24Å; A610-N614 WeakPolarHBondContact O-CB 3.41Å; A610-N614 PolarHBondContact O-N 3.47Å; A610-N614 PolarHBondContact O-ND2 3.42Å; F611-N614 PolarHBondContact O-N 3.31Å; N614-P618 WeakPolarHBondContact O-CG 3.36Å
615	E	93.8	Very high	94.4	Very high	73 Å²	73	48.7 Å²	48.7	34%	0.341	26%	0.261	S	S	.	.	I	π-helix	trans	-110	-36.9	-173.6	-66.4	-179.9	-128.3	0	0	113.1	F611	F611-E615 HydrophobicContact CD2-CB 4.13Å; F611-E615 HydrophobicContact CD2-CG 4.24Å; F611-E615 WeakPolarHBondContact CD2-OE1 3.47Å; F611-E615 HydrophobicContact CE2-CB 4.08Å; F611-E615 HydrophobicContact CE2-CG 4.42Å; F611-E615 WeakPolarHBondContact CE2-OE2 3.31Å; F611-E615 PolarHBondContact O-N 3.24Å
616	V	96.2	Very high	94.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.278	C	S	.	.	I	π-helix	trans	-94.6	-45.1	-170.7	-173.8	0	0	0	0	112.6	L515 L518 L583 L586 F611 L612 P618 L619 W620 L630	L515-V616 HydrophobicContact CD1-CG2 4.41Å; L518-V616 HydrophobicContact CD2-CG1 3.92Å; L583-V616 HydrophobicContact CD1-CG1 3.85Å; L586-V616 HydrophobicContact CD2-CG1 4.47Å; L586-V616 HydrophobicContact CD2-CG2 3.73Å; F611-V616 HydrophobicContact CD1-CG2 4.07Å; F611-V616 HydrophobicContact CE1-CG2 3.55Å; F611-V616 HydrophobicContact CE2-CG2 4.4Å; F611-V616 HydrophobicContact CZ-CG2 3.75Å; F611-V616 PolarHBondContact O-N 3.44Å; L612-V616 HydrophobicContact CD2-CB 3.94Å; L612-V616 HydrophobicContact CD2-CG1 4.14Å; L612-V616 HydrophobicContact CD2-CG2 3.85Å; V616-P618 VanDerWaalsContact C-CD 3.48Å; V616-L619 HydrophobicContact CG1-CD1 4.46Å; V616-L619 VanDerWaalsContact O-CB 3.3Å; V616-L619 WeakPolarHBondContact O-CB 3.46Å; V616-L619 VanDerWaalsContact O-CG 3.23Å; V616-L619 WeakPolarHBondContact O-CG 3.3Å; V616-L619 PolarHBondContact O-N 2.77Å; V616-L619 VanDerWaalsContact O-N 3.08Å; V616-W620 HydrophobicContact CG1-CZ3 3.94Å; V616-W620 VanDerWaalsContact O-CZ3 3.25Å; V616-W620 WeakPolarHBondContact O-CZ3 3.49Å; V616-L630 HydrophobicContact CB-CD1 4.18Å; V616-L630 HydrophobicContact CG1-CD1 3.95Å; V616-L630 HydrophobicContact CG1-CD2 4.11Å
617	K	96.5	Very high	94.8	Very high	68 Å²	68	49.5 Å²	49.5	30%	0.296	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-54.6	-39.4	175.7	176.4	-172.7	-177.5	-179	0	113.8	L612 E613 L619 W620 L630	L612-K617 VanDerWaalsContact O-CB 3.27Å; L612-K617 WeakPolarHBondContact O-CB 3.47Å; L612-K617 PolarHBondContact O-N 3.02Å; E613-K617 WeakPolarHBondContact OE1-CD 3.44Å; E613-K617 WeakPolarHBondContact OE1-CE 3.05Å; E613-K617 IonicContact OE1-NZ 3.72Å; E613-K617 PolarHBondContact OE1-NZ 3.37Å; E613-K617 WeakPolarHBondContact OE2-CD 3.44Å; E613-K617 IonicContact OE2-NZ 2.85Å; E613-K617 PolarHBondContact OE2-NZ 3.42Å; K617-L619 PolarHBondContact O-N 2.85Å; K617-W620 PolarHBondContact O-N 2.95Å; K617-W620 VanDerWaalsContact O-N 3.13Å; K617-L630 HydrophobicContact CB-CD1 3.98Å
618	P	96.3	Very high	94.9	Very high	87 Å²	87	58.7 Å²	58.7	57%	0.565	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-66.8	-2.9	176.9	-23.2	36.5	0	0	0	115.8	N614 V616	N614-P618 WeakPolarHBondContact O-CG 3.36Å; V616-P618 VanDerWaalsContact C-CD 3.48Å
619	L	95.7	Very high	95	Very high	23 Å²	23	61.1 Å²	61.1	12%	0.12	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-71.9	-18.6	170	-56.2	-178.2	0	0	0	112.6	L515 L518 K519 V522 V616 K617	L515-L619 HydrophobicContact CD1-CD1 4.02Å; L518-L619 HydrophobicContact CB-CD1 4.4Å; L518-L619 HydrophobicContact CD2-CD1 3.84Å; L518-L619 HydrophobicContact CG-CD1 3.87Å; K519-L619 HydrophobicContact CB-CD1 4.38Å; K519-L619 HydrophobicContact CB-CD2 3.8Å; K519-L619 HydrophobicContact CD-CD2 3.77Å; K519-L619 HydrophobicContact CG-CD2 3.8Å; V522-L619 WeakPolarHBondContact CG1-O 3.42Å; V616-L619 HydrophobicContact CG1-CD1 4.46Å; V616-L619 VanDerWaalsContact O-CB 3.3Å; V616-L619 WeakPolarHBondContact O-CB 3.46Å; V616-L619 VanDerWaalsContact O-CG 3.23Å; V616-L619 WeakPolarHBondContact O-CG 3.3Å; V616-L619 PolarHBondContact O-N 2.77Å; V616-L619 VanDerWaalsContact O-N 3.08Å; K617-L619 PolarHBondContact O-N 2.85Å
620	W	96.3	Very high	95.1	Very high	15 Å²	15	57.8 Å²	57.8	6%	0.057	30%	0.296	C	S	.	.	S	Bend	trans	-105.6	150.5	177	-72.4	-100.8	0	0	0	111.8	V522 F573 W575 V616 K617 W624 M625 L630	V522-W620 HydrophobicContact CG1-CD2 4.09Å; V522-W620 HydrophobicContact CG1-CG 4.17Å; V522-W620 HydrophobicContact CG1-CZ2 4.46Å; V522-W620 HydrophobicContact CG2-CD2 4.43Å; V522-W620 HydrophobicContact CG2-CH2 3.8Å; V522-W620 HydrophobicContact CG2-CZ2 3.48Å; V522-W620 VanDerWaalsContact CG2-CZ2 3.48Å; V522-W620 HydrophobicContact CG2-CZ3 4.39Å; F573-W620 HydrophobicContact CD1-CZ2 4.25Å; F573-W620 AromaticContact CD1-NE1 3.41Å; F573-W620 AromaticContact CD2-CD1 3.79Å; F573-W620 AromaticContact CD2-NE1 3.35Å; F573-W620 VanDerWaalsContact CD2-NE1 3.35Å; F573-W620 AromaticContact CE1-CE2 3.83Å; F573-W620 AromaticContact CE1-CZ2 3.71Å; F573-W620 HydrophobicContact CE1-CZ2 3.71Å; F573-W620 AromaticContact CE1-NE1 3.34Å; F573-W620 VanDerWaalsContact CE1-NE1 3.34Å; F573-W620 AromaticContact CE2-NE1 3.29Å; F573-W620 VanDerWaalsContact CE2-NE1 3.29Å; F573-W620 AromaticContact CG-CD1 3.98Å; F573-W620 AromaticContact CG-NE1 3.39Å; F573-W620 AromaticContact CZ-CE2 3.95Å; F573-W620 HydrophobicContact CZ-CZ2 4.04Å; F573-W620 AromaticContact CZ-NE1 3.25Å; F573-W620 VanDerWaalsContact CZ-NE1 3.25Å; W575-W620 AromaticContact CH2-CH2 3.83Å; W575-W620 HydrophobicContact CH2-CH2 3.83Å; W575-W620 AromaticContact CH2-CZ2 3.64Å; W575-W620 HydrophobicContact CH2-CZ2 3.64Å; W575-W620 HydrophobicContact CZ2-CZ2 4.13Å; W575-W620 HydrophobicContact CZ3-CZ2 4.25Å; V616-W620 HydrophobicContact CG1-CZ3 3.94Å; V616-W620 VanDerWaalsContact O-CZ3 3.25Å; V616-W620 WeakPolarHBondContact O-CZ3 3.49Å; K617-W620 PolarHBondContact O-N 2.95Å; K617-W620 VanDerWaalsContact O-N 3.13Å; W620-W624 HydrophobicContact CB-CB 4.29Å; W620-M625 HydrophobicContact CB-CB 3.61Å; W620-M625 HydrophobicContact CD2-CB 3.83Å; W620-M625 HydrophobicContact CD2-CE 4.1Å; W620-M625 HydrophobicContact CD2-CG 3.88Å; W620-M625 HydrophobicContact CE3-CB 4.2Å; W620-M625 HydrophobicContact CE3-CG 3.93Å; W620-M625 HydrophobicContact CG-CB 3.56Å; W620-M625 HydrophobicContact CG-CE 4.38Å; W620-M625 HydrophobicContact CG-CG 4.18Å; W620-M625 HydrophobicContact CZ2-CE 3.95Å; W620-M625 HydrophobicContact CZ3-CG 4.47Å; W620-L630 HydrophobicContact CE3-CD2 4.49Å; W620-L630 HydrophobicContact CH2-CD2 3.69Å; W620-L630 HydrophobicContact CZ2-CD2 4.41Å; W620-L630 HydrophobicContact CZ3-CD2 3.74Å
621	P	94.6	Very high	95.1	Very high	58 Å²	58	56.7 Å²	56.7	38%	0.377	28%	0.283	S	S	.	.			trans	-65.2	155.6	173.2	-15.9	29.3	0	0	0	112.8	M526 I530 G623 W624	M526-P621 WeakPolarHBondContact SD-CD 3.48Å; M526-P621 HydrophobicContact SD-CG 3.77Å; I530-P621 HydrophobicContact CD1-CG 4.46Å; P621-G623 PolarHBondContact O-N 3.18Å; P621-W624 WeakPolarHBondContact O-CB 3.17Å; P621-W624 PolarHBondContact O-N 3.14Å
622	K	91.9	Very high	95.2	Very high	148 Å²	148	61.5 Å²	61.5	64%	0.643	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	127.2	-177.9	-166.4	-167.4	179.3	-162.2	0	110.6	S172	S172-K622 PolarHBondContact OG-NZ 3.17Å
623	G	91.6	Very high	95.1	Very high	49 Å²	49	63.3 Å²	63.3	51%	0.505	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-2.1	178	0	0	0	0	0	116.2	K571 P621	K571-G623 WeakPolarHBondContact CB-O 3.26Å; P621-G623 PolarHBondContact O-N 3.18Å
624	W	95.1	Very high	95.1	Very high	23 Å²	23	59.7 Å²	59.7	9%	0.087	30%	0.295	C	S	.	.	S	Bend	trans	-88.6	-22	175.9	-77.1	83.8	0	0	0	114.5	M526 Q529 I530 Y533 K571 W620 P621	M526-W624 HydrophobicContact CE-CD2 4.33Å; M526-W624 HydrophobicContact CE-CE3 4.03Å; Q529-W624 HydrophobicContact CB-CH2 4.29Å; Q529-W624 HydrophobicContact CB-CZ3 4Å; Q529-W624 WeakPolarHBondContact O-CH2 3.38Å; I530-W624 HydrophobicContact CB-CZ2 4.34Å; I530-W624 HydrophobicContact CG1-CH2 4.23Å; I530-W624 HydrophobicContact CG1-CZ2 3.68Å; Y533-W624 HydrophobicContact CD1-CZ2 4.31Å; Y533-W624 HydrophobicContact CD2-CH2 4.36Å; Y533-W624 HydrophobicContact CG-CH2 4.02Å; Y533-W624 HydrophobicContact CG-CZ2 4.05Å; K571-W624 HydrophobicContact CB-CD2 4.26Å; K571-W624 HydrophobicContact CB-CG 4.49Å; K571-W624 HydrophobicContact CG-CZ2 4.44Å; W620-W624 HydrophobicContact CB-CB 4.29Å; P621-W624 WeakPolarHBondContact O-CB 3.17Å; P621-W624 PolarHBondContact O-N 3.14Å
625	M	96.4	Very high	95	Very high	13 Å²	13	57.3 Å²	57.3	6%	0.064	28%	0.282	C	S	.	.			trans	-139.8	151.1	-177.2	-169.6	50.2	65.2	0	0	112.1	F573 W575 W620 I629 L630	F573-M625 HydrophobicContact CB-CE 3.67Å; F573-M625 HydrophobicContact CD1-CE 3.43Å; F573-M625 VanDerWaalsContact CD1-CE 3.43Å; F573-M625 HydrophobicContact CE1-CE 4.27Å; F573-M625 HydrophobicContact CG-CE 3.79Å; W575-M625 HydrophobicContact CH2-CE 4.31Å; W575-M625 HydrophobicContact CZ2-CE 3.4Å; W575-M625 HydrophobicContact CZ2-SD 4.03Å; W620-M625 HydrophobicContact CB-CB 3.61Å; W620-M625 HydrophobicContact CD2-CB 3.83Å; W620-M625 HydrophobicContact CD2-CE 4.1Å; W620-M625 HydrophobicContact CD2-CG 3.88Å; W620-M625 HydrophobicContact CE3-CB 4.2Å; W620-M625 HydrophobicContact CE3-CG 3.93Å; W620-M625 HydrophobicContact CG-CB 3.56Å; W620-M625 HydrophobicContact CG-CE 4.38Å; W620-M625 HydrophobicContact CG-CG 4.18Å; W620-M625 HydrophobicContact CZ2-CE 3.95Å; W620-M625 HydrophobicContact CZ3-CG 4.47Å; M625-I629 HydrophobicContact SD-CB 3.91Å; M625-I629 HydrophobicContact SD-CG2 3.85Å; M625-L630 HydrophobicContact CE-CD2 4.46Å; M625-L630 HydrophobicContact CG-CD1 3.94Å; M625-L630 HydrophobicContact CG-CD2 3.85Å; M625-L630 HydrophobicContact CG-CG 3.72Å; M625-L630 HydrophobicContact SD-CD2 3.83Å; M625-L630 HydrophobicContact SD-CG 3.82Å
626	Q	95.3	Very high	94.9	Very high	126 Å²	126	58.4 Å²	58.4	59%	0.589	30%	0.304	S	S	*	.			trans	-134.4	144.1	175.8	-64.3	179	-12.2	0	0	109.4	R628 I629 L630	Q626-R628 VanDerWaalsContact C-N 3.25Å; Q626-R628 PolarHBondContact O-N 2.78Å; Q626-I629 HydrophobicContact CB-CG1 4.22Å; Q626-I629 WeakPolarHBondContact O-CA 3.28Å; Q626-I629 WeakPolarHBondContact O-CB 3.49Å; Q626-I629 PolarHBondContact O-N 2.93Å; Q626-L630 PolarHBondContact O-N 2.82Å; Q626-L630 VanDerWaalsContact O-N 3.13Å
627	T	95.9	Very high	94.7	Very high	16 Å²	16	59.7 Å²	59.7	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-58.9	-34.9	-179.5	-58.6	0	0	0	0	112.8	L612 E613 I629 L630 F631	L612-T627 HydrophobicContact CB-CG2 3.85Å; E613-T627 WeakPolarHBondContact CA-OG1 3.48Å; E613-T627 HydrophobicContact CB-CG2 4.06Å; E613-T627 WeakPolarHBondContact OE2-CB 3.5Å; E613-T627 PolarHBondContact OE2-OG1 2.9Å; T627-I629 PolarHBondContact O-N 2.88Å; T627-L630 PolarHBondContact O-N 2.76Å; T627-F631 VanDerWaalsContact O-CB 3.31Å; T627-F631 WeakPolarHBondContact O-CB 3.32Å; T627-F631 PolarHBondContact O-N 3.46Å
628	R	94.6	Very high	94.5	Very high	215 Å²	215	56.5 Å²	56.5	81%	0.811	30%	0.298	S	S	*	.	H	α-helix	trans	-60.6	-31.1	172.5	-170.9	175.8	-177.7	-179.5	2.1	113.1	Q626 K632	Q626-R628 VanDerWaalsContact C-N 3.25Å; Q626-R628 PolarHBondContact O-N 2.78Å; R628-K632 VanDerWaalsContact O-CB 3.25Å; R628-K632 WeakPolarHBondContact O-CB 3.32Å; R628-K632 PolarHBondContact O-N 3.12Å; R628-K632 VanDerWaalsContact O-N 3.12Å
629	I	95	Very high	94.1	Very high	56 Å²	56	53.5 Å²	53.5	29%	0.287	28%	0.283	S	S	.	.	H	α-helix	trans	-77.5	-44.5	175.5	-58.4	-60.6	0	0	0	110.5	M625 Q626 T627 F631 K632 E633	M625-I629 HydrophobicContact SD-CB 3.91Å; M625-I629 HydrophobicContact SD-CG2 3.85Å; Q626-I629 HydrophobicContact CB-CG1 4.22Å; Q626-I629 WeakPolarHBondContact O-CA 3.28Å; Q626-I629 WeakPolarHBondContact O-CB 3.49Å; Q626-I629 PolarHBondContact O-N 2.93Å; T627-I629 PolarHBondContact O-N 2.88Å; I629-F631 VanDerWaalsContact C-N 3.33Å; I629-F631 PolarHBondContact O-N 2.9Å; I629-K632 PolarHBondContact O-N 2.92Å; I629-E633 HydrophobicContact CG2-CG 4.17Å; I629-E633 WeakPolarHBondContact O-CG 3.5Å; I629-E633 PolarHBondContact O-N 3.03Å
630	L	96.3	Very high	93.7	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-44.2	174.9	-66.1	171.9	0	0	0	111.9	W575 L583 L612 V616 K617 W620 M625 Q626 T627 S634	W575-L630 HydrophobicContact CH2-CD2 3.83Å; W575-L630 HydrophobicContact CZ2-CD2 3.89Å; L583-L630 HydrophobicContact CD1-CD2 4.13Å; L583-L630 HydrophobicContact CD2-CD2 4.26Å; L612-L630 HydrophobicContact CB-CB 4.36Å; L612-L630 HydrophobicContact CB-CD1 4.44Å; L612-L630 HydrophobicContact CD1-CB 4.09Å; L612-L630 HydrophobicContact CD2-CB 4.19Å; L612-L630 HydrophobicContact CG-CB 4.46Å; V616-L630 HydrophobicContact CB-CD1 4.18Å; V616-L630 HydrophobicContact CG1-CD1 3.95Å; V616-L630 HydrophobicContact CG1-CD2 4.11Å; K617-L630 HydrophobicContact CB-CD1 3.98Å; W620-L630 HydrophobicContact CE3-CD2 4.49Å; W620-L630 HydrophobicContact CH2-CD2 3.69Å; W620-L630 HydrophobicContact CZ2-CD2 4.41Å; W620-L630 HydrophobicContact CZ3-CD2 3.74Å; M625-L630 HydrophobicContact CE-CD2 4.46Å; M625-L630 HydrophobicContact CG-CD1 3.94Å; M625-L630 HydrophobicContact CG-CD2 3.85Å; M625-L630 HydrophobicContact CG-CG 3.72Å; M625-L630 HydrophobicContact SD-CD2 3.83Å; M625-L630 HydrophobicContact SD-CG 3.82Å; Q626-L630 PolarHBondContact O-N 2.82Å; Q626-L630 VanDerWaalsContact O-N 3.13Å; T627-L630 PolarHBondContact O-N 2.76Å; L630-S634 WeakPolarHBondContact O-CB 3.45Å; L630-S634 PolarHBondContact O-N 3.22Å; L630-S634 VanDerWaalsContact O-N 3.13Å; L630-S634 PolarHBondContact O-OG 2.88Å
631	F	94.9	Very high	93.2	Very high	21 Å²	21	63.2 Å²	63.2	9%	0.092	33%	0.33	C	S	.	.	H	α-helix	trans	-61.9	-48.2	175.6	-166.3	-86.1	0	0	0	110.4	E605 L608 K609 L612 T627 I629 E633 S634 L635 H638 T642	E605-F631 HydrophobicContact CB-CZ 4.49Å; E605-F631 HydrophobicContact CG-CE2 4.02Å; E605-F631 HydrophobicContact CG-CZ 3.73Å; L608-F631 HydrophobicContact CB-CE2 4.45Å; L608-F631 HydrophobicContact CD2-CD2 4.27Å; L608-F631 HydrophobicContact CD2-CE2 4.08Å; L608-F631 HydrophobicContact CG-CD2 4.42Å; L608-F631 HydrophobicContact CG-CE2 4.41Å; K609-F631 HydrophobicContact CG-CD2 4.01Å; K609-F631 HydrophobicContact CG-CE2 4.11Å; L612-F631 HydrophobicContact CD1-CB 4.06Å; L612-F631 HydrophobicContact CD1-CD2 4.19Å; T627-F631 VanDerWaalsContact O-CB 3.31Å; T627-F631 WeakPolarHBondContact O-CB 3.32Å; T627-F631 PolarHBondContact O-N 3.46Å; I629-F631 VanDerWaalsContact C-N 3.33Å; I629-F631 PolarHBondContact O-N 2.9Å; F631-E633 PolarHBondContact O-N 3.29Å; F631-S634 PolarHBondContact O-N 3.4Å; F631-S634 PolarHBondContact O-OG 3.22Å; F631-S634 VanDerWaalsContact O-OG 3.14Å; F631-L635 HydrophobicContact CD1-CD2 4.46Å; F631-L635 HydrophobicContact CE1-CD2 4.22Å; F631-L635 PolarHBondContact O-N 2.77Å; F631-H638 AromaticContact CD1-NE2 3.81Å; F631-H638 AromaticContact CD2-NE2 3.83Å; F631-H638 AromaticContact CE1-NE2 3.51Å; F631-H638 AromaticContact CE2-NE2 3.54Å; F631-H638 AromaticContact CG-NE2 3.96Å; F631-H638 AromaticContact CZ-CD2 3.94Å; F631-H638 AromaticContact CZ-NE2 3.36Å; F631-H638 WeakPolarHBondContact CZ-NE2 3.15Å; F631-H638 PolarHBondContact O-CE1 3.15Å; F631-H638 VanDerWaalsContact O-CE1 3.32Å; F631-T642 HydrophobicContact CZ-CG2 4.14Å
632	K	95.1	Very high	92.7	Very high	106 Å²	106	60.9 Å²	60.9	46%	0.461	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-45.1	177.8	-173.5	-171.9	71.4	77.6	0	113.6	R628 I629 S634 L635	R628-K632 VanDerWaalsContact O-CB 3.25Å; R628-K632 WeakPolarHBondContact O-CB 3.32Å; R628-K632 PolarHBondContact O-N 3.12Å; R628-K632 VanDerWaalsContact O-N 3.12Å; I629-K632 PolarHBondContact O-N 2.92Å; K632-S634 VanDerWaalsContact C-N 3.28Å; K632-S634 PolarHBondContact O-N 2.8Å; K632-L635 HydrophobicContact CG-CD1 4.32Å; K632-L635 WeakPolarHBondContact O-CB 3.26Å; K632-L635 WeakPolarHBondContact O-CD1 3.39Å; K632-L635 WeakPolarHBondContact O-CG 3.47Å; K632-L635 PolarHBondContact O-N 3.02Å
633	E	95	Very high	91.6	Very high	38 Å²	38	56 Å²	56	18%	0.178	31%	0.307	C	S	.	.	H	α-helix	trans	-75.2	-15.4	-178.8	-60.6	-71	130	0	0	112.8	W575 R580 L583 I629 F631	W575-E633 HydrophobicContact CD2-CG 4.19Å; W575-E633 HydrophobicContact CG-CG 4.37Å; W575-E633 HydrophobicContact CZ2-CB 4.46Å; W575-E633 HydrophobicContact CZ2-CG 4.23Å; R580-E633 IonicContact CZ-OE2 2.7Å; R580-E633 IonicContact NE-OE2 3.75Å; R580-E633 PolarHBondContact NE-OE2 2.85Å; R580-E633 IonicContact NH2-OE2 3.08Å; L583-E633 HydrophobicContact CD2-CB 4.1Å; I629-E633 HydrophobicContact CG2-CG 4.17Å; I629-E633 WeakPolarHBondContact O-CG 3.5Å; I629-E633 PolarHBondContact O-N 3.03Å; F631-E633 PolarHBondContact O-N 3.29Å
634	S	95.2	Very high	89.8	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	2.2	174.5	55.1	0	0	0	0	114.4	L630 F631 K632 A636 V637 H638	L630-S634 WeakPolarHBondContact O-CB 3.45Å; L630-S634 PolarHBondContact O-N 3.22Å; L630-S634 VanDerWaalsContact O-N 3.13Å; L630-S634 PolarHBondContact O-OG 2.88Å; F631-S634 PolarHBondContact O-N 3.4Å; F631-S634 PolarHBondContact O-OG 3.22Å; F631-S634 VanDerWaalsContact O-OG 3.14Å; K632-S634 VanDerWaalsContact C-N 3.28Å; K632-S634 PolarHBondContact O-N 2.8Å; S634-A636 PolarHBondContact O-N 3.18Å; S634-V637 PolarHBondContact O-N 2.77Å; S634-H638 VanDerWaalsContact C-CE1 3.43Å; S634-H638 PolarHBondContact O-CE1 2.89Å; S634-H638 PolarHBondContact O-ND1 3.22Å; S634-H638 PolarHBondContact OG-CE1 2.9Å; S634-H638 VanDerWaalsContact OG-CE1 3.3Å
635	L	93.4	Very high	87.8	Confident	68 Å²	68	67 Å²	67	36%	0.356	36%	0.355	S	S	.	.	H	α-helix	trans	-55.3	-26.1	-179.2	-79.5	172.6	0	0	0	114.1	F631 K632 V637 H638 G639	F631-L635 HydrophobicContact CD1-CD2 4.46Å; F631-L635 HydrophobicContact CE1-CD2 4.22Å; F631-L635 PolarHBondContact O-N 2.77Å; K632-L635 HydrophobicContact CG-CD1 4.32Å; K632-L635 WeakPolarHBondContact O-CB 3.26Å; K632-L635 WeakPolarHBondContact O-CD1 3.39Å; K632-L635 WeakPolarHBondContact O-CG 3.47Å; K632-L635 PolarHBondContact O-N 3.02Å; L635-V637 PolarHBondContact O-N 3.34Å; L635-V637 VanDerWaalsContact O-N 3.13Å; L635-H638 PolarHBondContact O-N 3.42Å; L635-G639 WeakPolarHBondContact O-CA 3.27Å; L635-G639 PolarHBondContact O-N 2.67Å
636	A	91.6	Very high	85.4	Confident	97 Å²	97	71.4 Å²	71.4	80%	0.802	38%	0.382	S	S	*	.	H	α-helix	trans	-57.4	-24.8	176.2	0	0	0	0	0	113.6	S634	S634-A636 PolarHBondContact O-N 3.18Å
637	V	91.9	Very high	83.1	Confident	27 Å²	27	77.1 Å²	77.1	16%	0.164	40%	0.398	C	S	.	.	H	α-helix	trans	-93.1	-47.4	179	173.8	0	0	0	0	112.1	C584 V587 S588 S634 L635 H640	C584-V637 HydrophobicContact CB-CG2 3.56Å; V587-V637 HydrophobicContact CG1-CB 4.34Å; V587-V637 HydrophobicContact CG1-CG1 4.13Å; S588-V637 VanDerWaalsContact OG-CG1 3.26Å; S588-V637 WeakPolarHBondContact OG-CG1 3.33Å; S588-V637 WeakPolarHBondContact OG-CG2 3.47Å; S634-V637 PolarHBondContact O-N 2.77Å; L635-V637 PolarHBondContact O-N 3.34Å; L635-V637 VanDerWaalsContact O-N 3.13Å; V637-H640 PolarHBondContact O-CE1 3.23Å; V637-H640 PolarHBondContact O-ND1 3.14Å; V637-H640 VanDerWaalsContact O-ND1 3.14Å
638	H	91.8	Very high	80.6	Confident	0 Å²	0	86.9 Å²	86.9	0%	0	43%	0.434	C	S	.	.	H	α-helix	trans	-116.2	-5.8	-163.4	71.8	-80.1	0	0	0	114	V587 L591 L608 F631 S634 L635 H640 L641 T642	V587-H638 HydrophobicContact CG1-CB 4.46Å; L591-H638 HydrophobicContact CD2-CB 4.21Å; L608-H638 HydrophobicContact CD2-CB 4.15Å; L608-H638 WeakPolarHBondContact CD2-CD2 3.38Å; L608-H638 VanDerWaalsContact CD2-CG 3.46Å; F631-H638 AromaticContact CD1-NE2 3.81Å; F631-H638 AromaticContact CD2-NE2 3.83Å; F631-H638 AromaticContact CE1-NE2 3.51Å; F631-H638 AromaticContact CE2-NE2 3.54Å; F631-H638 AromaticContact CG-NE2 3.96Å; F631-H638 AromaticContact CZ-CD2 3.94Å; F631-H638 AromaticContact CZ-NE2 3.36Å; F631-H638 WeakPolarHBondContact CZ-NE2 3.15Å; F631-H638 PolarHBondContact O-CE1 3.15Å; F631-H638 VanDerWaalsContact O-CE1 3.32Å; S634-H638 VanDerWaalsContact C-CE1 3.43Å; S634-H638 PolarHBondContact O-CE1 2.89Å; S634-H638 PolarHBondContact O-ND1 3.22Å; S634-H638 PolarHBondContact OG-CE1 2.9Å; S634-H638 VanDerWaalsContact OG-CE1 3.3Å; L635-H638 PolarHBondContact O-N 3.42Å; H638-H640 PolarHBondContact O-N 3.44Å; H638-H640 VanDerWaalsContact O-N 3.13Å; H638-L641 PolarHBondContact O-N 2.94Å; H638-T642 PolarHBondContact CD2-OG1 3.02Å; H638-T642 PolarHBondContact O-N 3Å; H638-T642 PolarHBondContact O-OG1 2.78Å
639	G	89.4	Confident	77.9	Confident	24 Å²	24	87.3 Å²	87.3	25%	0.247	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-12.4	-176.2	0	0	0	0	0	115	L635 L641 G643	L635-G639 WeakPolarHBondContact O-CA 3.27Å; L635-G639 PolarHBondContact O-N 2.67Å; G639-L641 VanDerWaalsContact C-N 3.34Å; G639-G643 WeakPolarHBondContact O-CA 3.4Å; G639-G643 PolarHBondContact O-N 3.36Å
640	H	87	Confident	75.1	Confident	151 Å²	151	89.8 Å²	89.8	70%	0.699	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-26.8	168.6	66.1	-97	0	0	0	112.3	V637 H638	V637-H640 PolarHBondContact O-CE1 3.23Å; V637-H640 PolarHBondContact O-ND1 3.14Å; V637-H640 VanDerWaalsContact O-ND1 3.14Å; H638-H640 PolarHBondContact O-N 3.44Å; H638-H640 VanDerWaalsContact O-N 3.13Å
641	L	85.1	Confident	72.2	Confident	91 Å²	91	95.4 Å²	95.4	48%	0.476	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-20.8	-174.7	-172.5	54.7	0	0	0	112.7	L591 V604 H638 G639	L591-L641 HydrophobicContact CD1-CD2 4.11Å; L591-L641 HydrophobicContact CD2-CD2 4.42Å; V604-L641 HydrophobicContact CB-CD2 4.45Å; V604-L641 HydrophobicContact CB-CG 4.34Å; V604-L641 HydrophobicContact CG1-CD2 3.83Å; V604-L641 HydrophobicContact CG1-CG 3.99Å; V604-L641 HydrophobicContact CG2-CD1 4.48Å; V604-L641 HydrophobicContact CG2-CD2 3.92Å; V604-L641 HydrophobicContact CG2-CG 3.99Å; H638-L641 PolarHBondContact O-N 2.94Å; G639-L641 VanDerWaalsContact C-N 3.34Å
642	T	84	Confident	69.6	Low	10 Å²	10	100.4 Å²	100.4	6%	0.061	52%	0.521	C	S	.	.	S	Bend	trans	-110.7	18.3	173.7	63	0	0	0	0	113.3	V604 E605 F631 H638 N644	V604-T642 HydrophobicContact CB-CG2 4.48Å; V604-T642 HydrophobicContact CG1-CG2 4.08Å; E605-T642 HydrophobicContact CB-CG2 3.81Å; F631-T642 HydrophobicContact CZ-CG2 4.14Å; H638-T642 PolarHBondContact CD2-OG1 3.02Å; H638-T642 PolarHBondContact O-N 3Å; H638-T642 PolarHBondContact O-OG1 2.78Å; T642-N644 VanDerWaalsContact C-N 3.28Å; T642-N644 PolarHBondContact O-N 3.25Å
643	G	69.5	Low	66.5	Low	45 Å²	45	98.4 Å²	98.4	46%	0.464	53%	0.531	S	S	.	.			trans	-72	35.1	-162.1	0	0	0	0	0	119.1	G639 L645	G639-G643 WeakPolarHBondContact O-CA 3.4Å; G639-G643 PolarHBondContact O-N 3.36Å; G643-L645 VanDerWaalsContact C-N 3.26Å; G643-L645 PolarHBondContact O-N 2.88Å
644	N	52.8	Low	64.2	Low	146 Å²	146	102.9 Å²	102.9	78%	0.781	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	0.7	-176.3	-83.3	-42.6	0	0	0	115.8	T642	T642-N644 VanDerWaalsContact C-N 3.28Å; T642-N644 PolarHBondContact O-N 3.25Å
645	L	54.1	Low	61.1	Low	157 Å²	157	112.9 Å²	112.9	82%	0.822	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	0.7	-169.5	-83.8	162.5	0	0	0	116.5	G643	G643-L645 VanDerWaalsContact C-N 3.26Å; G643-L645 PolarHBondContact O-N 2.88Å
646	V	46	Very low	58.5	Low	106 Å²	106	114.2 Å²	114.2	64%	0.642	63%	0.628	S	S	*	*	S	Bend	trans	-94	-23.8	-175.8	-176	0	0	0	0	113.6	R648 R649	V646-R648 PolarHBondContact O-N 2.82Å; V646-R649 PolarHBondContact O-N 2.87Å
647	R	47.4	Very low	55.5	Low	245 Å²	245	119.2 Å²	119.2	93%	0.925	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	31.1	-174.6	-81.5	-162.5	176.9	-159.9	2.1	116.3
648	R	43	Very low	52.7	Low	222 Å²	222	122.5 Å²	122.5	84%	0.838	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.7	55.1	151.8	-71.2	-154.6	96	142.2	5.7	113.1	V646 V650	V646-R648 PolarHBondContact O-N 2.82Å; R648-V650 PolarHBondContact O-N 3.16Å
649	R	38	Very low	49.6	Very low	224 Å²	224	131.5 Å²	131.5	85%	0.845	70%	0.7	S	S	*	*			trans	-68.7	89.4	146.2	-70.1	-155.8	-160.8	-162.5	10.9	108.5	V646 V651	V646-R649 PolarHBondContact O-N 2.87Å; R649-V651 PolarHBondContact O-N 3.45Å
650	V	35.7	Very low	46.6	Very low	108 Å²	108	136.4 Å²	136.4	66%	0.655	72%	0.721	S	S	*	*			trans	-66.6	125	161.9	176.6	0	0	0	0	106.8	R648 P652	R648-V650 PolarHBondContact O-N 3.16Å; V650-P652 WeakPolarHBondContact O-CD 3.47Å
651	V	35.4	Very low	43.7	Very low	118 Å²	118	132.4 Å²	132.4	72%	0.715	72%	0.72	S	S	*	*			trans	-68.4	126.2	178.6	177.2	0	0	0	0	109	R649 G653	R649-V651 PolarHBondContact O-N 3.45Å; V651-G653 PolarHBondContact O-N 2.84Å
652	P	41	Very low	41	Very low	125 Å²	125	135.2 Å²	135.2	81%	0.812	74%	0.735	S	S	*	*			trans	-66.4	99.5	167.2	-18.6	33.1	0	0	0	109.3	V650	V650-P652 WeakPolarHBondContact O-CD 3.47Å
653	G	29.8	Very low	38.3	Very low	65 Å²	65	145.4 Å²	145.4	67%	0.67	77%	0.773	S	S	*	*			trans	-72.2	132.2	-179.6	0	0	0	0	0	111.7	V651 K655	V651-G653 PolarHBondContact O-N 2.84Å; G653-K655 PolarHBondContact O-N 3.27Å
654	P	45.4	Very low	36.6	Very low	131 Å²	131	148.8 Å²	148.8	85%	0.851	78%	0.779	S	S	*	*			trans	-79.8	112.7	-179.7	30.8	-33.4	0	0	0	111.4
655	K	29.6	Very low	35.5	Very low	211 Å²	211	147.2 Å²	147.2	92%	0.917	77%	0.771	S	S	*	*			trans	-136.4	116.4	159.8	-86.9	-169.2	175.4	178.9	0	110.8	G653	G653-K655 PolarHBondContact O-N 3.27Å
656	A	38.8	Very low	34.2	Very low	96 Å²	96	148.2 Å²	148.2	79%	0.793	77%	0.768	S	S	*	*			trans	-105.4	149.1	164.8	0	0	0	0	0	109.8
657	K	30.6	Very low	33.4	Very low	201 Å²	201	150.9 Å²	150.9	87%	0.874	78%	0.778	S	S	*	*			trans	-163.7	119.6	140	-79.6	-129.8	174.5	-174.5	0	106.1
658	A	31.3	Very low	33.5	Very low	97 Å²	97	143.9 Å²	143.9	80%	0.802	76%	0.764	S	S	*	*				65	124.3	79.7	0	0	0	0	0	111.3
659	K	27.4	Very low	32.9	Very low	188 Å²	188	140.5 Å²	140.5	82%	0.817	76%	0.762	S	S	*	*				-160.4	154.8	65.5	164.3	-174.2	179.2	-163.7	0	108.6
660	D	26.7	Very low	32.4	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	76%	0.757	S	S	*	*			cis	-135.4	-166	7.3	-146	-57.1	0	0	0	110.3
661	G	26.8	Very low	32	Very low	66 Å²	66	138.1 Å²	138.1	68%	0.68	76%	0.764	S	S	*	*			trans	153.8	56.4	162.1	0	0	0	0	0	117.6
662	L	27.2	Very low	31.6	Very low	151 Å²	151	137.8 Å²	137.8	79%	0.791	76%	0.762	S	S	*	*			trans	-2	126.6	156.3	-61.6	157.3	0	0	0	115.7
663	W	27.8	Very low	30.8	Very low	224 Å²	224	136.9 Å²	136.9	85%	0.848	76%	0.759	S	S	*	*			cis	-171.9	-165.7	21.9	52.9	13.7	0	0	0	108.5
664	I	34.1	Very low	30.7	Very low	116 Å²	116	141.4 Å²	141.4	60%	0.595	77%	0.768	S	S	*	*			cis	-163.7	172.6	11.3	-158.3	166.1	0	0	0	111.2
665	N	28.5	Very low	31	Very low	113 Å²	113	140.7 Å²	140.7	60%	0.604	76%	0.763	S	S	*	*			trans	61.4	95.5	159.2	-76.4	-38.5	0	0	0	123.2
666	K	27.3	Very low	30.8	Very low	178 Å²	178	134.8 Å²	134.8	77%	0.774	75%	0.754	S	S	*	*				68.6	101.2	123.8	-63.6	169.1	-176.1	178.5	0	120.2
667	L	29.8	Very low	30.4	Very low	161 Å²	161	136.7 Å²	136.7	84%	0.843	76%	0.755	S	S	*	*				59.1	153.8	67.9	-86.6	79.8	0	0	0	116.5
668	P	49.9	Very low	30.3	Very low	99 Å²	99	133.6 Å²	133.6	64%	0.643	75%	0.753	S	S	*	*			cis	-146.5	-161.6	-19.9	34.3	-10.2	0	0	0	116.2
669	L	29.6	Very low	30.1	Very low	151 Å²	151	134.4 Å²	134.4	79%	0.791	75%	0.753	S	S	*	*			trans	98.3	142	159	-50.3	-172.6	0	0	0	117
670	T	27.2	Very low	30.1	Very low	121 Å²	121	129.8 Å²	129.8	74%	0.742	75%	0.75	S	S	*	*			cis	-148.3	155.9	6.5	-16.1	0	0	0	0	114.3
671	M	28.6	Very low	30	Very low	160 Å²	160	135.8 Å²	135.8	79%	0.788	76%	0.763	S	S	*	*			trans	-15.9	169.8	152.4	-58.3	-67.3	92.6	0	0	120.2
672	T	25.3	Very low	30.1	Very low	112 Å²	112	140.6 Å²	140.6	69%	0.687	77%	0.767	S	S	*	*			cis	173.2	145.3	-19.9	-82.7	0	0	0	0	108.1
673	S	26.2	Very low	30.5	Very low	106 Å²	106	139.3 Å²	139.3	74%	0.741	77%	0.768	S	S	*	*			trans	160	130.6	134.6	61.5	0	0	0	0	116.3
674	N	27.4	Very low	31.7	Very low	160 Å²	160	133.6 Å²	133.6	86%	0.856	76%	0.76	S	S	*	*			trans	-100.3	-172.5	153.5	-80.4	3.3	0	0	0	107.5
675	P	50	Low	31.3	Very low	116 Å²	116	135.7 Å²	135.7	75%	0.753	77%	0.772	S	S	*	*			cis	-150.1	177.5	16.3	46.7	-26.4	0	0	0	119.6
676	A	27.3	Very low	31.1	Very low	87 Å²	87	138.3 Å²	138.3	72%	0.719	78%	0.782	S	S	*	*			trans	45.4	156.5	134.5	0	0	0	0	0	122.6
677	V	29.4	Very low	31.1	Very low	136 Å²	136	134.9 Å²	134.9	82%	0.824	79%	0.787	S	S	*	*			cis	-113.1	-121.2	14.4	-155	0	0	0	0	112.7
678	T	27.9	Very low	30.9	Very low	135 Å²	135	132.4 Å²	132.4	83%	0.828	78%	0.783	S	S	*	*			cis	-150.9	-176.7	3.3	-39.1	0	0	0	0	108.8
679	S	27.4	Very low	31.4	Very low	114 Å²	114	133 Å²	133	80%	0.797	79%	0.787	S	S	*	*			trans	-145.4	158.5	-167.3	-167.1	0	0	0	0	116.7
680	A	28.2	Very low	32	Very low	91 Å²	91	131.6 Å²	131.6	75%	0.752	79%	0.787	S	S	*	*			trans	104.4	123.2	140.7	0	0	0	0	0	122.7
681	R	24.9	Very low	32	Very low	254 Å²	254	134.2 Å²	134.2	96%	0.958	79%	0.791	S	S	*	*			trans	103	135.8	136	-149	173.2	-172.5	-165.3	0.8	119.9
682	Q	29	Very low	33	Very low	167 Å²	167	131.6 Å²	131.6	78%	0.78	79%	0.786	S	S	*	*			trans	-90.2	172.1	178.3	-54.2	168.8	-63.9	0	0	112.3
683	P	34.1	Very low	33.1	Very low	124 Å²	124	134.2 Å²	134.2	81%	0.805	79%	0.794	S	S	*	*				-140.8	170.2	93.2	37.7	-23.6	0	0	0	115.8
684	P	53.7	Low	33.1	Very low	104 Å²	104	134.3 Å²	134.3	68%	0.675	79%	0.793	S	S	*	*			trans	-108.4	178	179.9	41.5	-34.7	0	0	0	114.4
685	L	25.8	Very low	33.2	Very low	161 Å²	161	133.8 Å²	133.8	84%	0.843	79%	0.789	S	S	*	*			trans	171.1	132	133.3	-92.5	167.1	0	0	0	115.8
686	M	24.8	Very low	32.1	Very low	168 Å²	168	133.2 Å²	133.2	83%	0.828	79%	0.788	S	S	*	*			trans	37.5	153.9	138.3	-65.5	-67.3	103.4	0	0	126.7
687	A	25.8	Very low	32.1	Very low	105 Å²	105	136.2 Å²	136.2	87%	0.868	79%	0.792	S	S	*	*			trans	94.3	163.3	153.3	0	0	0	0	0	120.8
688	S	25.5	Very low	32.2	Very low	110 Å²	110	134.5 Å²	134.5	77%	0.769	79%	0.786	S	S	*	*			trans	-166.5	163.2	-161.3	178.5	0	0	0	0	110.8
689	P	60.3	Low	32.5	Very low	111 Å²	111	135.4 Å²	135.4	72%	0.721	79%	0.785	S	S	*	*			cis	-109.4	-110	1.1	23	1.8	0	0	0	113.9
690	P	42.3	Very low	32.6	Very low	122 Å²	122	136.1 Å²	136.1	79%	0.792	78%	0.78	S	S	*	*			cis	-127.4	-111	21.5	40	-18	0	0	0	116.2
691	E	27	Very low	32.9	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.822	78%	0.782	S	S	*	*			trans	-151	177.9	-166	-90.8	-164.8	160	0	0	110.3
692	P	49.7	Very low	33.2	Very low	105 Å²	105	134.5 Å²	134.5	68%	0.682	77%	0.773	S	S	*	*			cis	-135.6	-145.2	-35.1	36.7	-15.5	0	0	0	111.8
693	I	28.4	Very low	33.5	Very low	166 Å²	166	133.9 Å²	133.9	85%	0.851	77%	0.774	S	S	*	*			trans	106.7	153.5	164.8	-57.9	168.8	0	0	0	116.3
694	C	25.6	Very low	33.8	Very low	108 Å²	108	134.1 Å²	134.1	73%	0.73	77%	0.773	S	S	*	*			trans	-141.3	173.1	-165.8	-171.4	0	0	0	0	111.6
695	L	29.3	Very low	33	Very low	149 Å²	149	133 Å²	133	78%	0.78	77%	0.773	S	S	*	*			trans	94.3	108.2	166.7	-53.6	178.3	0	0	0	119.7
696	S	27	Very low	33.8	Very low	104 Å²	104	131.6 Å²	131.6	73%	0.727	77%	0.773	S	S	*	*				69.6	110.2	121.2	-52	0	0	0	0	123.6
697	D	28.7	Very low	34.5	Very low	150 Å²	150	127.5 Å²	127.5	80%	0.802	76%	0.761	S	S	*	*				69.5	108.7	114.1	-166.3	25.6	0	0	0	121.9
698	S	31.4	Very low	35.4	Very low	100 Å²	100	129.3 Å²	129.3	70%	0.699	76%	0.756	S	S	*	*			trans	-174.8	128.6	133.9	-82.3	0	0	0	0	113
699	L	33.7	Very low	36.7	Very low	154 Å²	154	128.9 Å²	128.9	81%	0.806	75%	0.745	S	S	*	*				44.6	140.7	128.5	-61.8	172.6	0	0	0	120.8
700	D	29.9	Very low	36	Very low	129 Å²	129	128.4 Å²	128.4	69%	0.69	74%	0.744	S	S	*	*			cis	-158.5	165.9	6.5	-156.6	-171.2	0	0	0	113.8
701	E	33.2	Very low	36.5	Very low	170 Å²	170	127.9 Å²	127.9	79%	0.794	73%	0.733	S	S	*	*			trans	50.6	154.8	157.2	-92.1	-174.8	31.6	0	0	124.7
702	D	31.8	Very low	37.4	Very low	142 Å²	142	123.2 Å²	123.2	76%	0.759	72%	0.72	S	S	*	*			trans	84.4	151.9	161.8	-127.6	-20.6	0	0	0	122.3
703	L	35.8	Very low	37.3	Very low	153 Å²	153	124.2 Å²	124.2	80%	0.801	72%	0.715	S	S	*	*			trans	70	67.2	177.1	-58	-177.5	0	0	0	119.4
704	T	40	Very low	38.3	Very low	129 Å²	129	118.8 Å²	118.8	79%	0.791	70%	0.695	S	S	*	*				29.2	130.8	118.7	-48.1	0	0	0	0	120.3
705	A	37.6	Very low	39.7	Very low	81 Å²	81	119.4 Å²	119.4	67%	0.669	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-55.7	149.5	173.9	0	0	0	0	0	114.7	S707	A705-S707 PolarHBondContact O-N 3.5Å
706	P	42.3	Very low	40.8	Very low	132 Å²	132	114.9 Å²	114.9	86%	0.857	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-63.6	124.1	-178.1	26	-35	0	0	0	111.9
707	S	38.4	Very low	41.9	Very low	82 Å²	82	115.3 Å²	115.3	57%	0.573	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-79.1	160.5	-173.8	75.4	0	0	0	0	113.8	A705 D709	A705-S707 PolarHBondContact O-N 3.5Å; S707-D709 WeakPolarHBondContact CB-OD2 3.22Å; S707-D709 PolarHBondContact O-N 2.98Å; S707-D709 PolarHBondContact OG-OD2 2.94Å
708	L	45.2	Very low	42.9	Very low	143 Å²	143	114.7 Å²	114.7	75%	0.749	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	10.3	-178.1	-95.1	162.4	0	0	0	114.3	S710 I711	L708-S710 PolarHBondContact O-N 2.86Å; L708-I711 HydrophobicContact CD2-CD1 4.1Å
709	D	53.3	Low	43.7	Very low	101 Å²	101	114.3 Å²	114.3	54%	0.54	66%	0.661	S	S	.	*	H	α-helix	trans	-73.3	-25.5	-171.2	-64.6	-67.8	0	0	0	114.4	S707 I711 S712 H713	S707-D709 WeakPolarHBondContact CB-OD2 3.22Å; S707-D709 PolarHBondContact O-N 2.98Å; S707-D709 PolarHBondContact OG-OD2 2.94Å; D709-I711 PolarHBondContact O-N 3.41Å; D709-S712 WeakPolarHBondContact O-CB 3.41Å; D709-S712 PolarHBondContact O-N 3.21Å; D709-H713 PolarHBondContact O-N 3.44Å
710	S	45.8	Very low	44.4	Very low	100 Å²	100	113.7 Å²	113.7	70%	0.699	66%	0.659	S	S	*	*	H	α-helix	trans	-59.8	-30.4	-179.4	-169.6	0	0	0	0	113	L708 A714	L708-S710 PolarHBondContact O-N 2.86Å; S710-A714 PolarHBondContact O-N 3.26Å
711	I	52.4	Low	45	Very low	111 Å²	111	111.7 Å²	111.7	57%	0.569	66%	0.661	S	S	*	*	H	α-helix	trans	-78.2	-38.6	176	-57.2	178.4	0	0	0	111	L708 D709 A714 L715	L708-I711 HydrophobicContact CD2-CD1 4.1Å; D709-I711 PolarHBondContact O-N 3.41Å; I711-A714 PolarHBondContact O-N 2.9Å; I711-L715 HydrophobicContact CG2-CD1 4.48Å; I711-L715 PolarHBondContact O-N 3.18Å
712	S	45.5	Very low	45.2	Very low	79 Å²	79	108.5 Å²	108.5	55%	0.552	66%	0.657	S	S	*	*	H	α-helix	trans	-63.7	-45.8	176.3	-168.7	0	0	0	0	111.3	D709 A714 L715 A716	D709-S712 WeakPolarHBondContact O-CB 3.41Å; D709-S712 PolarHBondContact O-N 3.21Å; S712-A714 VanDerWaalsContact C-N 3.32Å; S712-A714 PolarHBondContact O-N 3.05Å; S712-L715 PolarHBondContact O-N 2.9Å; S712-A716 PolarHBondContact O-N 2.98Å
713	H	48	Very low	45.4	Very low	125 Å²	125	111.5 Å²	111.5	58%	0.579	66%	0.663	S	S	*	*	H	α-helix	trans	-67.6	-31	-178.5	-153.7	-44.1	0	0	0	112.8	D709 L717	D709-H713 PolarHBondContact O-N 3.44Å; H713-L717 WeakPolarHBondContact O-CD1 3.21Å; H713-L717 VanDerWaalsContact O-CG 3.31Å; H713-L717 WeakPolarHBondContact O-CG 3.33Å; H713-L717 PolarHBondContact O-N 3.36Å
714	A	49	Very low	45.1	Very low	52 Å²	52	107.5 Å²	107.5	43%	0.43	66%	0.659	S	S	.	*	H	α-helix	trans	-67.8	-40.4	173.1	0	0	0	0	0	112.5	S710 I711 S712 L717 L718	S710-A714 PolarHBondContact O-N 3.26Å; I711-A714 PolarHBondContact O-N 2.9Å; S712-A714 VanDerWaalsContact C-N 3.32Å; S712-A714 PolarHBondContact O-N 3.05Å; A714-L717 PolarHBondContact O-N 3.14Å; A714-L718 WeakPolarHBondContact O-CD1 3.44Å; A714-L718 PolarHBondContact O-N 3.12Å
715	L	54.9	Low	44.6	Very low	121 Å²	121	109.7 Å²	109.7	63%	0.634	67%	0.665	S	S	*	*	H	α-helix	trans	-72.5	-35.7	177.8	-68.3	171.4	0	0	0	112.3	I711 S712 L717 L718 S719	I711-L715 HydrophobicContact CG2-CD1 4.48Å; I711-L715 PolarHBondContact O-N 3.18Å; S712-L715 PolarHBondContact O-N 2.9Å; L715-L717 VanDerWaalsContact C-N 3.32Å; L715-L717 PolarHBondContact O-N 3.05Å; L715-L718 PolarHBondContact O-N 3.48Å; L715-S719 PolarHBondContact O-N 3.32Å
716	A	52.6	Low	44.1	Very low	54 Å²	54	109.3 Å²	109.3	45%	0.446	67%	0.669	S	S	.	*	H	α-helix	trans	-60.9	-39.1	172.7	0	0	0	0	0	112.5	S712 L718 S719	S712-A716 PolarHBondContact O-N 2.98Å; A716-L718 PolarHBondContact O-N 3.47Å; A716-S719 WeakPolarHBondContact O-CB 3.39Å; A716-S719 PolarHBondContact O-N 2.83Å; A716-S719 VanDerWaalsContact O-N 3.13Å
717	L	50.3	Low	43.5	Very low	113 Å²	113	110.9 Å²	110.9	59%	0.592	67%	0.669	S	S	*	*	H	α-helix	trans	-69.4	-29	-179.7	-74.7	168.2	0	0	0	113.6	H713 A714 L715 S719	H713-L717 WeakPolarHBondContact O-CD1 3.21Å; H713-L717 VanDerWaalsContact O-CG 3.31Å; H713-L717 WeakPolarHBondContact O-CG 3.33Å; H713-L717 PolarHBondContact O-N 3.36Å; A714-L717 PolarHBondContact O-N 3.14Å; L715-L717 VanDerWaalsContact C-N 3.32Å; L715-L717 PolarHBondContact O-N 3.05Å; L717-S719 VanDerWaalsContact C-N 3.32Å
718	L	49.6	Very low	42.9	Very low	138 Å²	138	111.6 Å²	111.6	72%	0.723	68%	0.68	S	S	*	*	H	α-helix	trans	-72.8	-23.5	170.9	-90.1	79.8	0	0	0	112.9	A714 L715 A716 N720	A714-L718 WeakPolarHBondContact O-CD1 3.44Å; A714-L718 PolarHBondContact O-N 3.12Å; L715-L718 PolarHBondContact O-N 3.48Å; A716-L718 PolarHBondContact O-N 3.47Å; L718-N720 VanDerWaalsContact C-N 3.34Å; L718-N720 PolarHBondContact O-N 2.82Å
719	S	49.6	Very low	41.9	Very low	91 Å²	91	112 Å²	112	64%	0.636	68%	0.684	S	S	*	*	H	α-helix	trans	-75.9	-17	-177.3	-169.1	0	0	0	0	114.4	L715 A716 L717	L715-S719 PolarHBondContact O-N 3.32Å; A716-S719 WeakPolarHBondContact O-CB 3.39Å; A716-S719 PolarHBondContact O-N 2.83Å; A716-S719 VanDerWaalsContact O-N 3.13Å; L717-S719 VanDerWaalsContact C-N 3.32Å
720	N	47.3	Very low	40.9	Very low	142 Å²	142	112.5 Å²	112.5	76%	0.759	70%	0.695	S	S	*	*	S	Bend	trans	-109	-1.9	-173.6	-77.7	8.8	0	0	0	114.5	L718 S722	L718-N720 VanDerWaalsContact C-N 3.34Å; L718-N720 PolarHBondContact O-N 2.82Å; N720-S722 VanDerWaalsContact C-N 3.31Å; N720-S722 PolarHBondContact O-N 2.93Å
721	A	42.3	Very low	40.4	Very low	87 Å²	87	113.2 Å²	113.2	72%	0.719	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	12.6	-172.4	0	0	0	0	0	115.5
722	S	37.8	Very low	39	Very low	102 Å²	102	115.1 Å²	115.1	71%	0.713	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.7	39.6	-172.1	56.2	0	0	0	0	115.8	N720	N720-S722 VanDerWaalsContact C-N 3.31Å; N720-S722 PolarHBondContact O-N 2.93Å
723	K	35.4	Very low	38.2	Very low	205 Å²	205	115.9 Å²	115.9	89%	0.891	71%	0.711	S	S	*	*			trans	-135.7	96.8	164.3	-76.1	-169.7	178.5	178.3	0	113.8
724	G	30.8	Very low	37.1	Very low	70 Å²	70	117 Å²	117	72%	0.722	72%	0.716	S	S	*	*			trans	-158.6	106.6	159.4	0	0	0	0	0	107
725	L	29	Very low	36.1	Very low	174 Å²	174	122.2 Å²	122.2	91%	0.911	74%	0.736	S	S	*	*				92.4	131.3	57.2	-74.9	171.9	0	0	0	112
726	G	25.8	Very low	34.8	Very low	74 Å²	74	120.9 Å²	120.9	76%	0.763	74%	0.742	S	S	*	*			trans	100.3	89.2	-166.6	0	0	0	0	0	111.4
727	L	31.1	Very low	33.9	Very low	164 Å²	164	124.8 Å²	124.8	86%	0.859	76%	0.761	S	S	*	*			cis	84.7	80.4	26	-153.6	169.4	0	0	0	114
728	A	25.3	Very low	33.4	Very low	97 Å²	97	125 Å²	125	80%	0.802	77%	0.772	S	S	*	*			trans	-175.8	146	156.9	0	0	0	0	0	108.5
729	D	24.3	Very low	32.5	Very low	153 Å²	153	123.2 Å²	123.2	82%	0.818	78%	0.777	S	S	*	*			cis	-155.1	159.8	-27.5	-161.3	1.1	0	0	0	108.7
730	S	32.7	Very low	31.6	Very low	111 Å²	111	123 Å²	123	78%	0.776	78%	0.781	S	S	*	*			trans	-138.6	122.4	-176.8	-76.3	0	0	0	0	113.3
731	P	34.6	Very low	31	Very low	114 Å²	114	121.4 Å²	121.4	74%	0.74	78%	0.781	S	S	*	*			trans	-135.8	160.4	137.6	38	-26.5	0	0	0	110.9
732	M	23.3	Very low	30.7	Very low	151 Å²	151	123 Å²	123	74%	0.744	78%	0.782	S	S	*	*			cis	-150.5	178.7	-5.9	-138.7	58.4	-178.1	0	0	105.3
733	S	28.9	Very low	30.6	Very low	96 Å²	96	124.9 Å²	124.9	67%	0.671	78%	0.783	S	S	*	*			cis	-156.9	164.2	10	-144.1	0	0	0	0	106.4
734	Q	24.6	Very low	30.6	Very low	147 Å²	147	122.4 Å²	122.4	69%	0.687	78%	0.775	S	S	*	*			cis	63.4	90.2	34.3	-72.9	-171.3	-22.2	0	0	114.6
735	L	28.1	Very low	30.8	Very low	162 Å²	162	127 Å²	127	85%	0.848	78%	0.777	S	S	*	*				81.1	105.5	78.4	178	72.9	0	0	0	112.3
736	A	27.7	Very low	31.1	Very low	93 Å²	93	126.7 Å²	126.7	77%	0.769	77%	0.771	S	S	*	*			trans	-165.8	116.1	161.1	0	0	0	0	0	113.7
737	T	34.3	Very low	31.3	Very low	136 Å²	136	127.9 Å²	127.9	83%	0.834	77%	0.768	S	S	*	*			trans	-159.5	123.3	143.3	38.1	0	0	0	0	105.6
738	S	39.5	Very low	31.3	Very low	117 Å²	117	127.1 Å²	127.1	82%	0.818	76%	0.764	S	S	*	*			cis	-144.6	-175.1	1.6	-63.3	0	0	0	0	109.7
739	A	30.9	Very low	31.5	Very low	101 Å²	101	128.8 Å²	128.8	84%	0.835	76%	0.763	S	S	*	*			trans	-63.7	156.4	-179.9	0	0	0	0	0	113.4
740	A	30.4	Very low	31.6	Very low	88 Å²	88	129.1 Å²	129.1	73%	0.727	76%	0.758	S	S	*	*			cis	-163.4	172.4	-1.8	0	0	0	0	0	113.5
741	S	33.8	Very low	31.2	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	75%	0.752	S	S	*	*			trans	81.2	103.3	144.9	-65.8	0	0	0	0	124.6
742	T	36	Very low	30.8	Very low	121 Å²	121	128.4 Å²	128.4	74%	0.742	75%	0.746	S	S	*	*				92.6	121.9	112	-53	0	0	0	0	123.5
743	L	36	Very low	32.2	Very low	141 Å²	141	126.8 Å²	126.8	74%	0.738	75%	0.747	S	S	*	*			trans	94.9	131.6	148.1	-121.5	73.4	0	0	0	125.1
744	Q	35.1	Very low	32.1	Very low	153 Å²	153	126 Å²	126	72%	0.715	75%	0.746	S	S	*	*			trans	63.2	111	140.3	-93.3	171.7	2.3	0	0	125.7
745	Q	35.9	Very low	32.9	Very low	167 Å²	167	125.2 Å²	125.2	78%	0.78	75%	0.753	S	S	*	*				63.5	151.3	125.5	-78.5	-167.7	-6.3	0	0	124.8
746	H	34.8	Very low	32.9	Very low	167 Å²	167	125.2 Å²	125.2	77%	0.773	75%	0.754	S	S	*	*			trans	90.9	118.5	140.8	85.9	-72.6	0	0	0	126
747	S	31.1	Very low	34.1	Very low	99 Å²	99	126.4 Å²	126.4	69%	0.692	75%	0.754	S	S	*	*				91.4	140.1	128.3	-95.6	0	0	0	0	126.3
748	L	29.9	Very low	34.9	Very low	149 Å²	149	125.1 Å²	125.1	78%	0.78	75%	0.748	S	S	*	*			trans	58.2	119.4	147.3	-91.5	45.5	0	0	0	120.9
749	V	29.8	Very low	34.2	Very low	131 Å²	131	124.2 Å²	124.2	79%	0.794	75%	0.747	S	S	*	*				79.7	132.7	79.4	164.7	0	0	0	0	113.4
750	K	26.1	Very low	34.1	Very low	160 Å²	160	124 Å²	124	70%	0.696	75%	0.746	S	S	*	*			cis	-131.8	-151.3	-1.4	-138	-164.5	-160.8	-142.7	0	108.7	E752	K750-E752 WeakPolarHBondContact CD-OE2 3.43Å; K750-E752 WeakPolarHBondContact CE-OE2 3.19Å; K750-E752 IonicContact NZ-OE1 2.7Å; K750-E752 PolarHBondContact NZ-OE1 3.49Å; K750-E752 IonicContact NZ-OE2 2.77Å; K750-E752 PolarHBondContact NZ-OE2 2.94Å
751	A	25.5	Very low	34.2	Very low	80 Å²	80	125.1 Å²	125.1	66%	0.661	75%	0.748	S	S	*	*			cis	-152.7	173.1	2.4	0	0	0	0	0	107.5
752	E	26.1	Very low	34.1	Very low	131 Å²	131	126.9 Å²	126.9	61%	0.612	75%	0.754	S	S	*	*			cis	80	144.3	16.4	-71.5	169.6	67.9	0	0	118.6	K750	K750-E752 WeakPolarHBondContact CD-OE2 3.43Å; K750-E752 WeakPolarHBondContact CE-OE2 3.19Å; K750-E752 IonicContact NZ-OE1 2.7Å; K750-E752 PolarHBondContact NZ-OE1 3.49Å; K750-E752 IonicContact NZ-OE2 2.77Å; K750-E752 PolarHBondContact NZ-OE2 2.94Å
753	P	51.9	Low	34	Very low	117 Å²	117	124.5 Å²	124.5	76%	0.76	75%	0.753	S	S	*	*			cis	-142.4	-172.6	-27.9	39.7	-20.3	0	0	0	115.5
754	A	26.5	Very low	34.1	Very low	80 Å²	80	124.9 Å²	124.9	66%	0.661	76%	0.756	S	S	*	*			trans	-81.4	-170.3	159.6	0	0	0	0	0	111.6
755	P	42.3	Very low	34.2	Very low	129 Å²	129	124.7 Å²	124.7	84%	0.838	76%	0.759	S	S	*	*				-152.8	-152.5	91.6	42.8	-23	0	0	0	115.4
756	L	27	Very low	34	Very low	163 Å²	163	122.1 Å²	122.1	85%	0.853	76%	0.76	S	S	*	*			trans	-115.2	-130	-157.5	-63.8	161.8	0	0	0	113.5
757	P	53	Low	34	Very low	118 Å²	118	117.5 Å²	117.5	77%	0.766	76%	0.757	S	S	*	*				-117.2	-108.3	-129.6	30.6	-5.5	0	0	0	119.8
758	P	51	Low	34.2	Very low	109 Å²	109	119 Å²	119	71%	0.708	76%	0.762	S	S	*	*				-127	178.4	-108.7	38.5	-20.4	0	0	0	118
759	A	25.3	Very low	34.3	Very low	97 Å²	97	115.7 Å²	115.7	80%	0.802	75%	0.752	S	S	*	*			trans	75.7	162.8	143.6	0	0	0	0	0	122.5
760	A	28.6	Very low	34.5	Very low	98 Å²	98	113.3 Å²	113.3	81%	0.81	74%	0.741	S	S	*	*			trans	86	105.8	156	0	0	0	0	0	122.6
761	S	33.1	Very low	34.8	Very low	110 Å²	110	110.4 Å²	110.4	77%	0.769	74%	0.74	S	S	*	*			trans	13.9	133	135.3	-168.4	0	0	0	0	122.7
762	V	30.8	Very low	35	Very low	145 Å²	145	112.5 Å²	112.5	88%	0.879	75%	0.745	S	S	*	*				-178.5	150.4	110.8	-88.6	0	0	0	0	114.4
763	G	34.7	Very low	35.2	Very low	71 Å²	71	111.1 Å²	111.1	73%	0.732	75%	0.75	S	S	*	*				101.9	90.7	128.8	0	0	0	0	0	124.7
764	N	37.4	Very low	34	Very low	149 Å²	149	110.6 Å²	110.6	80%	0.797	75%	0.749	S	S	*	*				54.4	127.4	126.8	-82.4	12.1	0	0	0	127.8
765	L	37.7	Very low	34.1	Very low	148 Å²	148	112.2 Å²	112.2	78%	0.775	76%	0.755	S	S	*	*				96.2	131.2	123.4	-73.8	172.2	0	0	0	126.3
766	S	32.5	Very low	33.4	Very low	114 Å²	114	110.9 Å²	110.9	80%	0.797	75%	0.749	S	S	*	*			trans	83.4	108.5	139.9	-64.5	0	0	0	0	125.5
767	G	34.6	Very low	33.7	Very low	69 Å²	69	108 Å²	108	71%	0.711	74%	0.742	S	S	*	*				112.5	98	107.9	0	0	0	0	0	123.1
768	T	34.1	Very low	32.6	Very low	132 Å²	132	108.2 Å²	108.2	81%	0.81	74%	0.742	S	S	*	*			trans	65.2	171.5	157.2	25.6	0	0	0	0	117.9
769	S	33.3	Very low	31.7	Very low	79 Å²	79	108 Å²	108	55%	0.552	74%	0.743	S	S	*	*			cis	-166.5	171.2	-11.3	39	0	0	0	0	108.9	M1155	S769-M1155 WeakPolarHBondContact O-CE 3.38Å
770	S	33.1	Very low	32.6	Very low	81 Å²	81	109 Å²	109	57%	0.566	74%	0.741	S	S	*	*			cis	-172.2	177	-31.9	64	0	0	0	0	109.9
771	S	32.4	Very low	32.5	Very low	98 Å²	98	110.2 Å²	110.2	69%	0.685	74%	0.739	S	S	*	*			trans	73.2	168.9	164.2	-41.5	0	0	0	0	116.1
772	T	30.5	Very low	33.4	Very low	124 Å²	124	111.4 Å²	111.4	76%	0.761	74%	0.741	S	S	*	*			cis	-153.5	154.3	8.1	-30.8	0	0	0	0	113
773	S	29.5	Very low	33.8	Very low	103 Å²	103	110.7 Å²	110.7	72%	0.72	74%	0.742	S	S	*	*			trans	39.9	121.9	157.5	56.6	0	0	0	0	123.9
774	S	27.5	Very low	33.9	Very low	106 Å²	106	112.6 Å²	112.6	74%	0.741	74%	0.744	S	S	*	*			trans	71.8	115.6	146.7	56.5	0	0	0	0	123.2
775	S	28.1	Very low	33.6	Very low	113 Å²	113	113.5 Å²	113.5	79%	0.79	75%	0.746	S	S	*	*			trans	51.4	137.4	143.5	54.7	0	0	0	0	121.7
776	S	27.5	Very low	33.3	Very low	102 Å²	102	110.2 Å²	110.2	71%	0.713	74%	0.74	S	S	*	*			cis	-166.3	158.3	-5.7	52.3	0	0	0	0	112.3
777	S	33.3	Very low	33.2	Very low	101 Å²	101	113 Å²	113	71%	0.706	74%	0.74	S	S	*	*			trans	56.5	127	150.2	59.1	0	0	0	0	121.2
778	T	29	Very low	32.8	Very low	124 Å²	124	115.8 Å²	115.8	76%	0.761	74%	0.738	S	S	*	*			cis	-178.5	135	-21.7	8	0	0	0	0	105.6
779	S	32.2	Very low	32.4	Very low	103 Å²	103	117 Å²	117	72%	0.72	73%	0.734	S	S	*	*			cis	58.2	162.1	28.4	-69.3	0	0	0	0	114.4
780	P	44.1	Very low	32.3	Very low	118 Å²	118	119.1 Å²	119.1	77%	0.766	74%	0.744	S	S	*	*			cis	-112.8	177.6	-5.3	4.5	21.6	0	0	0	112.2
781	V	27.3	Very low	32.4	Very low	125 Å²	125	121.4 Å²	121.4	76%	0.758	76%	0.757	S	S	*	*			cis	-164.5	164.4	-22.4	123.1	0	0	0	0	107.7
782	V	51.5	Low	32.1	Very low	135 Å²	135	119.7 Å²	119.7	82%	0.818	75%	0.754	S	S	*	*			trans	-124.9	141.1	166.8	-68.3	0	0	0	0	111.5
783	S	38.8	Very low	31.9	Very low	129 Å²	129	122.4 Å²	122.4	90%	0.902	76%	0.764	S	S	*	*			trans	-175.5	172.6	158.5	-85.7	0	0	0	0	111.4
784	S	36.6	Very low	31.7	Very low	111 Å²	111	123.2 Å²	123.2	78%	0.776	77%	0.769	S	S	*	*			trans	-146.1	172.8	-160.8	-166	0	0	0	0	114.4
785	M	31.1	Very low	31.6	Very low	169 Å²	169	126.4 Å²	126.4	83%	0.833	78%	0.777	S	S	*	*			trans	71.2	101.4	165.1	-71.6	-66.1	-177	0	0	121.5
786	A	32.2	Very low	31.4	Very low	79 Å²	79	124.7 Å²	124.7	65%	0.653	77%	0.769	S	S	*	*				63.4	132	113.5	0	0	0	0	0	124.7
787	H	29.6	Very low	31.5	Very low	171 Å²	171	124.9 Å²	124.9	79%	0.792	77%	0.771	S	S	*	*			trans	73.3	110.1	136.3	-104.8	-92.7	0	0	0	122.7
788	L	27.1	Very low	31.3	Very low	128 Å²	128	130.8 Å²	130.8	67%	0.67	78%	0.778	S	S	*	*				168.3	159.3	95.5	-96.4	173.2	0	0	0	115.8
789	H	26.3	Very low	31.2	Very low	158 Å²	158	130 Å²	130	73%	0.731	77%	0.773	S	S	*	*			trans	74.2	104.4	158.3	-62.1	153.1	0	0	0	122.7
790	T	30.9	Very low	31.1	Very low	123 Å²	123	130 Å²	130	76%	0.755	78%	0.779	S	S	*	*				-23.9	157.7	129.8	31.9	0	0	0	0	116.6
791	P	34.2	Very low	30.3	Very low	129 Å²	129	130.4 Å²	130.4	84%	0.838	77%	0.774	S	S	*	*			cis	-98.5	177.9	40.3	-4	25.8	0	0	0	114.4
792	G	25.8	Very low	30.2	Very low	62 Å²	62	129.6 Å²	129.6	64%	0.639	77%	0.773	S	S	*	*			cis	117.5	146.7	7.1	0	0	0	0	0	112.6
793	L	27.1	Very low	29.2	Very low	182 Å²	182	129.5 Å²	129.5	95%	0.953	76%	0.763	S	S	*	*			trans	91	134.7	-176.3	-56.2	175.2	0	0	0	117.8
794	S	24.8	Very low	28.7	Very low	120 Å²	120	134 Å²	134	84%	0.839	76%	0.762	S	S	*	*			trans	-87.3	163.2	175.3	-29.6	0	0	0	0	112.2
795	L	25.9	Very low	28.4	Very low	173 Å²	173	131.9 Å²	131.9	91%	0.906	76%	0.758	S	S	*	*				-161.7	156.9	121.7	-160.7	50	0	0	0	113.8
796	A	24.8	Very low	28.2	Very low	76 Å²	76	132.9 Å²	132.9	63%	0.628	76%	0.76	S	S	*	*			trans	-57.1	153.2	-168.4	0	0	0	0	0	120.3
797	S	29.1	Very low	28.2	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	77%	0.767	S	S	*	*				27.4	139.7	125	-43.2	0	0	0	0	122
798	R	29.6	Very low	28.1	Very low	226 Å²	226	136.6 Å²	136.6	85%	0.853	77%	0.77	S	S	*	*				-175.8	112.7	118.1	-98.9	164.1	179	-75	-0.7	112
799	T	27.1	Very low	28.2	Very low	108 Å²	108	133.6 Å²	133.6	66%	0.663	77%	0.771	S	S	*	*				76.5	111.9	87.1	60.6	0	0	0	0	116.9
800	A	30.2	Very low	28.1	Very low	102 Å²	102	132.2 Å²	132.2	84%	0.843	78%	0.777	S	S	*	*			trans	174.9	96.8	149.4	0	0	0	0	0	107.1
801	D	26	Very low	28.1	Very low	126 Å²	126	134.8 Å²	134.8	67%	0.674	79%	0.786	S	S	*	*			cis	77.4	102.7	27.2	-161.5	-5.5	0	0	0	115.1	H803	D801-H803 IonicContact OD1-CE1 3.83Å; D801-H803 IonicContact OD1-ND1 3.99Å
802	C	24.8	Very low	28	Very low	108 Å²	108	131.9 Å²	131.9	73%	0.73	77%	0.772	S	S	*	*				-175.5	128.4	129.3	-94.7	0	0	0	0	114.7
803	H	31.2	Very low	28.4	Very low	133 Å²	133	137.1 Å²	137.1	62%	0.616	78%	0.78	S	S	*	*			trans	27.7	143.9	131.5	-48.7	86.2	0	0	0	121.6	D801	D801-H803 IonicContact OD1-CE1 3.83Å; D801-H803 IonicContact OD1-ND1 3.99Å
804	Y	29.2	Very low	28.5	Very low	224 Å²	224	133.9 Å²	133.9	88%	0.878	77%	0.768	S	S	*	*			cis	-136.4	-174.2	8.1	-74.6	-86.8	0	0	0	109.7
805	G	30	Very low	28.7	Very low	66 Å²	66	134.5 Å²	134.5	68%	0.68	76%	0.758	S	S	*	*			cis	-158.1	-170.8	2.4	0	0	0	0	0	108.3
806	Q	26.6	Very low	29	Very low	190 Å²	190	135.1 Å²	135.1	89%	0.888	75%	0.748	S	S	*	*			cis	67.8	124.7	19.4	-94.1	177.4	16.4	0	0	115.5
807	V	32.7	Very low	29.2	Very low	131 Å²	131	138.9 Å²	138.9	79%	0.794	75%	0.752	S	S	*	*				-144.5	157.6	55.8	178.8	0	0	0	0	115
808	K	27.5	Very low	29.2	Very low	197 Å²	197	139.4 Å²	139.4	86%	0.857	75%	0.751	S	S	*	*			trans	-32.3	165.3	155.6	-72.3	154.8	164.9	174.7	0	117
809	G	28.6	Very low	29.3	Very low	66 Å²	66	134.4 Å²	134.4	68%	0.68	75%	0.745	S	S	*	*			cis	157.1	174	-5.3	0	0	0	0	0	114
810	C	25.2	Very low	29.2	Very low	128 Å²	128	136.9 Å²	136.9	87%	0.865	75%	0.752	S	S	*	*			trans	58.8	93.3	158	-61.1	0	0	0	0	122.2
811	L	29.2	Very low	29.1	Very low	178 Å²	178	137.4 Å²	137.4	93%	0.932	74%	0.744	S	S	*	*			trans	-147.8	153.2	141.5	-74.5	179.4	0	0	0	107.8
812	A	32.6	Very low	29.2	Very low	68 Å²	68	137.2 Å²	137.2	56%	0.562	75%	0.747	S	S	*	*			cis	-165.6	153.8	-23.3	0	0	0	0	0	110
813	Q	34.3	Very low	29.9	Very low	172 Å²	172	137.2 Å²	137.2	80%	0.804	75%	0.746	S	S	*	*			trans	58.8	144.3	160.5	-61.7	168.7	-85.7	0	0	117.9
814	T	28.8	Very low	29.6	Very low	114 Å²	114	135.4 Å²	135.4	70%	0.699	75%	0.749	S	S	*	*				51	143.9	59.7	30.9	0	0	0	0	114.5
815	Q	30.4	Very low	29.8	Very low	133 Å²	133	133.9 Å²	133.9	62%	0.621	75%	0.749	S	S	*	*			cis	-162.8	157.5	24.9	-133.5	175.2	44.1	0	0	111.7
816	R	32.2	Very low	29.7	Very low	186 Å²	186	141.6 Å²	141.6	70%	0.702	76%	0.758	S	S	*	*			trans	61	129.9	143.5	-77.9	166.1	-177.4	159.6	-9.5	122.9
817	H	29	Very low	30.5	Very low	154 Å²	154	136.8 Å²	136.8	71%	0.713	74%	0.743	S	S	*	*				82.4	138.4	127.3	-77.5	-146	0	0	0	118.7
818	V	27.5	Very low	30.1	Very low	118 Å²	118	139 Å²	139	72%	0.715	74%	0.744	S	S	*	*			cis	73.6	101.6	31.1	-174.6	0	0	0	0	114.5
819	T	32.7	Very low	30.2	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	74%	0.742	S	S	*	*			trans	167.9	110.1	147.4	-73.7	0	0	0	0	105.7
820	M	25.2	Very low	30.1	Very low	161 Å²	161	135 Å²	135	79%	0.793	74%	0.742	S	S	*	*				70.1	154.6	58.4	-68.9	-71.7	-77.8	0	0	114.6
821	V	28.5	Very low	30.3	Very low	112 Å²	112	137.8 Å²	137.8	68%	0.679	74%	0.744	S	S	*	*			trans	80.1	109.7	173.3	-173	0	0	0	0	112.5
822	T	27	Very low	30.2	Very low	122 Å²	122	132.5 Å²	132.5	75%	0.748	73%	0.733	S	S	*	*			cis	61.5	162.8	48.3	79.8	0	0	0	0	113
823	P	39.5	Very low	30.2	Very low	108 Å²	108	138.8 Å²	138.8	70%	0.701	75%	0.747	S	S	*	*			cis	-126.1	-167.9	-1.1	42.9	-26.5	0	0	0	114.3
824	S	25.6	Very low	29.9	Very low	96 Å²	96	137.7 Å²	137.7	67%	0.671	74%	0.744	S	S	*	*			trans	-3.1	145.8	154.8	-50.7	0	0	0	0	120.1
825	H	32.8	Very low	30.1	Very low	191 Å²	191	140.2 Å²	140.2	88%	0.884	75%	0.748	S	S	*	*				-170.3	154.4	105.5	-101.7	-77.2	0	0	0	114.7
826	R	27.7	Very low	31.1	Very low	229 Å²	229	138.8 Å²	138.8	86%	0.864	75%	0.75	S	S	*	*			trans	-72.6	-179.8	163.2	-111.7	-175.4	157.4	161.6	-7.5	110.6
827	P	43.3	Very low	31	Very low	88 Å²	88	138.2 Å²	138.2	57%	0.571	76%	0.755	S	S	*	*			cis	-135.5	-160.8	-29.8	39.7	-21	0	0	0	111.9
828	Q	25.4	Very low	31.7	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	76%	0.762	S	S	*	*			trans	67.6	145.1	160	-68	162.5	-17.9	0	0	116.6
829	A	28.1	Very low	31.8	Very low	97 Å²	97	136.7 Å²	136.7	80%	0.802	76%	0.764	S	S	*	*			cis	103.5	141	13	0	0	0	0	0	116.4
830	A	28.3	Very low	32.7	Very low	83 Å²	83	135.9 Å²	135.9	69%	0.686	76%	0.76	S	S	*	*			trans	88.7	117.9	167.3	0	0	0	0	0	120.6
831	M	28.9	Very low	32.9	Very low	186 Å²	186	133.5 Å²	133.5	92%	0.916	76%	0.76	S	S	*	*			trans	60.6	141.7	147.3	-60.5	-175.3	-83.2	0	0	120.3
832	G	26.8	Very low	33.6	Very low	67 Å²	67	134 Å²	134	69%	0.691	77%	0.765	S	S	*	*			cis	144.9	176.1	-6.3	0	0	0	0	0	113.3
833	K	31.7	Very low	34.8	Very low	199 Å²	199	133.4 Å²	133.4	87%	0.865	76%	0.763	S	S	*	*			trans	71.4	148.5	165.8	-84.6	174	-178.2	176.1	0	116
834	M	28.9	Very low	34.2	Very low	150 Å²	150	136.9 Å²	136.9	74%	0.739	77%	0.767	S	S	*	*			cis	-147.3	147.2	11.8	-75.6	-155.5	-78.7	0	0	115.3
835	H	32.5	Very low	34.4	Very low	166 Å²	166	140.5 Å²	140.5	77%	0.769	77%	0.774	S	S	*	*			trans	64.4	160.8	140.6	-77.5	-120.3	0	0	0	121.9
836	P	51.1	Low	34.2	Very low	103 Å²	103	143 Å²	143	67%	0.669	78%	0.775	S	S	*	*			cis	-140.2	167.6	-36	38.9	-21.6	0	0	0	117.4
837	H	30.1	Very low	34.6	Very low	175 Å²	175	137.1 Å²	137.1	81%	0.81	77%	0.767	S	S	*	*			trans	-14.7	155.2	148	-59.7	-61.5	0	0	0	120
838	P	44.9	Very low	34.5	Very low	132 Å²	132	138.4 Å²	138.4	86%	0.857	78%	0.775	S	S	*	*				-141.2	-154.8	53.7	42.5	-22	0	0	0	117.9
839	S	29.2	Very low	35.8	Very low	108 Å²	108	136 Å²	136	76%	0.755	78%	0.775	S	S	*	*			trans	-137.7	-150.6	-153.1	-162.1	0	0	0	0	112.6
840	P	51.6	Low	35.9	Very low	102 Å²	102	138.4 Å²	138.4	66%	0.662	78%	0.78	S	S	*	*				-130.2	-177.6	-102.3	43.5	-28	0	0	0	117.9
841	S	28.4	Very low	35.9	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	78%	0.781	S	S	*	*			trans	74.8	169.3	159.9	-56.9	0	0	0	0	116.9
842	P	44.6	Very low	35.8	Very low	121 Å²	121	135 Å²	135	79%	0.786	78%	0.775	S	S	*	*			cis	-130.1	-177.2	4.4	42.5	-25	0	0	0	116.5
843	P	50.7	Low	36.9	Very low	110 Å²	110	136.6 Å²	136.6	71%	0.714	77%	0.773	S	S	*	*			trans	-119.9	165.2	-171.3	41.1	-31.1	0	0	0	116.7
844	K	27	Very low	36.7	Very low	181 Å²	181	134.1 Å²	134.1	79%	0.787	77%	0.768	S	S	*	*			trans	153.8	149.7	134	-90.2	171.9	179.4	174.3	0	117.3
845	Q	30.1	Very low	36.8	Very low	172 Å²	172	133.9 Å²	133.9	80%	0.804	77%	0.769	S	S	*	*			trans	60.1	129.8	145.4	-71.1	174	4.4	0	0	122.7
846	R	29.4	Very low	37.8	Very low	244 Å²	244	130.7 Å²	130.7	92%	0.921	76%	0.763	S	S	*	*				-163.1	176.5	121.3	-111.8	-162.9	163.9	149.2	1.2	112.8
847	P	36.3	Very low	37.5	Very low	106 Å²	106	131.1 Å²	131.1	69%	0.688	77%	0.766	S	S	*	*			trans	-127.9	-162.2	-130.7	49.8	-30.9	0	0	0	113.7
848	P	39.5	Very low	37.6	Very low	114 Å²	114	130.8 Å²	130.8	74%	0.74	76%	0.764	S	S	*	*			trans	-85.9	171.6	-165.1	37.3	-35.9	0	0	0	114.7
849	P	54.3	Low	37.1	Very low	129 Å²	129	131.6 Å²	131.6	84%	0.838	76%	0.757	S	S	*	*			trans	-83.1	148.6	-169.9	32.9	-36.9	0	0	0	114.7
850	T	29	Very low	37.2	Very low	146 Å²	146	135 Å²	135	90%	0.896	76%	0.758	S	S	*	*			trans	-134.8	160.8	165.8	54.6	0	0	0	0	109.9
851	A	27.9	Very low	36.1	Very low	85 Å²	85	133.7 Å²	133.7	70%	0.702	76%	0.762	S	S	*	*			trans	-112.6	165.6	-171.2	0	0	0	0	0	112.9
852	S	27.7	Very low	36.2	Very low	113 Å²	113	137.8 Å²	137.8	79%	0.79	77%	0.767	S	S	*	*			trans	72.5	169.3	156.3	-63	0	0	0	0	116.6
853	P	48.9	Very low	35.5	Very low	100 Å²	100	138.6 Å²	138.6	65%	0.649	77%	0.769	S	S	*	*			cis	-140.9	-172.6	-41.2	35.3	-16.3	0	0	0	113.9
854	L	27.9	Very low	34.5	Very low	147 Å²	147	139.1 Å²	139.1	77%	0.77	78%	0.775	S	S	*	*			trans	70.6	159.2	160.6	-51.8	176.6	0	0	0	116.5
855	L	32	Very low	35.6	Very low	146 Å²	146	136.2 Å²	136.2	76%	0.764	77%	0.774	S	S	*	*			cis	-158.6	168.8	-22.4	-102.9	171.6	0	0	0	108.1
856	P	53	Low	35.5	Very low	99 Å²	99	132.8 Å²	132.8	64%	0.643	78%	0.775	S	S	*	*			trans	-88.2	-165.1	178.6	38.9	-35.6	0	0	0	112.5
857	P	44.8	Very low	35.4	Very low	111 Å²	111	124.4 Å²	124.4	72%	0.721	77%	0.765	S	S	*	*				-152.8	139.4	109.4	37.6	-19.9	0	0	0	118.7
858	H	32.1	Very low	35.3	Very low	168 Å²	168	126.8 Å²	126.8	78%	0.778	77%	0.77	S	S	*	*			trans	66.4	147.3	135.3	-82.3	-119.3	0	0	0	120.8
859	Q	34.8	Very low	34.9	Very low	150 Å²	150	129.7 Å²	129.7	70%	0.701	78%	0.779	S	S	*	*				-142.9	142.4	56.7	-57.2	-168	21.7	0	0	117.7
860	K	31.1	Very low	33.7	Very low	180 Å²	180	126.8 Å²	126.8	78%	0.783	77%	0.772	S	S	*	*			trans	61.6	141.4	146.4	-63.3	158.8	-177.5	162.4	0	118.6
861	G	29.6	Very low	33.7	Very low	73 Å²	73	126.3 Å²	126.3	75%	0.753	77%	0.769	S	S	*	*			cis	-171.3	159	-2	0	0	0	0	0	113.7
862	F	29.9	Very low	33.8	Very low	199 Å²	199	130.3 Å²	130.3	87%	0.873	78%	0.778	S	S	*	*			trans	-59	151.5	-168.8	-67.8	-102.2	0	0	0	118
863	T	29.7	Very low	33.8	Very low	137 Å²	137	128.7 Å²	128.7	84%	0.84	78%	0.779	S	S	*	*				179.2	164	109.7	29.2	0	0	0	0	113.8
864	C	29	Very low	32.8	Very low	122 Å²	122	127.5 Å²	127.5	82%	0.824	78%	0.784	S	S	*	*			trans	-147.3	-168	178.2	-42.3	0	0	0	0	107.7
865	P	50.4	Low	32.8	Very low	119 Å²	119	127.2 Å²	127.2	77%	0.773	79%	0.789	S	S	*	*			cis	-140.4	-168.5	-17	41	-21.6	0	0	0	115.3
866	A	27.3	Very low	32.7	Very low	100 Å²	100	124.9 Å²	124.9	83%	0.826	78%	0.784	S	S	*	*			trans	80.3	154.3	140.8	0	0	0	0	0	124.3
867	G	29.2	Very low	31.6	Very low	69 Å²	69	129 Å²	129	71%	0.711	79%	0.792	S	S	*	*			trans	129.1	127.4	174.5	0	0	0	0	0	114
868	I	33.1	Very low	30.9	Very low	155 Å²	155	130.1 Å²	130.1	80%	0.795	80%	0.797	S	S	*	*			cis	116.2	133.1	-6.8	-56.9	173.2	0	0	0	116.3
869	L	31.1	Very low	30.7	Very low	176 Å²	176	126.2 Å²	126.2	92%	0.921	79%	0.794	S	S	*	*			trans	69.3	154.4	179.3	-108.8	64.2	0	0	0	116.9
870	G	29.7	Very low	30.6	Very low	67 Å²	67	125.1 Å²	125.1	69%	0.691	80%	0.797	S	S	*	*			cis	-152.3	-158.2	4.8	0	0	0	0	0	114.8
871	T	28.8	Very low	30.6	Very low	136 Å²	136	125.3 Å²	125.3	83%	0.834	80%	0.798	S	S	*	*			trans	-124.1	-175.7	-159	53.6	0	0	0	0	116.1
872	L	30.2	Very low	31.6	Very low	170 Å²	170	126.4 Å²	126.4	89%	0.89	79%	0.792	S	S	*	*			trans	88.8	147	-179.1	-52.2	162.9	0	0	0	113.3
873	G	27.9	Very low	31.8	Very low	79 Å²	79	122.4 Å²	122.4	81%	0.814	79%	0.788	S	S	*	*			cis	101.9	126.5	21.3	0	0	0	0	0	109.5
874	G	27.1	Very low	31.8	Very low	74 Å²	74	119.2 Å²	119.2	76%	0.763	78%	0.783	S	S	*	*			cis	-177.1	-167.6	0.4	0	0	0	0	0	110.7
875	V	28.1	Very low	32	Very low	142 Å²	142	120.5 Å²	120.5	86%	0.861	78%	0.78	S	S	*	*			trans	-22.6	134.6	173.2	-72.2	0	0	0	0	117.5
876	S	29.4	Very low	30.9	Very low	96 Å²	96	119.8 Å²	119.8	67%	0.671	78%	0.778	S	S	*	*				179.2	159.1	84	-72.2	0	0	0	0	114.9
877	K	30.7	Very low	31.1	Very low	186 Å²	186	120.9 Å²	120.9	81%	0.809	78%	0.779	S	S	*	*			trans	16.3	149.7	132.4	-43.5	170.7	-176.5	169.3	0	119.1
878	T	30	Very low	31.3	Very low	135 Å²	135	122.5 Å²	122.5	83%	0.828	78%	0.78	S	S	*	*			cis	-162.9	172.7	26.6	-23.3	0	0	0	0	113.3
879	A	28.2	Very low	31.2	Very low	86 Å²	86	122.9 Å²	122.9	71%	0.711	78%	0.784	S	S	*	*			trans	-61.1	166.1	163.8	0	0	0	0	0	113.4
880	V	32.6	Very low	31.3	Very low	127 Å²	127	118.4 Å²	118.4	77%	0.77	78%	0.78	S	S	*	*				-174	133	82.1	159.3	0	0	0	0	106.7
881	K	31.4	Very low	31.3	Very low	184 Å²	184	119.1 Å²	119.1	80%	0.8	79%	0.787	S	S	*	*				59	163.7	83.6	-113	-166.3	174.3	-164	0	115.1
882	P	50.4	Low	31.6	Very low	96 Å²	96	116.2 Å²	116.2	62%	0.623	78%	0.784	S	S	*	*			cis	-140.5	-169.2	-11.8	42.3	-23	0	0	0	116.6
883	S	33.8	Very low	31.6	Very low	114 Å²	114	112.6 Å²	112.6	80%	0.797	78%	0.779	S	S	*	*			trans	76.1	149.9	154.6	-56.2	0	0	0	0	119.2
884	G	30	Very low	31.8	Very low	70 Å²	70	116.1 Å²	116.1	72%	0.722	78%	0.778	S	S	*	*			cis	-175.1	-173.9	-9.8	0	0	0	0	0	109.7
885	I	31.8	Very low	31.7	Very low	149 Å²	149	118 Å²	118	76%	0.764	78%	0.779	S	S	*	*			cis	171.5	149.9	-18	-87.5	153.8	0	0	0	105.3
886	S	28.4	Very low	31.6	Very low	105 Å²	105	114.7 Å²	114.7	73%	0.734	77%	0.774	S	S	*	*			trans	104.8	129.9	173.9	-43.6	0	0	0	0	114.7
887	S	32	Very low	31.7	Very low	122 Å²	122	115.9 Å²	115.9	85%	0.853	78%	0.779	S	S	*	*			cis	87.9	137.7	30.3	-55.9	0	0	0	0	113.6
888	S	32.5	Very low	31.5	Very low	103 Å²	103	113.6 Å²	113.6	72%	0.72	78%	0.781	S	S	*	*			cis	-154.2	-170.7	22.2	63.3	0	0	0	0	115.7
889	N	31.3	Very low	31.4	Very low	164 Å²	164	115.4 Å²	115.4	88%	0.877	78%	0.78	S	S	*	*			trans	90.7	130.2	164	-67.3	12.3	0	0	0	120.7
890	G	32.5	Very low	32.9	Very low	82 Å²	82	116.3 Å²	116.3	85%	0.845	78%	0.779	S	S	*	*			trans	143.4	102	158.6	0	0	0	0	0	117.2
891	G	31	Very low	33.1	Very low	81 Å²	81	116.4 Å²	116.4	84%	0.835	78%	0.782	S	S	*	*			trans	73.7	156.3	168.9	0	0	0	0	0	116.5
892	G	34.1	Very low	32.9	Very low	76 Å²	76	112.5 Å²	112.5	78%	0.784	78%	0.778	S	S	*	*			cis	83.4	113.7	0.6	0	0	0	0	0	113.5
893	A	31.3	Very low	31.7	Very low	93 Å²	93	113.1 Å²	113.1	77%	0.769	78%	0.784	S	S	*	*			cis	-110.5	127.4	-2.7	0	0	0	0	0	109.8
894	L	30.3	Very low	31.2	Very low	154 Å²	154	113 Å²	113	81%	0.806	78%	0.784	S	S	*	*				60.6	128.9	81.5	-61	173	0	0	0	113.7
895	S	26.9	Very low	31.3	Very low	113 Å²	113	115.1 Å²	115.1	79%	0.79	79%	0.787	S	S	*	*			cis	-167.8	151	-13	-127.8	0	0	0	0	112.1
896	G	25.7	Very low	31.3	Very low	72 Å²	72	113.5 Å²	113.5	74%	0.742	79%	0.786	S	S	*	*			trans	92.1	170.7	150.2	0	0	0	0	0	118.3
897	P	31.1	Very low	30.9	Very low	121 Å²	121	113.5 Å²	113.5	79%	0.786	79%	0.786	S	S	*	*			trans	-124.5	-167.9	-164.3	41.4	-24.9	0	0	0	112.5
898	V	26.7	Very low	30.6	Very low	139 Å²	139	114 Å²	114	84%	0.842	78%	0.784	S	S	*	*				-173.2	150.2	116.1	143.7	0	0	0	0	110.3
899	Q	28.3	Very low	30.6	Very low	173 Å²	173	117.7 Å²	117.7	81%	0.808	79%	0.79	S	S	*	*			trans	-103	-169.6	178.8	-126.1	-163.5	-54.7	0	0	110.1
900	P	58.3	Low	31	Very low	105 Å²	105	114.7 Å²	114.7	68%	0.682	78%	0.78	S	S	*	*			trans	-75.8	176.6	-164.7	36.9	-40.8	0	0	0	113.2
901	P	37.7	Very low	30.6	Very low	129 Å²	129	121.6 Å²	121.6	84%	0.838	78%	0.78	S	S	*	*				-141.9	-174.6	106.1	41	-29	0	0	0	115.3
902	S	26.4	Very low	30.4	Very low	102 Å²	102	122.2 Å²	122.2	71%	0.713	77%	0.772	S	S	*	*			trans	-86.7	163.2	-172.9	-46.1	0	0	0	0	115
903	S	26.4	Very low	30.4	Very low	108 Å²	108	125 Å²	125	76%	0.755	77%	0.769	S	S	*	*			trans	69.7	156.6	142.7	53.3	0	0	0	0	121.5
904	S	23.1	Very low	30.8	Very low	113 Å²	113	125.2 Å²	125.2	79%	0.79	77%	0.765	S	S	*	*			trans	65.7	113.9	161.9	39.8	0	0	0	0	120.3
905	S	31	Very low	30.9	Very low	114 Å²	114	123.7 Å²	123.7	80%	0.797	76%	0.762	S	S	*	*			trans	-61.1	170.7	142	-30.8	0	0	0	0	110.8
906	P	32.3	Very low	31.2	Very low	115 Å²	115	122.2 Å²	122.2	75%	0.747	75%	0.752	S	S	*	*			cis	-141.8	-168.6	13.4	42.3	-22.4	0	0	0	115.7
907	S	21	Very low	31.5	Very low	105 Å²	105	126 Å²	126	73%	0.734	75%	0.75	S	S	*	*			trans	65.4	161.5	155.4	-104.8	0	0	0	0	119.1
908	T	24.5	Very low	31.7	Very low	131 Å²	131	127.9 Å²	127.9	80%	0.804	75%	0.748	S	S	*	*			cis	-160.7	173.7	-36.6	14	0	0	0	0	108.6
909	Q	32.4	Very low	31.7	Very low	181 Å²	181	127.4 Å²	127.4	85%	0.846	75%	0.745	S	S	*	*			trans	-57.8	177.2	172.6	-95.9	-173.1	0	0	0	115.4
910	P	39.5	Very low	32.4	Very low	102 Å²	102	123.7 Å²	123.7	66%	0.662	74%	0.736	S	S	*	*			cis	-157.3	176.6	35.8	45.5	-23.5	0	0	0	122.4
911	R	24.1	Very low	31.1	Very low	226 Å²	226	126.6 Å²	126.6	85%	0.853	74%	0.74	S	S	*	*			trans	69.4	151.8	141.9	-90.4	176.9	178.9	-178.4	-2.6	121.2
912	S	27.6	Very low	30.6	Very low	95 Å²	95	124.1 Å²	124.1	66%	0.664	73%	0.726	S	S	*	*			cis	-127	-142.7	-3.5	-72.4	0	0	0	0	109.6
913	N	32.9	Very low	30.8	Very low	135 Å²	135	128.4 Å²	128.4	72%	0.722	73%	0.732	S	S	*	*			cis	-164	178.1	0.7	-151.6	75.7	0	0	0	111.4
914	S	39.7	Very low	30.6	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	73%	0.734	S	S	*	*			trans	74.1	157.4	156.4	-58.3	0	0	0	0	117.3
915	T	33.7	Very low	31.3	Very low	121 Å²	121	131.7 Å²	131.7	74%	0.742	73%	0.733	S	S	*	*			cis	-160.7	177.8	-16.7	-94.4	0	0	0	0	109.6
916	S	33.7	Very low	31.8	Very low	83 Å²	83	131.7 Å²	131.7	58%	0.58	73%	0.73	S	S	*	*			trans	-49.4	140.4	176.4	56.6	0	0	0	0	115.5
917	H	30.5	Very low	31.6	Very low	151 Å²	151	131.6 Å²	131.6	70%	0.699	73%	0.732	S	S	*	*			cis	-142.6	163.9	14.3	-61.9	-96.6	0	0	0	108.7
918	H	35.3	Very low	32	Very low	160 Å²	160	132.1 Å²	132.1	74%	0.741	73%	0.733	S	S	*	*			cis	-158.2	-175.9	-12.5	-106.5	-26	0	0	0	106.4
919	V	27.7	Very low	32.3	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	73%	0.733	S	S	*	*			cis	-138.9	168.8	14	92.4	0	0	0	0	108
920	P	42.4	Very low	32.3	Very low	95 Å²	95	126.7 Å²	126.7	62%	0.617	72%	0.724	S	S	*	*			trans	-104.2	175.3	-146.1	39.2	-37.4	0	0	0	118
921	Q	30.2	Very low	31.5	Very low	167 Å²	167	127.1 Å²	127.1	78%	0.78	73%	0.729	S	S	*	*			trans	88	129.1	168.9	-47.5	-63.5	-8.8	0	0	116.3
922	S	29.2	Very low	31.6	Very low	76 Å²	76	121 Å²	121	53%	0.531	72%	0.721	S	S	.	*			cis	-166.4	147	-18.3	-124.6	0	0	0	0	114.8
923	F	29	Very low	32.2	Very low	192 Å²	192	121.9 Å²	121.9	84%	0.842	73%	0.727	S	S	*	*			trans	57.8	150	157.9	-62.5	-66.7	0	0	0	124.1
924	H	22.4	Very low	32.1	Very low	174 Å²	174	120.7 Å²	120.7	81%	0.806	73%	0.727	S	S	*	*			trans	-108.1	-161.9	167	-58.7	-144.6	0	0	0	108.3
925	P	39	Very low	32.1	Very low	117 Å²	117	121.5 Å²	121.5	76%	0.76	73%	0.733	S	S	*	*			cis	-120.8	-108.8	-23.8	18.9	6.1	0	0	0	115.7
926	P	39.9	Very low	32.4	Very low	114 Å²	114	120.6 Å²	120.6	74%	0.74	73%	0.729	S	S	*	*				-119.1	-168	-111.5	40.8	-26.2	0	0	0	116.4
927	S	29	Very low	31.9	Very low	113 Å²	113	122.2 Å²	122.2	79%	0.79	74%	0.735	S	S	*	*			trans	-42.9	153.2	171.7	-40.9	0	0	0	0	115.1
928	P	30	Very low	31.7	Very low	116 Å²	116	119.4 Å²	119.4	75%	0.753	73%	0.733	S	S	*	*				-141.4	169.6	92.6	41.2	-30.2	0	0	0	114.8
929	A	30.5	Very low	31.3	Very low	96 Å²	96	120.6 Å²	120.6	79%	0.793	74%	0.739	S	S	*	*			trans	-85.4	142.5	149.5	0	0	0	0	0	108.2
930	P	31.9	Very low	31.5	Very low	102 Å²	102	120.3 Å²	120.3	66%	0.662	74%	0.742	S	S	*	*				-147	176.9	108.3	40	-27.1	0	0	0	113.4
931	S	22.7	Very low	30.8	Very low	110 Å²	110	125.4 Å²	125.4	77%	0.769	76%	0.755	S	S	*	*			trans	65.4	156.2	152.9	69.3	0	0	0	0	117.6
932	S	25.8	Very low	31.4	Very low	97 Å²	97	122.2 Å²	122.2	68%	0.678	75%	0.748	S	S	*	*			cis	-166.7	152.2	-27.1	46.3	0	0	0	0	107.9
933	S	40.6	Very low	31.3	Very low	115 Å²	115	126.8 Å²	126.8	80%	0.804	76%	0.761	S	S	*	*			trans	-55.9	140.4	155.2	-52.1	0	0	0	0	108.8
934	P	31.8	Very low	31.3	Very low	109 Å²	109	121.6 Å²	121.6	71%	0.708	75%	0.749	S	S	*	*				-141.6	132.3	98.4	34.9	-20.8	0	0	0	114.3
935	S	38.5	Very low	31.6	Very low	115 Å²	115	121.6 Å²	121.6	80%	0.804	75%	0.749	S	S	*	*			trans	-61.3	145.6	141.9	-36.3	0	0	0	0	108
936	P	39.3	Very low	31.2	Very low	102 Å²	102	124.9 Å²	124.9	66%	0.662	75%	0.753	S	S	*	*				-152.5	-179.8	109.4	36.1	-17.4	0	0	0	115.2
937	T	24.5	Very low	30.6	Very low	117 Å²	117	126.1 Å²	126.1	72%	0.718	75%	0.749	S	S	*	*			trans	49.1	108.8	150.9	48.2	0	0	0	0	119
938	S	26.3	Very low	30.7	Very low	92 Å²	92	127.4 Å²	127.4	64%	0.643	74%	0.742	S	S	*	*			cis	89.1	151.7	44.6	76.9	0	0	0	0	115.6
939	Q	27.3	Very low	30.8	Very low	185 Å²	185	130.3 Å²	130.3	86%	0.864	75%	0.746	S	S	*	*			trans	81.8	106.2	167.2	-55.6	-176.4	22.4	0	0	117.9
940	S	30.4	Very low	31	Very low	123 Å²	123	130 Å²	130	86%	0.86	74%	0.744	S	S	*	*				-148.5	143.4	112.4	38.1	0	0	0	0	111.3
941	K	28.5	Very low	31	Very low	202 Å²	202	132.1 Å²	132.1	88%	0.878	75%	0.749	S	S	*	*			trans	-122.1	-175.2	172.5	-113.4	-175.3	179	-179	0	105.7
942	P	42.7	Very low	31.4	Very low	100 Å²	100	135 Å²	135	65%	0.649	75%	0.748	S	S	*	*			cis	-125.2	-158.8	7.5	39	-17.2	0	0	0	111.2
943	Q	26.5	Very low	31.8	Very low	172 Å²	172	136.5 Å²	136.5	80%	0.804	75%	0.747	S	S	*	*			cis	-152.2	169	8	-155.8	144.5	-61	0	0	113.7
944	S	28.9	Very low	31.7	Very low	82 Å²	82	136 Å²	136	57%	0.573	74%	0.739	S	S	*	*			trans	-61.5	172.2	175.4	47.5	0	0	0	0	117
945	H	28.8	Very low	32.2	Very low	174 Å²	174	137 Å²	137	81%	0.806	75%	0.746	S	S	*	*			cis	-169.1	150.4	-12.9	-102.2	-47.7	0	0	0	108.9
946	H	30.5	Very low	31.9	Very low	186 Å²	186	138.3 Å²	138.3	86%	0.861	74%	0.741	S	S	*	*			trans	171.6	162.3	139.2	-90.4	-68.1	0	0	0	108.2
947	H	28.7	Very low	31.6	Very low	140 Å²	140	141.3 Å²	141.3	65%	0.648	75%	0.746	S	S	*	*			cis	-168.4	122.5	-41.3	175.4	84.6	0	0	0	108.6
948	H	31.3	Very low	32	Very low	140 Å²	140	139.4 Å²	139.4	65%	0.648	74%	0.743	S	S	*	*			trans	81.6	127.3	155.9	-82	-163.9	0	0	0	125.3
949	Q	31.2	Very low	32.3	Very low	178 Å²	178	140.5 Å²	140.5	83%	0.832	75%	0.746	S	S	*	*			trans	98.4	159.1	133	-79.8	-171.4	35.5	0	0	123.2
950	A	33.7	Very low	32.5	Very low	90 Å²	90	139 Å²	139	74%	0.744	74%	0.743	S	S	*	*			trans	84	54.2	169.7	0	0	0	0	0	121.2
951	N	32	Very low	32.5	Very low	146 Å²	146	138.2 Å²	138.2	78%	0.781	73%	0.733	S	S	*	*				46.6	121.7	120.1	-75.9	-10.2	0	0	0	124
952	F	32.2	Very low	32.5	Very low	170 Å²	170	138.3 Å²	138.3	75%	0.746	73%	0.733	S	S	*	*			trans	74.4	119.1	150.9	-74.9	-109.6	0	0	0	119.3
953	I	34.7	Very low	31.7	Very low	128 Å²	128	137.3 Å²	137.3	66%	0.656	73%	0.729	S	S	*	*			cis	86.1	122	50	-70.1	163.5	0	0	0	111.2
954	T	37.4	Very low	31.8	Very low	104 Å²	104	134.6 Å²	134.6	64%	0.638	73%	0.729	S	S	*	*			cis	-160	165	-0.9	17.1	0	0	0	0	110.4
955	P	42	Very low	32	Very low	131 Å²	131	137.9 Å²	137.9	85%	0.851	74%	0.735	S	S	*	*			trans	-132.9	120.5	130.1	35.2	-25	0	0	0	113.8
956	M	32.4	Very low	32.1	Very low	143 Å²	143	133.7 Å²	133.7	70%	0.704	73%	0.725	S	S	*	*			trans	-154.2	146.9	176.7	-92.2	-178.8	51.4	0	0	108.6
957	Q	33.1	Very low	32.2	Very low	164 Å²	164	130.8 Å²	130.8	77%	0.766	73%	0.726	S	S	*	*			cis	-155	-166	-7.4	-136.1	171.8	34.3	0	0	111
958	A	33.5	Very low	32.5	Very low	78 Å²	78	131.2 Å²	131.2	65%	0.645	73%	0.733	S	S	*	*			trans	-72.5	-167.1	-175.1	0	0	0	0	0	113.6
959	T	31.7	Very low	32.3	Very low	115 Å²	115	129.5 Å²	129.5	71%	0.706	74%	0.737	S	S	*	*			cis	-171.8	155.3	31.2	-14.3	0	0	0	0	112.5
960	L	32.6	Very low	32.6	Very low	153 Å²	153	125.9 Å²	125.9	80%	0.801	73%	0.731	S	S	*	*			trans	66	164.1	153	-65	164.6	0	0	0	118
961	T	29.1	Very low	32.5	Very low	107 Å²	107	127.2 Å²	127.2	66%	0.656	73%	0.732	S	S	*	*			cis	-155.8	149.5	5.9	-7.7	0	0	0	0	113.1
962	K	28.6	Very low	32.3	Very low	203 Å²	203	128 Å²	128	88%	0.883	74%	0.735	S	S	*	*			trans	61.3	169.6	146	-72.8	174.9	69.5	175.2	0	121.2
963	S	27.5	Very low	32.2	Very low	80 Å²	80	127.4 Å²	127.4	56%	0.559	74%	0.737	S	S	*	*			trans	-135.8	175.6	-172.5	74.3	0	0	0	0	113.6	H965	S963-H965 VanDerWaalsContact CB-NE2 3.33Å; S963-H965 WeakPolarHBondContact CB-NE2 3.12Å; S963-H965 PolarHBondContact OG-NE2 3.3Å
964	S	29	Very low	31.9	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	74%	0.742	S	S	*	*			trans	-160.6	158.7	154.2	-81	0	0	0	0	112.1
965	H	32.4	Very low	31.4	Very low	151 Å²	151	132.1 Å²	132.1	70%	0.699	75%	0.751	S	S	*	*			trans	-154.6	163.9	-155	-58.5	-52.7	0	0	0	111	S963	S963-H965 VanDerWaalsContact CB-NE2 3.33Å; S963-H965 WeakPolarHBondContact CB-NE2 3.12Å; S963-H965 PolarHBondContact OG-NE2 3.3Å
966	S	31.6	Very low	31.4	Very low	85 Å²	85	131.7 Å²	131.7	59%	0.594	75%	0.746	S	S	*	*			cis	-171.7	153.4	-22.5	-88.9	0	0	0	0	108.1
967	S	32.3	Very low	31.2	Very low	125 Å²	125	131 Å²	131	87%	0.874	75%	0.752	S	S	*	*	S	Bend	trans	-138.3	124.4	173.1	-72.6	0	0	0	0	112.6
968	N	34.1	Very low	31	Very low	149 Å²	149	132.5 Å²	132.5	80%	0.797	75%	0.751	S	S	*	*	S	Bend	cis	-138.2	88.8	0	-160.3	22.8	0	0	0	112.5
969	S	28.1	Very low	31	Very low	105 Å²	105	133.9 Å²	133.9	73%	0.734	75%	0.753	S	S	*	*			trans	-126.8	117.7	154	48	0	0	0	0	108.3
970	S	37.5	Very low	30.9	Very low	101 Å²	101	134.3 Å²	134.3	71%	0.706	76%	0.758	S	S	*	*			trans	-73.5	152.5	174.7	-61.1	0	0	0	0	110.6
971	P	29.9	Very low	31	Very low	118 Å²	118	130.8 Å²	130.8	77%	0.766	75%	0.751	S	S	*	*			trans	-77.9	153.6	-171.4	32	-36.5	0	0	0	112.7
972	I	29.3	Very low	31.3	Very low	164 Å²	164	131.2 Å²	131.2	84%	0.841	76%	0.755	S	S	*	*			trans	-119.6	113.3	155.2	-67.5	179.6	0	0	0	107.9
973	I	28.7	Very low	31.7	Very low	156 Å²	156	127.6 Å²	127.6	80%	0.8	75%	0.751	S	S	*	*			trans	-97.1	120	151.8	-66.8	178.3	0	0	0	106.3
974	K	29.8	Very low	32.1	Very low	176 Å²	176	129.3 Å²	129.3	77%	0.765	76%	0.76	S	S	*	*			trans	12.9	111.7	146.3	-174.6	-175.7	-176.1	179.7	0	116
975	L	26.7	Very low	32.5	Very low	155 Å²	155	129.5 Å²	129.5	81%	0.812	76%	0.758	S	S	*	*				-166.5	159.5	115.8	-101.9	171.1	0	0	0	112.8
976	T	42.2	Very low	33.2	Very low	122 Å²	122	128.3 Å²	128.3	75%	0.748	76%	0.764	S	S	*	*			trans	-71.8	148.8	-175.8	-41.4	0	0	0	0	112.8
977	P	27.4	Very low	32.9	Very low	128 Å²	128	129.9 Å²	129.9	83%	0.831	78%	0.775	S	S	*	*			trans	-128.4	138.7	140.7	36.1	-26.8	0	0	0	114.2
978	R	28.6	Very low	32.6	Very low	197 Å²	197	129 Å²	129	74%	0.743	77%	0.769	S	S	*	*			trans	-147.5	143.1	167.8	174.1	-169.6	-179.2	-140.5	-0.5	106.6
979	P	33.8	Very low	32.3	Very low	106 Å²	106	127.3 Å²	127.3	69%	0.688	77%	0.768	S	S	*	*			cis	-120.2	-177.7	-21.1	39.3	-25	0	0	0	112
980	P	30.5	Very low	32.7	Very low	124 Å²	124	128.2 Å²	128.2	81%	0.805	77%	0.772	S	S	*	*			trans	-110.1	123.3	166.3	35.3	-25.7	0	0	0	113.6
981	A	34.9	Very low	32.1	Very low	80 Å²	80	128.1 Å²	128.1	66%	0.661	77%	0.771	S	S	*	*			trans	-176.1	160.7	159.7	0	0	0	0	0	109.2
982	P	35.2	Very low	32.4	Very low	115 Å²	115	125.8 Å²	125.8	75%	0.747	76%	0.756	S	S	*	*			cis	-123.8	173.7	-4.9	40.9	-27.9	0	0	0	114.1
983	T	35.9	Very low	32.1	Very low	128 Å²	128	123.3 Å²	123.3	79%	0.785	75%	0.754	S	S	*	*			trans	-140.4	122.7	157.7	45.3	0	0	0	0	110.8
984	P	36.5	Very low	32.1	Very low	115 Å²	115	121 Å²	121	75%	0.747	75%	0.751	S	S	*	*			trans	-105.6	-172.5	169.8	42.4	-33.9	0	0	0	110.9
985	P	38.1	Very low	31.9	Very low	120 Å²	120	117.7 Å²	117.7	78%	0.779	75%	0.75	S	S	*	*				-122.2	178.7	-74.5	37.1	-20.9	0	0	0	112.4
986	P	46.5	Very low	32.5	Very low	125 Å²	125	115.7 Å²	115.7	81%	0.812	75%	0.746	S	S	*	*			trans	-106	163.9	-164.1	39.9	-35.4	0	0	0	116.6
987	S	25	Very low	31.7	Very low	118 Å²	118	114.1 Å²	114.1	83%	0.825	74%	0.741	S	S	*	*			trans	-170.2	147.1	161.9	-124.1	0	0	0	0	108.3
988	S	26.5	Very low	31.7	Very low	107 Å²	107	115.9 Å²	115.9	75%	0.748	74%	0.737	S	S	*	*			cis	-150.4	167.2	1.3	-69.5	0	0	0	0	111.3
989	S	26.7	Very low	31.7	Very low	113 Å²	113	114.1 Å²	114.1	79%	0.79	74%	0.738	S	S	*	*			trans	-65.5	172.7	164.5	-56.2	0	0	0	0	112.6
990	P	37.8	Very low	31.4	Very low	124 Å²	124	115.9 Å²	115.9	81%	0.805	74%	0.74	S	S	*	*			cis	-143.5	-172.3	21.3	43.9	-23	0	0	0	118.6
991	S	23.6	Very low	31.3	Very low	100 Å²	100	114.1 Å²	114.1	70%	0.699	73%	0.731	S	S	*	*			trans	-56.8	-175.1	165.5	-41.4	0	0	0	0	114.1
992	P	36.4	Very low	31.3	Very low	69 Å²	69	115.9 Å²	115.9	45%	0.448	73%	0.725	S	S	.	*			cis	-140.8	-170.8	6.7	45.7	-28.5	0	0	0	116.6	H1188	P992-H1188 VanDerWaalsContact CD-CE1 3.48Å; P992-H1188 WeakPolarHBondContact CD-CE1 3.24Å
993	S	24.1	Very low	31.2	Very low	112 Å²	112	115.9 Å²	115.9	78%	0.783	72%	0.715	S	S	*	*			trans	66.2	156	158.9	-81.7	0	0	0	0	118.4
994	S	27.8	Very low	31.1	Very low	106 Å²	106	115.6 Å²	115.6	74%	0.741	71%	0.705	S	S	*	*			cis	-159.8	163.9	-15.8	45.6	0	0	0	0	110.2
995	S	26.3	Very low	31.1	Very low	107 Å²	107	116.5 Å²	116.5	75%	0.748	70%	0.699	S	S	*	*			trans	-51.9	164.9	158.3	-52.1	0	0	0	0	111.7
996	P	39.5	Very low	31	Very low	113 Å²	113	116 Å²	116	73%	0.734	69%	0.686	S	S	*	*			cis	-146.2	-164.2	22.6	41.4	-19.3	0	0	0	116.7
997	S	25.6	Very low	30.4	Very low	90 Å²	90	119.5 Å²	119.5	63%	0.629	69%	0.685	S	S	*	*			trans	79.9	108.7	143.5	-67.7	0	0	0	0	122
998	H	27.3	Very low	30.7	Very low	165 Å²	165	118.1 Å²	118.1	76%	0.764	68%	0.68	S	S	*	*				72.5	132.4	125.2	-72.4	-70.7	0	0	0	123.4
999	Q	27.6	Very low	31.1	Very low	160 Å²	160	118 Å²	118	75%	0.748	68%	0.679	S	S	*	*			trans	80.5	111.4	139.8	-74.2	-177.3	-2.3	0	0	122.4
1000	L	27.7	Very low	31.3	Very low	142 Å²	142	121 Å²	121	74%	0.743	68%	0.678	S	S	*	*				78	130.5	119	-67.1	170.1	0	0	0	123.2
1001	S	27.4	Very low	31.2	Very low	87 Å²	87	121 Å²	121	61%	0.608	68%	0.676	S	S	*	*			trans	66.4	105.3	132.8	67.7	0	0	0	0	123
1002	H	35.5	Very low	32.5	Very low	118 Å²	118	121.2 Å²	121.2	55%	0.546	68%	0.675	S	S	.	*				73	129.6	109.8	-65.1	-27.4	0	0	0	123.3	N326 T328	N326-H1002 PolarHBondContact ND2-CD2 3.04Å; N326-H1002 VanDerWaalsContact ND2-CD2 3.3Å; N326-H1002 VanDerWaalsContact ND2-CG 3.27Å; N326-H1002 PolarHBondContact ND2-ND1 2.66Å; N326-H1002 PolarHBondContact OD1-ND1 3.4Å; N326-H1002 VanDerWaalsContact OD1-ND1 3.1Å; T328-H1002 PolarHBondContact OG1-NE2 3.44Å
1003	Q	33.3	Very low	32.6	Very low	114 Å²	114	127.2 Å²	127.2	53%	0.533	69%	0.694	S	S	.	*			trans	69.6	154.4	138.4	-69.2	-165.2	-48.5	0	0	120	N326	N326-Q1003 HydrophobicContact CB-CG 4.36Å; N326-Q1003 VanDerWaalsContact CB-NE2 3.34Å; N326-Q1003 PolarHBondContact ND2-NE2 3.06Å; N326-Q1003 PolarHBondContact ND2-OE1 3.13Å; N326-Q1003 WeakPolarHBondContact OD1-CG 3.46Å
1004	Q	33.6	Very low	33.1	Very low	123 Å²	123	126.8 Å²	126.8	58%	0.575	69%	0.687	S	S	*	*			cis	-163.2	147.2	-18.5	-121.6	178.4	-19.5	0	0	111.7
1005	H	36.8	Very low	33.6	Very low	133 Å²	133	130.4 Å²	130.4	62%	0.616	69%	0.69	S	S	*	*			trans	63	162.8	139.7	-68	-16	0	0	0	120.5
1006	Q	36.8	Very low	33.9	Very low	111 Å²	111	135.7 Å²	135.7	52%	0.519	69%	0.693	S	S	.	*			cis	-164.3	172.6	-12.7	-110.9	167.7	24.3	0	0	111.9
1007	Y	32.1	Very low	33.7	Very low	198 Å²	198	135.7 Å²	135.7	78%	0.776	69%	0.691	S	S	*	*			trans	72.7	139.3	166.7	-52.9	-65.8	0	0	0	118.2
1008	A	32.9	Very low	35.2	Very low	88 Å²	88	136 Å²	136	73%	0.727	69%	0.691	S	S	*	*			cis	89.2	138.3	22.4	0	0	0	0	0	115.1
1009	S	34.4	Very low	35.4	Very low	104 Å²	104	137.5 Å²	137.5	73%	0.727	70%	0.696	S	S	*	*			cis	-175.8	170.2	6.5	46.7	0	0	0	0	111
1010	K	30.7	Very low	35.5	Very low	177 Å²	177	134.6 Å²	134.6	77%	0.77	69%	0.693	S	S	*	*			trans	147.9	124.1	139.4	-85.6	178	175.4	-166.2	0	120.2
1011	T	34.9	Very low	35.5	Very low	125 Å²	125	133.8 Å²	133.8	77%	0.767	69%	0.694	S	S	*	*				44.1	177.4	126.8	67.4	0	0	0	0	124.3
1012	P	52	Low	35.4	Very low	104 Å²	104	135.6 Å²	135.6	68%	0.675	71%	0.706	S	S	*	*			cis	-143	163.5	-25.9	28	-4.1	0	0	0	120.2
1013	K	39	Very low	35	Very low	195 Å²	195	133.9 Å²	133.9	85%	0.848	72%	0.72	S	S	*	*			trans	60.5	171	145.8	-63.3	176.5	176.2	-178.6	0	120.9
1014	T	34.6	Very low	34.6	Very low	102 Å²	102	132.3 Å²	132.3	63%	0.626	74%	0.735	S	S	*	*			cis	-163.8	165.5	18.7	-24.5	0	0	0	0	116.1
1015	F	38.4	Very low	34.2	Very low	183 Å²	183	130 Å²	130	80%	0.803	74%	0.744	S	S	*	*			trans	72.4	158.1	154.7	-67.7	-51.2	0	0	0	121.8
1016	R	32.3	Very low	34.8	Very low	218 Å²	218	129.5 Å²	129.5	82%	0.823	75%	0.753	S	S	*	*			cis	-150.3	-165.8	-7	-136.2	-179	-168.4	-109.3	6.2	113.8
1017	T	34.3	Very low	34.3	Very low	113 Å²	113	130.4 Å²	130.4	69%	0.693	77%	0.765	S	S	*	*			trans	-111.2	-175.5	-169.3	52.7	0	0	0	0	113.1
1018	P	57.5	Low	34.3	Very low	96 Å²	96	130 Å²	130	62%	0.623	77%	0.768	S	S	*	*			cis	-154.1	-176.9	36.4	41.9	-16.5	0	0	0	122.1
1019	F	31.7	Very low	34.1	Very low	196 Å²	196	131.9 Å²	131.9	86%	0.86	77%	0.773	S	S	*	*			trans	67.2	150.2	167.5	-59.9	-57.1	0	0	0	117.9
1020	S	30.4	Very low	33.7	Very low	99 Å²	99	131.1 Å²	131.1	69%	0.692	77%	0.773	S	S	*	*			cis	-172	169.9	-7.6	-100.3	0	0	0	0	108.8
1021	V	26.8	Very low	34.7	Very low	126 Å²	126	128.4 Å²	128.4	76%	0.764	77%	0.773	S	S	*	*			cis	-169.7	161.1	-24.7	66.5	0	0	0	0	109.1
1022	S	26.4	Very low	35	Very low	124 Å²	124	128.1 Å²	128.1	87%	0.867	77%	0.773	S	S	*	*			trans	64.4	141.8	176.4	-68.2	0	0	0	0	117.9
1023	G	25.5	Very low	33.9	Very low	82 Å²	82	128 Å²	128	85%	0.845	78%	0.781	S	S	*	*			cis	156.6	148	-4.2	0	0	0	0	0	109.3
1024	G	26.2	Very low	33.5	Very low	81 Å²	81	122.2 Å²	122.2	84%	0.835	78%	0.776	S	S	*	*			cis	-166.5	-169.8	-4.7	0	0	0	0	0	109.5
1025	G	25.3	Very low	33.2	Very low	75 Å²	75	123.7 Å²	123.7	77%	0.773	79%	0.789	S	S	*	*			trans	-96.9	-158.7	162.9	0	0	0	0	0	111.1
1026	P	48.4	Very low	32.6	Very low	122 Å²	122	120.3 Å²	120.3	79%	0.792	79%	0.788	S	S	*	*			cis	-138	-154.5	-11.5	27	-0.9	0	0	0	112.7
1027	V	27.2	Very low	32.4	Very low	130 Å²	130	118.5 Å²	118.5	79%	0.788	79%	0.787	S	S	*	*			trans	92.4	145.1	154.4	-167.3	0	0	0	0	120
1028	K	30.8	Very low	32.2	Very low	191 Å²	191	117.6 Å²	117.6	83%	0.83	78%	0.781	S	S	*	*			trans	-34.3	170.8	155.7	-86.9	177.6	175.3	178	0	115.8
1029	P	30.2	Very low	30.9	Very low	127 Å²	127	119.3 Å²	119.3	83%	0.825	78%	0.781	S	S	*	*			cis	-129	-146.2	16.8	42.5	-25.1	0	0	0	113.9
1030	A	25.1	Very low	30.9	Very low	88 Å²	88	118.1 Å²	118.1	73%	0.727	78%	0.775	S	S	*	*			trans	-111	-145.6	-172.5	0	0	0	0	0	111.2
1031	P	51.1	Low	31.5	Very low	119 Å²	119	118 Å²	118	77%	0.773	77%	0.772	S	S	*	*			trans	-86.8	-161	-156.2	46.7	-45	0	0	0	111.7
1032	P	41.4	Very low	31.7	Very low	120 Å²	120	120.4 Å²	120.4	78%	0.779	78%	0.775	S	S	*	*			cis	-140.1	-175.3	0.5	44.3	-26.5	0	0	0	115.9
1033	A	30	Very low	32.2	Very low	102 Å²	102	119.9 Å²	119.9	84%	0.843	77%	0.769	S	S	*	*				179	161	129.5	0	0	0	0	0	111.2
1034	G	29.1	Very low	33.2	Very low	72 Å²	72	121.1 Å²	121.1	74%	0.742	76%	0.762	S	S	*	*			trans	114.5	76.6	164.6	0	0	0	0	0	116.8
1035	C	28.8	Very low	34	Very low	133 Å²	133	122.5 Å²	122.5	90%	0.899	76%	0.756	S	S	*	*			trans	0.3	131.8	154.4	-50	0	0	0	0	117.9
1036	S	26.4	Very low	34	Very low	112 Å²	112	123.4 Å²	123.4	78%	0.783	75%	0.75	S	S	*	*			cis	-161.1	-169.2	6.6	68	0	0	0	0	108.2
1037	F	28	Very low	32.9	Very low	181 Å²	181	122.7 Å²	122.7	79%	0.794	75%	0.748	S	S	*	*			cis	-138.9	-133.6	12.6	-167.7	-127.5	0	0	0	112.4
1038	V	30.7	Very low	32.8	Very low	93 Å²	93	122.1 Å²	122.1	56%	0.564	75%	0.75	S	S	*	*			trans	-162.7	157.7	-149	105	0	0	0	0	110.3
1039	Q	30.5	Very low	32.6	Very low	133 Å²	133	117 Å²	117	62%	0.621	74%	0.743	S	S	*	*			cis	-150.5	144.9	15.8	-132.4	-170	125.5	0	0	112.9
1040	K	31.3	Very low	32.5	Very low	171 Å²	171	117.9 Å²	117.9	74%	0.743	74%	0.741	S	S	*	*			trans	73.3	166.1	136.2	-95.6	-167.5	-169.1	148.4	0	121.3
1041	P	42	Very low	32.9	Very low	95 Å²	95	120.4 Å²	120.4	62%	0.617	74%	0.742	S	S	*	*				-145.3	-165.9	-77.7	42.7	-20.8	0	0	0	116.7
1042	Q	30.5	Very low	31.9	Very low	178 Å²	178	124.3 Å²	124.3	83%	0.832	75%	0.747	S	S	*	*			trans	84.1	159.4	152.6	-87.2	-169.9	-74.1	0	0	119.8
1043	P	37	Very low	31.4	Very low	113 Å²	113	122.6 Å²	122.6	73%	0.734	75%	0.751	S	S	*	*			trans	-122.8	-117.7	-132.1	30.4	-4.4	0	0	0	118.3
1044	P	46.5	Very low	31.2	Very low	108 Å²	108	122.6 Å²	122.6	70%	0.701	74%	0.737	S	S	*	*			trans	-95.4	-168.9	-141.6	47.4	-37.1	0	0	0	112.9
1045	P	43.1	Very low	31.2	Very low	110 Å²	110	127.1 Å²	127.1	71%	0.714	74%	0.736	S	S	*	*			cis	-144.6	-172	9.3	36.3	-11.3	0	0	0	117.7
1046	S	25.2	Very low	31	Very low	94 Å²	94	126.9 Å²	126.9	66%	0.657	73%	0.731	S	S	*	*			trans	57.2	123.8	140.2	63.4	0	0	0	0	124.8
1047	S	25.7	Very low	31.7	Very low	106 Å²	106	127 Å²	127	74%	0.741	73%	0.729	S	S	*	*				91.3	139.7	129.3	78.8	0	0	0	0	122.5
1048	S	25	Very low	32.5	Very low	119 Å²	119	123.8 Å²	123.8	83%	0.832	73%	0.726	S	S	*	*			trans	55.2	131.7	141.5	-62.6	0	0	0	0	121
1049	A	27.3	Very low	32.1	Very low	82 Å²	82	124.3 Å²	124.3	68%	0.678	73%	0.734	S	S	*	*			cis	-167.2	176.2	3.6	0	0	0	0	0	113
1050	N	28.4	Very low	31.9	Very low	146 Å²	146	122.6 Å²	122.6	78%	0.781	74%	0.737	S	S	*	*			trans	77.2	148.1	153.5	-70.8	-22.1	0	0	0	122.3
1051	N	33.9	Very low	31.6	Very low	141 Å²	141	121.2 Å²	121.2	75%	0.754	74%	0.743	S	S	*	*			trans	73	55.3	152.9	-63.5	-25.4	0	0	0	120.9
1052	K	28.6	Very low	30.8	Very low	201 Å²	201	121 Å²	121	87%	0.874	75%	0.749	S	S	*	*				-173.3	125.3	123	-96.4	141.8	-166	155.1	0	111.9
1053	G	30.9	Very low	30.6	Very low	84 Å²	84	117.9 Å²	117.9	87%	0.866	75%	0.747	S	S	*	*			trans	-140.5	118.7	171.8	0	0	0	0	0	110.4
1054	D	26.3	Very low	30.1	Very low	103 Å²	103	117 Å²	117	55%	0.551	75%	0.749	S	S	*	*			trans	-124.7	134.3	-178.5	172	29.7	0	0	0	108.3	R268	R268-D1054 IonicContact CZ-OD2 3.71Å; R268-D1054 IonicContact NE-OD2 3.99Å; R268-D1054 IonicContact NH2-OD2 2.66Å; R268-D1054 PolarHBondContact NH2-OD2 3.35Å
1055	K	28.2	Very low	29.2	Very low	167 Å²	167	120.1 Å²	120.1	73%	0.726	76%	0.759	S	S	*	*			trans	71.1	147.7	-173.2	-43.4	178.7	-175.9	-173.3	0	112.8
1056	T	25.5	Very low	28.7	Very low	128 Å²	128	118.2 Å²	118.2	79%	0.785	75%	0.753	S	S	*	*			cis	-147.3	169.7	37.1	44.6	0	0	0	0	114.3
1057	P	40.6	Very low	28.8	Very low	114 Å²	114	121.2 Å²	121.2	74%	0.74	76%	0.761	S	S	*	*			trans	-83.5	-162.9	162.8	42.2	-40.8	0	0	0	110.2
1058	P	44.3	Very low	29	Very low	113 Å²	113	124.3 Å²	124.3	73%	0.734	76%	0.764	S	S	*	*			cis	-132	-168	-9.6	39.8	-21.3	0	0	0	114.4
1059	S	23.5	Very low	29	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	76%	0.76	S	S	*	*			trans	126.3	140.7	133.7	76.2	0	0	0	0	120.3
1060	S	25.6	Very low	29	Very low	97 Å²	97	131.3 Å²	131.3	68%	0.678	76%	0.761	S	S	*	*			trans	72.3	129.3	145.3	-54.6	0	0	0	0	123.8
1061	T	24.9	Very low	28.9	Very low	141 Å²	141	135.3 Å²	135.3	87%	0.865	77%	0.765	S	S	*	*			trans	65.2	146.7	143.7	45.4	0	0	0	0	120.2
1062	A	24.8	Very low	28.5	Very low	90 Å²	90	134.4 Å²	134.4	74%	0.744	77%	0.765	S	S	*	*			cis	-158	177.6	-5.9	0	0	0	0	0	112.8
1063	S	26.4	Very low	28.4	Very low	114 Å²	114	129.6 Å²	129.6	80%	0.797	76%	0.756	S	S	*	*			trans	-20	158.3	171.6	-46.2	0	0	0	0	123.6
1064	A	27.5	Very low	28.2	Very low	94 Å²	94	132.5 Å²	132.5	78%	0.777	76%	0.757	S	S	*	*			trans	72.2	156.5	157	0	0	0	0	0	117.4
1065	L	27.2	Very low	28.1	Very low	173 Å²	173	131.4 Å²	131.4	91%	0.906	77%	0.77	S	S	*	*			cis	-139.5	-158.9	-3.7	-133.5	162.3	0	0	0	110
1066	A	32.1	Very low	28.1	Very low	71 Å²	71	127.4 Å²	127.4	59%	0.587	78%	0.776	S	S	*	*			trans	-109.8	162.8	-157.2	0	0	0	0	0	117.3
1067	N	27.5	Very low	28	Very low	156 Å²	156	125.8 Å²	125.8	83%	0.834	78%	0.776	S	S	*	*			trans	67.3	158	164.1	-68.4	-25.2	0	0	0	117.2
1068	Q	29.9	Very low	27.3	Very low	171 Å²	171	127.9 Å²	127.9	80%	0.799	78%	0.779	S	S	*	*			cis	-143.4	-167.2	7.1	-145.2	175.3	-2.5	0	0	112.6
1069	R	25.8	Very low	26.6	Very low	200 Å²	200	130.4 Å²	130.4	76%	0.755	78%	0.781	S	S	*	*			trans	-51.7	167.5	175.4	-60.7	157.1	127.3	-140.9	14.7	112.7
1070	Q	26.4	Very low	26.7	Very low	148 Å²	148	130.1 Å²	130.1	69%	0.692	78%	0.779	S	S	*	*			cis	-166.4	166.7	36.2	-156.5	142.8	-74.7	0	0	114.4
1071	R	26.6	Very low	26.9	Very low	230 Å²	230	130.6 Å²	130.6	87%	0.868	78%	0.783	S	S	*	*			trans	-22.2	153.1	152.5	-97.3	-178.2	-179.1	-172.2	1.3	115.7
1072	V	26.4	Very low	27	Very low	123 Å²	123	133.5 Å²	133.5	75%	0.745	78%	0.783	S	S	*	*			cis	-147.3	167	-0.1	-141.1	0	0	0	0	106.9
1073	S	26.5	Very low	27.2	Very low	99 Å²	99	134 Å²	134	69%	0.692	79%	0.788	S	S	*	*				171.6	144.7	75.1	-113.2	0	0	0	0	113
1074	V	26.3	Very low	27.1	Very low	145 Å²	145	131.5 Å²	131.5	88%	0.879	78%	0.78	S	S	*	*			trans	47.7	128	137.5	-175	0	0	0	0	121.5
1075	G	24	Very low	27.2	Very low	81 Å²	81	135.5 Å²	135.5	84%	0.835	79%	0.788	S	S	*	*			trans	120.4	125.9	154.4	0	0	0	0	0	114.8
1076	G	28	Very low	27.2	Very low	83 Å²	83	130.4 Å²	130.4	86%	0.856	78%	0.777	S	S	*	*			trans	157.8	106.3	173.8	0	0	0	0	0	114
1077	A	24.6	Very low	26.9	Very low	94 Å²	94	140 Å²	140	78%	0.777	80%	0.799	S	S	*	*			trans	-86.8	149.4	178.8	0	0	0	0	0	113.1
1078	I	25.6	Very low	26.8	Very low	158 Å²	158	136.8 Å²	136.8	81%	0.81	79%	0.794	S	S	*	*			trans	-7.7	142.1	136.2	1.1	173.2	0	0	0	114.3
1079	Q	29.3	Very low	27.4	Very low	165 Å²	165	134.3 Å²	134.3	77%	0.771	79%	0.792	S	S	*	*			cis	-156.1	168.1	37.3	-51.7	175	29.1	0	0	114.3
1080	S	25.9	Very low	27.3	Very low	100 Å²	100	131 Å²	131	70%	0.699	80%	0.8	S	S	*	*			trans	46.4	141.8	139.5	71.9	0	0	0	0	121
1081	S	28.3	Very low	27.2	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	80%	0.797	S	S	*	*			cis	-160.2	134.6	37.6	-74.7	0	0	0	0	109.9
1082	K	28.7	Very low	27.1	Very low	201 Å²	201	122.3 Å²	122.3	87%	0.874	80%	0.795	S	S	*	*				75	113.8	82.6	-164.5	176	-178.4	177	0	116.2
1083	A	28.9	Very low	27.1	Very low	102 Å²	102	124.1 Å²	124.1	84%	0.843	80%	0.799	S	S	*	*			trans	64	149.9	160.2	0	0	0	0	0	119.9
1084	G	24.6	Very low	27	Very low	61 Å²	61	124 Å²	124	63%	0.629	80%	0.804	S	S	*	*			cis	171.4	163.4	-7.9	0	0	0	0	0	114
1085	N	29.7	Very low	27	Very low	177 Å²	177	123.7 Å²	123.7	95%	0.947	80%	0.803	S	S	*	*			trans	60.1	142.4	167	-54.6	3.8	0	0	0	117.9
1086	G	25.4	Very low	27.1	Very low	66 Å²	66	126 Å²	126	68%	0.68	81%	0.806	S	S	*	*			cis	152.6	128.8	-8.2	0	0	0	0	0	112
1087	W	25.6	Very low	27.1	Very low	274 Å²	274	126.8 Å²	126.8	100%	1.038	80%	0.804	S	S	*	*			trans	-162.1	163	165.9	-103.5	-13.1	0	0	0	112.2
1088	A	27.3	Very low	27.2	Very low	88 Å²	88	129.1 Å²	129.1	73%	0.727	81%	0.809	S	S	*	*			trans	-149.5	-175.7	-173.3	0	0	0	0	0	109.3
1089	P	42.3	Very low	27.3	Very low	118 Å²	118	127.6 Å²	127.6	77%	0.766	81%	0.807	S	S	*	*				-129.6	168.9	-54	35.6	-22.2	0	0	0	112.9
1090	S	22.7	Very low	27.2	Very low	132 Å²	132	124.9 Å²	124.9	92%	0.923	81%	0.807	S	S	*	*			trans	-171.8	152.7	153.8	-88.9	0	0	0	0	113.7
1091	G	24.8	Very low	27.3	Very low	61 Å²	61	127.4 Å²	127.4	63%	0.629	81%	0.807	S	S	*	*			trans	97.6	114.1	178.7	0	0	0	0	0	112.2
1092	T	24.6	Very low	27.2	Very low	134 Å²	134	130.5 Å²	130.5	82%	0.822	81%	0.814	S	S	*	*				60.3	130.9	53.2	79.4	0	0	0	0	112.5
1093	L	25.9	Very low	27.1	Very low	161 Å²	161	125.2 Å²	125.2	84%	0.843	80%	0.803	S	S	*	*			cis	-145.7	156.4	35.1	-81.5	166.4	0	0	0	116
1094	A	24.9	Very low	27.1	Very low	95 Å²	95	129.1 Å²	129.1	79%	0.785	80%	0.803	S	S	*	*			trans	58.5	126.3	137.2	0	0	0	0	0	123
1095	T	26.6	Very low	27.1	Very low	140 Å²	140	130.9 Å²	130.9	86%	0.859	80%	0.802	S	S	*	*			trans	-113.8	151.5	151.6	45.2	0	0	0	0	109.8
1096	S	25.8	Very low	26.9	Very low	129 Å²	129	127.3 Å²	127.3	90%	0.902	79%	0.791	S	S	*	*			trans	-73.5	153.7	180	-54.1	0	0	0	0	112.7
1097	A	26.7	Very low	27.1	Very low	99 Å²	99	129 Å²	129	82%	0.818	80%	0.799	S	S	*	*			trans	-131.3	151.4	175.3	0	0	0	0	0	111.5
1098	T	26.8	Very low	27.1	Very low	143 Å²	143	121 Å²	121	88%	0.877	79%	0.791	S	S	*	*			trans	-127.6	158.3	166.4	46.4	0	0	0	0	110
1099	T	28.3	Very low	27	Very low	126 Å²	126	120.2 Å²	120.2	77%	0.773	79%	0.791	S	S	*	*			trans	-68.9	168.6	-166.7	55.3	0	0	0	0	113
1100	S	27.7	Very low	26.2	Very low	108 Å²	108	120.3 Å²	120.3	76%	0.755	79%	0.794	S	S	*	*			cis	-160.3	164	34	48	0	0	0	0	116.6
1101	H	26.9	Very low	27.2	Very low	154 Å²	154	119 Å²	119	71%	0.713	78%	0.783	S	S	*	*			trans	-41.1	146.7	-179.5	-48.6	-98	0	0	0	120.5
1102	L	27.4	Very low	27.5	Very low	171 Å²	171	122.9 Å²	122.9	90%	0.895	79%	0.788	S	S	*	*				-167.8	178.7	108.3	-108	158.8	0	0	0	113.4
1103	S	27.2	Very low	27.8	Very low	90 Å²	90	123.7 Å²	123.7	63%	0.629	79%	0.787	S	S	*	*			trans	-115	-175.4	-154.3	-57.4	0	0	0	0	115.9
1104	Q	27	Very low	27.8	Very low	184 Å²	184	121.1 Å²	121.1	86%	0.86	78%	0.778	S	S	*	*			trans	-142.4	174.2	-172.5	-45.3	175.7	-6.2	0	0	108.8
1105	V	26	Very low	27.8	Very low	98 Å²	98	123.2 Å²	123.2	59%	0.594	78%	0.776	S	S	*	*			cis	-164	176.7	18	67.7	0	0	0	0	110.2
1106	S	24.9	Very low	27.9	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	77%	0.773	S	S	*	*			trans	96.5	102.1	160.7	-70	0	0	0	0	120.9
1107	A	30.4	Very low	28.1	Very low	103 Å²	103	124.1 Å²	124.1	85%	0.851	77%	0.769	S	S	*	*				11.4	135	129.8	0	0	0	0	0	122.5
1108	A	25.1	Very low	28.3	Very low	106 Å²	106	124 Å²	124	88%	0.876	77%	0.768	S	S	*	*				178.6	141.5	114.8	0	0	0	0	0	114.4
1109	G	24.7	Very low	28.8	Very low	70 Å²	70	125.2 Å²	125.2	72%	0.722	77%	0.768	S	S	*	*			trans	85.7	105.1	138	0	0	0	0	0	123.6
1110	S	26.8	Very low	29.7	Very low	120 Å²	120	125.1 Å²	125.1	84%	0.839	77%	0.769	S	S	*	*				67.1	168.7	125.8	-63.3	0	0	0	0	121.8
1111	P	43	Very low	30.3	Very low	105 Å²	105	127.9 Å²	127.9	68%	0.682	78%	0.775	S	S	*	*			cis	-139.8	159.2	-31.1	32.4	-12.9	0	0	0	117.6
1112	L	31.5	Very low	30.5	Very low	142 Å²	142	123.6 Å²	123.6	74%	0.743	77%	0.773	S	S	*	*			trans	62.8	161.9	148.4	-64.9	167.2	0	0	0	119.8	T1114	L1112-T1114 HydrophobicContact CD2-CG2 3.87Å
1113	L	29.4	Very low	30.9	Very low	151 Å²	151	124.6 Å²	124.6	79%	0.791	77%	0.77	S	S	*	*			cis	-120.4	164.7	-0.1	-65.4	161.1	0	0	0	109.6
1114	T	26.4	Very low	31.2	Very low	108 Å²	108	123.5 Å²	123.5	66%	0.663	77%	0.773	S	S	*	*			cis	89.1	97.5	6.7	75.8	0	0	0	0	120	L1112	L1112-T1114 HydrophobicContact CD2-CG2 3.87Å
1115	N	26	Very low	31.8	Very low	139 Å²	139	122.7 Å²	122.7	74%	0.743	77%	0.771	S	S	*	*			trans	-144.2	146.4	153.1	-139.5	3.7	0	0	0	106.3
1116	H	27.6	Very low	32.7	Very low	172 Å²	172	126.3 Å²	126.3	80%	0.796	79%	0.786	S	S	*	*			cis	-129.7	-178.5	25.9	-63.9	-105.2	0	0	0	113.8
1117	S	30.8	Very low	33	Very low	116 Å²	116	124.9 Å²	124.9	81%	0.811	79%	0.787	S	S	*	*			trans	-128.5	162.8	-177.6	-76.3	0	0	0	0	110.6
1118	A	29.8	Very low	33.1	Very low	96 Å²	96	123.3 Å²	123.3	79%	0.793	78%	0.781	S	S	*	*			cis	-164.5	-174.4	-11.9	0	0	0	0	0	110.7
1119	L	38.3	Very low	33.5	Very low	169 Å²	169	126.6 Å²	126.6	89%	0.885	78%	0.783	S	S	*	*			trans	-84.5	171.9	-173.6	-62.1	168	0	0	0	115.2
1120	P	47.7	Very low	33.9	Very low	123 Å²	123	129.4 Å²	129.4	80%	0.799	79%	0.786	S	S	*	*				-140.3	170.8	119.2	38.5	-27.4	0	0	0	114.1
1121	L	38.7	Very low	35.4	Very low	166 Å²	166	129.1 Å²	129.1	87%	0.869	78%	0.781	S	S	*	*			cis	-173.9	133.8	-32.1	176.4	62.6	0	0	0	110
1122	G	32.4	Very low	35	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	78%	0.784	S	S	*	*			trans	132.3	147.8	156.7	0	0	0	0	0	117.3
1123	F	35	Very low	34.9	Very low	192 Å²	192	128.5 Å²	128.5	84%	0.842	79%	0.786	S	S	*	*			cis	-159.6	145.4	-5.4	-149	-88.8	0	0	0	113.8	M1125	F1123-M1125 HydrophobicContact CE1-SD 4.41Å
1124	G	33.9	Very low	35	Very low	66 Å²	66	129 Å²	129	68%	0.68	79%	0.788	S	S	*	*			trans	88.6	148.4	161.7	0	0	0	0	0	118.9
1125	M	38.6	Very low	36.3	Very low	168 Å²	168	128.6 Å²	128.6	83%	0.828	79%	0.788	S	S	*	*			cis	178.6	162.6	-27.1	-116.6	172.4	76.6	0	0	109.2	F1123	F1123-M1125 HydrophobicContact CE1-SD 4.41Å
1126	L	45.3	Very low	36.4	Very low	173 Å²	173	131 Å²	131	91%	0.906	79%	0.792	S	S	*	*				-161.5	164.1	-67.6	-124	175.8	0	0	0	111.8
1127	G	31.6	Very low	36.5	Very low	72 Å²	72	129.7 Å²	129.7	74%	0.742	79%	0.786	S	S	*	*			trans	128.5	123.7	161.9	0	0	0	0	0	114.8
1128	G	33	Very low	36.4	Very low	70 Å²	70	132.8 Å²	132.8	72%	0.722	79%	0.785	S	S	*	*			cis	-168.4	-157	-0.6	0	0	0	0	0	110.8
1129	L	33.3	Very low	37	Very low	176 Å²	176	133.5 Å²	133.5	92%	0.921	78%	0.782	S	S	*	*			cis	-143.6	-89.6	4.3	-82	178.8	0	0	0	115
1130	V	33.4	Very low	37.7	Very low	129 Å²	129	130.6 Å²	130.6	78%	0.782	77%	0.773	S	S	*	*			trans	-140.3	155	-150	164.4	0	0	0	0	115.2
1131	P	58.6	Low	36.9	Very low	114 Å²	114	132.2 Å²	132.2	74%	0.74	77%	0.774	S	S	*	*			trans	-134.1	-117.9	-163.6	41.1	-18.6	0	0	0	115.8
1132	V	32.9	Very low	36.6	Very low	120 Å²	120	131.5 Å²	131.5	73%	0.727	77%	0.771	S	S	*	*			trans	74.2	143.5	176.9	-128.5	0	0	0	0	114.7
1133	S	29.5	Very low	36.4	Very low	113 Å²	113	134.7 Å²	134.7	79%	0.79	77%	0.772	S	S	*	*			cis	-152.9	176.5	30.4	-59.2	0	0	0	0	117.6
1134	L	31.3	Very low	36.2	Very low	162 Å²	162	134 Å²	134	85%	0.848	77%	0.769	S	S	*	*			trans	-91.7	-153.1	-177.8	-54.2	142.1	0	0	0	112.3
1135	P	54.3	Low	35.9	Very low	100 Å²	100	135.9 Å²	135.9	65%	0.649	77%	0.772	S	S	*	*			cis	-139.1	-163.7	-17.9	23.7	4	0	0	0	116.4
1136	F	29.3	Very low	36	Very low	189 Å²	189	132.3 Å²	132.3	83%	0.829	77%	0.769	S	S	*	*			trans	86.5	160.4	163.6	-67	-90.4	0	0	0	120.7
1137	Q	27.8	Very low	35.7	Very low	144 Å²	144	130.4 Å²	130.4	67%	0.673	77%	0.767	S	S	*	*			cis	178.2	154.8	-46.9	-177.9	59.5	18.1	0	0	110.3
1138	F	29.9	Very low	35.7	Very low	181 Å²	181	130.2 Å²	130.2	79%	0.794	77%	0.765	S	S	*	*			trans	113.9	152.3	162.6	-68.4	-61.4	0	0	0	118.3
1139	P	41.6	Very low	35.7	Very low	111 Å²	111	132.1 Å²	132.1	72%	0.721	77%	0.774	S	S	*	*			trans	-137	-137.3	-141.4	43.9	-18.5	0	0	0	114.1
1140	P	53.4	Low	35.3	Very low	109 Å²	109	128.7 Å²	128.7	71%	0.708	77%	0.771	S	S	*	*				-129.2	168.1	-126.4	39.2	-18	0	0	0	117.7
1141	L	31	Very low	35.1	Very low	157 Å²	157	128.2 Å²	128.2	82%	0.822	77%	0.774	S	S	*	*			trans	-149.8	124.6	162.2	-74.2	179.9	0	0	0	113.1
1142	L	33.5	Very low	33.9	Very low	151 Å²	151	127 Å²	127	79%	0.791	77%	0.774	S	S	*	*			trans	53.3	144.6	140.7	-51	174.5	0	0	0	120.1
1143	N	27.6	Very low	33.8	Very low	131 Å²	131	126.1 Å²	126.1	70%	0.701	78%	0.778	S	S	*	*			cis	-154.5	171.3	7.1	-148.2	21.9	0	0	0	113.5
1144	F	29.9	Very low	33.9	Very low	179 Å²	179	125.8 Å²	125.8	79%	0.785	78%	0.776	S	S	*	*			trans	-59.5	169.6	172.3	-57.1	-78.3	0	0	0	115.1
1145	S	27.4	Very low	34.1	Very low	104 Å²	104	123.7 Å²	123.7	73%	0.727	76%	0.763	S	S	*	*			cis	-168.2	172.3	-13.4	-104.8	0	0	0	0	109.5
1146	A	41.2	Very low	33.1	Very low	93 Å²	93	122.1 Å²	122.1	77%	0.769	77%	0.765	S	S	*	*			trans	-74.5	161.8	162.3	0	0	0	0	0	112.1
1147	P	39.5	Very low	33.3	Very low	133 Å²	133	119.1 Å²	119.1	86%	0.864	77%	0.768	S	S	*	*				-147.8	-172.2	108.5	41.1	-26.4	0	0	0	114
1148	G	31.3	Very low	33.8	Very low	69 Å²	69	118.7 Å²	118.7	71%	0.711	78%	0.775	S	S	*	*			trans	-136.7	178.2	166.6	0	0	0	0	0	112.8
1149	A	32.8	Very low	34.5	Very low	110 Å²	110	115.2 Å²	115.2	91%	0.909	77%	0.771	S	S	*	*			trans	69.9	125.6	171.7	0	0	0	0	0	119.7
1150	A	26.2	Very low	34	Very low	104 Å²	104	115.7 Å²	115.7	86%	0.86	78%	0.777	S	S	*	*			trans	-171.1	170.5	151.3	0	0	0	0	0	109.6
1151	S	28.6	Very low	33.1	Very low	119 Å²	119	116.1 Å²	116.1	83%	0.832	78%	0.783	S	S	*	*				-161.6	170.3	-65.9	-160.4	0	0	0	0	110.6
1152	A	32.3	Very low	33.1	Very low	89 Å²	89	116.4 Å²	116.4	74%	0.736	79%	0.785	S	S	*	*			trans	72.8	109.7	154.7	0	0	0	0	0	123.5
1153	A	31.1	Very low	33.1	Very low	100 Å²	100	114.6 Å²	114.6	83%	0.826	79%	0.785	S	S	*	*				78.5	134	112.9	0	0	0	0	0	125.9
1154	S	32.6	Very low	33.1	Very low	106 Å²	106	111.8 Å²	111.8	74%	0.741	79%	0.787	S	S	*	*			trans	100.6	121.9	132.9	-149.9	0	0	0	0	122.5
1155	M	34.9	Very low	33.3	Very low	118 Å²	118	114 Å²	114	58%	0.581	79%	0.792	S	S	*	*			trans	46.3	148.1	150.9	-54.5	-73.7	176.1	0	0	120.9	S769	S769-M1155 WeakPolarHBondContact O-CE 3.38Å
1156	G	33.9	Very low	34.5	Very low	67 Å²	67	114.3 Å²	114.3	69%	0.691	79%	0.791	S	S	*	*			cis	166.1	159.9	-7.1	0	0	0	0	0	113.1
1157	S	33.4	Very low	34	Very low	127 Å²	127	117.6 Å²	117.6	89%	0.888	79%	0.794	S	S	*	*			trans	86.6	158	168.6	-56.7	0	0	0	0	121.5
1158	T	38.3	Very low	33.7	Very low	135 Å²	135	114.5 Å²	114.5	83%	0.828	78%	0.78	S	S	*	*			trans	-117.4	-167.2	-167.3	53.4	0	0	0	0	110.9
1159	P	44.5	Very low	33.8	Very low	107 Å²	107	120 Å²	120	70%	0.695	79%	0.787	S	S	*	*			cis	-148.8	-179.3	9.8	46.6	-26.1	0	0	0	120.2
1160	S	31.1	Very low	33.9	Very low	121 Å²	121	118.3 Å²	118.3	85%	0.846	77%	0.769	S	S	*	*			trans	64.4	150.6	143	-68.9	0	0	0	0	125.1
1161	S	35	Very low	34.4	Very low	119 Å²	119	120.4 Å²	120.4	83%	0.832	77%	0.766	S	S	*	*			trans	-97.7	163.9	177.3	5.8	0	0	0	0	113.5
1162	N	30.8	Very low	34.8	Very low	162 Å²	162	121.4 Å²	121.4	87%	0.866	76%	0.761	S	S	*	*				-166.1	171.5	124.2	-147.9	-1.7	0	0	0	114.6
1163	S	32.2	Very low	35	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	76%	0.762	S	S	*	*			trans	-69.8	161.7	171.8	-179.5	0	0	0	0	115
1164	G	28.8	Very low	35.3	Very low	71 Å²	71	126.2 Å²	126.2	73%	0.732	76%	0.758	S	S	*	*			trans	165.8	107.5	161.2	0	0	0	0	0	117.8
1165	Y	32.8	Very low	35.4	Very low	227 Å²	227	124.9 Å²	124.9	89%	0.89	75%	0.748	S	S	*	*			trans	-75.4	171.3	147.7	-90.7	-95.8	0	0	0	108.9
1166	P	52.7	Low	35.3	Very low	109 Å²	109	125.3 Å²	125.3	71%	0.708	75%	0.753	S	S	*	*			cis	-148.7	-178.8	24.1	46.6	-27	0	0	0	119
1167	L	31.2	Very low	35.4	Very low	162 Å²	162	129.9 Å²	129.9	85%	0.848	76%	0.756	S	S	*	*			trans	68	137.9	140	-119.3	70.6	0	0	0	125.3
1168	A	34.1	Very low	35.5	Very low	69 Å²	69	128.1 Å²	128.1	57%	0.57	74%	0.744	S	S	*	*			trans	93	120.1	131.8	0	0	0	0	0	121.9
1169	Q	32.3	Very low	35.3	Very low	183 Å²	183	130 Å²	130	86%	0.855	74%	0.743	S	S	*	*			trans	63.2	147.1	136.2	-69.4	-174.8	-95	0	0	120.6
1170	S	34.3	Very low	34.7	Very low	75 Å²	75	130.8 Å²	130.8	52%	0.524	75%	0.751	S	S	.	*			cis	-171.4	143.4	-15	46	0	0	0	0	110.9
1171	D	37.3	Very low	34.8	Very low	148 Å²	148	128.7 Å²	128.7	79%	0.791	75%	0.749	S	S	*	*			trans	60.2	173.8	158.7	-46.4	-38.1	0	0	0	116.2
1172	L	37.6	Very low	34.9	Very low	140 Å²	140	129.3 Å²	129.3	73%	0.733	74%	0.742	S	S	*	*			cis	-162.4	143.4	15.6	-174.1	50.8	0	0	0	111.7
1173	M	35.7	Very low	35	Very low	155 Å²	155	128.6 Å²	128.6	76%	0.764	74%	0.736	S	S	*	*			trans	60.7	134.7	165.2	-63	-82.1	154.3	0	0	117.9
1174	D	37.5	Very low	35.3	Very low	136 Å²	136	131.1 Å²	131.1	73%	0.727	73%	0.732	S	S	*	*			cis	105.2	160.5	26.2	-173.4	47.7	0	0	0	113.7
1175	S	35.3	Very low	35.8	Very low	77 Å²	77	138.5 Å²	138.5	54%	0.538	74%	0.738	S	S	.	*			trans	86.4	94.9	169.5	-80.7	0	0	0	0	120.2
1176	N	32.7	Very low	36.1	Very low	128 Å²	128	137.2 Å²	137.2	68%	0.684	74%	0.737	S	S	*	*				73.7	161.7	119.1	-68.6	-53.5	0	0	0	121.4
1177	Q	36.5	Very low	35.7	Very low	163 Å²	163	138.1 Å²	138.1	76%	0.762	74%	0.741	S	S	*	*			cis	-172.5	154.3	-36.9	-177.4	169.8	95.6	0	0	109.9
1178	S	34.5	Very low	36.4	Very low	89 Å²	89	140 Å²	140	62%	0.622	75%	0.745	S	S	*	*			trans	84.6	130.6	150.8	-96.4	0	0	0	0	123.1
1179	Q	34.9	Very low	36.5	Very low	176 Å²	176	143.6 Å²	143.6	82%	0.822	75%	0.754	S	S	*	*			trans	86.9	109.1	134.1	-74.9	-175.7	10.4	0	0	123.3
1180	S	32.1	Very low	36.7	Very low	123 Å²	123	141.5 Å²	141.5	86%	0.86	75%	0.748	S	S	*	*				73.3	127.9	115.4	-154.5	0	0	0	0	120.1
1181	G	32.2	Very low	36.9	Very low	77 Å²	77	145.2 Å²	145.2	79%	0.794	76%	0.761	S	S	*	*			trans	175.3	66.5	177.3	0	0	0	0	0	114.4
1182	D	37	Very low	36.8	Very low	131 Å²	131	145 Å²	145	70%	0.701	76%	0.759	S	S	*	*			trans	-71.6	131	170.9	-170.5	-14	0	0	0	110.3
1183	M	34.1	Very low	36.8	Very low	147 Å²	147	145.3 Å²	145.3	72%	0.724	76%	0.761	S	S	*	*				-169.4	132.7	128.3	-147.2	58.2	64.2	0	0	114.6
1184	K	38.4	Very low	36.9	Very low	168 Å²	168	144.7 Å²	144.7	73%	0.73	76%	0.76	S	S	*	*			trans	-43.4	147	167.1	-59.1	151.9	179.8	161.9	0	115.2
1185	R	38	Very low	36.8	Very low	225 Å²	225	145.3 Å²	145.3	85%	0.849	76%	0.763	S	S	*	*				-164.8	133.8	110.9	-114.9	162.8	-71.3	-155.3	2.9	118.7
1186	K	39.9	Very low	36.9	Very low	200 Å²	200	150.5 Å²	150.5	87%	0.87	78%	0.78	S	S	*	*			trans	75.4	101.3	138.6	-140.5	161.5	-172.7	177.7	0	119.3
1187	T	43.8	Very low	37.3	Very low	128 Å²	128	152.4 Å²	152.4	79%	0.785	79%	0.788	S	S	*	*			trans	-59.4	152.1	164.9	49.2	0	0	0	0	114.4
1188	H	45.9	Very low	37.3	Very low	202 Å²	202	151.5 Å²	151.5	94%	0.935	79%	0.79	S	S	*	*				-144	0	119.8	-139.4	-61.5	0	0	0	111.6	P992	P992-H1188 VanDerWaalsContact CD-CE1 3.48Å; P992-H1188 WeakPolarHBondContact CD-CE1 3.24Å

Retrieved 1,188 of 1,188 residues in 337.4 ms (Link to these results)

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