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Isoform q of Serine/threonine-protein kinase WNK AlphaSync

Canonical isoform description: Serine/threonine-protein kinase component of the WNK3-SPAK/OSR1 kinase cascade, which plays an important role in the regulation of electrolyte homeostasis and regulatory volume increase in response to hyperosmotic stress¹. Wnk-1 mediates regulatory volume increase in response to hyperosmotic stress by acting as a molecular crowding sensor, which senses cell shrinkage and mediates formation of a membraneless compartment by undergoing liquid-liquid phase separation². The membraneless compartment concentrates wnk-1 with its substrates (By similarity). Phosphorylates gck-3³. Plays a role in osmotic stress responses during which it increases gpdh-1 translation, likely by phosphorylating gck-3⁴. Essential for larval development and the tubular formation of the excretory canals⁵.

AlphaFold DB , UniProt , Accession X5M5N0-17 (canonical: X5M5N0), Species CAEEL (Caenorhabditis elegans), Gene wnk-1, Length 1,686 aa.

						>WNK_CAEEL|X5M5N0-17|wnk-1
MPDSITNGGRPPAPPSSVSSTTASTTGNFGTRRRLVNRIKKVDELHPAQENPTMGSHWLSEQERSRLEAVQQDWRRTRPMKFQWTSKKRPDDPTTSSPSTVSISNALENSTPSLNNVSSITNSSSPFSLSSAATSTASAIIPFTSNVATNHPHLNHHVSRIPQAIVTGGTNGSLPPLLISPTSAAAATPLISGKAGPMSPSTGSPINVAATVLQNAVSSPQHSIFDRSRLNKIPPNTSLASSSSPSDAANNDKPIQQRHSILSNVRTLTQAMVNDGPRTLTGDDMDKMVSEEERARKEQEKREEEEKAARRIDVEDDFDAQEKPIDKSKNGRFLKFDEELGRGSFKTVFRGLDTETGVAVAWCELQESKLNKTERQRFREEAEMLKDLQHPNIVRFYDYWESADLCGKRKYIVLVTELMTSGTLKMYLKRFKRINIKVLKSWCRQILKGLSFLHTRNPPVIHRDLKCDNIFITGTTGSVKIGDLGLATLKNKSFAKSVIGTPEFMAPEMYEEMYDESVDVYAFGMCLLEMVTGEYPYSECMNPATIYRKVISGVKPECFSRIPAQYPEIREIIDRCIRVRREERSTVKQLLVDDFFTPEDLIGIRVEIKNRDADLNDLNVEIQMQLRVYDEKKRKQYRFKENEGLQFAFDIENDSPDEVVQQMIEQQHIPDEDTRMITKLIKDKVDAFRRDRDHRLLEIKRAKEEEERIREEAEIKEELRLRAEAKEKEKERLEKERLEKKAAAAAAANPNPTPIPPTPATPHSSAQQQPIPPPLSTQTSAEIQQSAQQPSVPVTMIANIPAMSPTSAQPQPVLSPTSAAVPVPTTMIHVPKPSEIPVQNVATTAAPVAANNVPPSPAPFKTEDIQTPTLAQNTVPRTISTDASGLVINTPASIASPSPAPSATDVASTTAPVTPAPTPTTTTDGGAAAASTTTENKEEKRKSNKRKVVMEILGCDESRNFALVSCRLDTSHKSVTFQFAPGTDKPCTIATKLLAEDCLLKVHVHIVEAQLGEVIQLINSDGKKGVGTKLATVLDPNSTEPPTITAVMPKDSSAATASNTKPKIEIEKTPPTRDASQEPNNVQVTNVRKVSQESNAESVQSIPRPGGIIVMSPTNQTDSAPPPTGAAAKPSRFQVTKSADPIATPISSSISTATVIPIVAATPTNITSEPVIVQPITAQVITHLATPSPVSHSLSSNSSPSATTHSNMSSIQSTTSVPGRRFTVQPVSQAESGISSSISTPHPEPTPAITSCPPPVPSVPPVVSNGTLNLEVAPKQTPSATNQNVDTQHSSSTASTATLVSETPATVHVTPISVPAPVQEPLVIDHHSDVLTQLDSELRKVSGVSHSASPSTVVESLTSMTPQTIPLACQTVPASIGQAPAVIAAAHAASLIPNASVPQSPSRLDAETGLAGLHEKLEALKMEQDRREDMGDDAIGTTTTDGKDEIPIDTLKGLAEALGKVIHADGRETTPMPPDHPDLTDASTGQMDLESEDPEVIQMIVRHRMEQHKLLEKQRVEIERLRSKIRVPRATSVNPEMIGDDEADTTLTALQSALGNASLSLPASPPPNTEIPDNEGQHHCNSFRCIGDPNDNVSIVNQIKQRLGIIPSSRQSVRSATSSSPSTPPSSSSAPPKSLSSPTKSYVSHCSLSIGYGSTASSEQQQREPSPSATTSSFLSDPATGVIENV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	33.9	Very low	35.3	Very low	223 Å²	223	134.1 Å²	134.1	100%	1.099	80%	0.797	S	S	*	*				0	143.3	0	-67.5	178.7	175.8	0	0	107.3
2	P	35	Very low	35.9	Very low	121 Å²	121	132 Å²	132	79%	0.786	79%	0.79	S	S	*	*			cis	-65.1	169.2	-15.7	-19.5	36.7	0	0	0	110.9
3	D	32.5	Very low	36.6	Very low	130 Å²	130	128.2 Å²	128.2	70%	0.695	78%	0.781	S	S	*	*			cis	76.4	145.5	29.2	-64.9	-75.1	0	0	0	114.9
4	S	30.8	Very low	37	Very low	84 Å²	84	127.6 Å²	127.6	59%	0.587	78%	0.781	S	S	*	*			cis	-168.2	154	-25	-107.1	0	0	0	0	110
5	I	33.7	Very low	37.4	Very low	140 Å²	140	127.9 Å²	127.9	72%	0.718	79%	0.786	S	S	*	*			trans	25	119.6	142.8	-49.1	162.2	0	0	0	118.1
6	T	35.8	Very low	37.6	Very low	138 Å²	138	127.3 Å²	127.3	85%	0.847	79%	0.789	S	S	*	*				-168.4	143.9	117.5	21.9	0	0	0	0	116
7	N	36	Very low	38	Very low	158 Å²	158	126.2 Å²	126.2	85%	0.845	79%	0.787	S	S	*	*			trans	-53	158.6	174.2	-52.4	-44.7	0	0	0	117
8	G	31.3	Very low	38	Very low	79 Å²	79	127.3 Å²	127.3	81%	0.814	79%	0.792	S	S	*	*				140.4	140.8	116.4	0	0	0	0	0	118.7
9	G	33.4	Very low	38	Very low	86 Å²	86	125.8 Å²	125.8	89%	0.887	79%	0.787	S	S	*	*			trans	108.6	107.8	154.5	0	0	0	0	0	117.6
10	R	45.3	Very low	37.9	Very low	206 Å²	206	124.8 Å²	124.8	78%	0.777	78%	0.784	S	S	*	*			trans	-133.8	136.6	159.2	-173	-162	176.6	-127.2	-6.8	109.4
11	P	40.9	Very low	37.6	Very low	110 Å²	110	124.5 Å²	124.5	71%	0.714	78%	0.782	S	S	*	*			trans	-140.9	-173.4	138.6	37.4	-22.3	0	0	0	111.6
12	P	42.5	Very low	37.5	Very low	109 Å²	109	120.1 Å²	120.1	71%	0.708	77%	0.768	S	S	*	*			cis	-120.1	-156.2	-49.5	35	-19.7	0	0	0	110.7
13	A	44.4	Very low	37.3	Very low	82 Å²	82	119.3 Å²	119.3	68%	0.678	77%	0.772	S	S	*	*			trans	-155.4	151.2	168.3	0	0	0	0	0	111.5
14	P	42.3	Very low	37.2	Very low	120 Å²	120	118.2 Å²	118.2	78%	0.779	77%	0.774	S	S	*	*			trans	-117.9	-178.7	174.6	44.9	-34.3	0	0	0	112.4
15	P	43	Very low	37.2	Very low	132 Å²	132	120.3 Å²	120.3	86%	0.857	78%	0.784	S	S	*	*				-128.5	-167.4	-75.1	37.7	-19.5	0	0	0	112.9
16	S	41	Very low	37.1	Very low	119 Å²	119	118.9 Å²	118.9	83%	0.832	78%	0.781	S	S	*	*			trans	-134.9	156.6	-167	59.4	0	0	0	0	114.9
17	S	43.8	Very low	36.9	Very low	108 Å²	108	114.1 Å²	114.1	76%	0.755	76%	0.76	S	S	*	*			trans	-150.9	123.4	165.5	58.2	0	0	0	0	114.4
18	V	38.8	Very low	36.9	Very low	146 Å²	146	110.5 Å²	110.5	89%	0.885	74%	0.741	S	S	*	*			trans	6.1	157.8	149.5	-63	0	0	0	0	121.3
19	S	37.9	Very low	36.9	Very low	100 Å²	100	113.7 Å²	113.7	70%	0.699	73%	0.732	S	S	*	*			cis	-157.3	148.5	29.8	58.1	0	0	0	0	116.4
20	S	35.5	Very low	36.8	Very low	104 Å²	104	112.8 Å²	112.8	73%	0.727	72%	0.723	S	S	*	*			trans	19.4	160.1	138.4	73.1	0	0	0	0	122.9
21	T	32.9	Very low	36.2	Very low	120 Å²	120	109.8 Å²	109.8	74%	0.736	73%	0.728	S	S	*	*			cis	-157.9	165.1	17.1	-21.8	0	0	0	0	112.4
22	T	29.9	Very low	35.9	Very low	130 Å²	130	115.5 Å²	115.5	80%	0.798	74%	0.735	S	S	*	*			trans	-21.1	140.9	164.8	53.6	0	0	0	0	120.5
23	A	32.7	Very low	35.3	Very low	105 Å²	105	121.2 Å²	121.2	87%	0.868	74%	0.743	S	S	*	*				-169.1	157.3	123.7	0	0	0	0	0	112.9
24	S	29	Very low	34.5	Very low	106 Å²	106	128.5 Å²	128.5	74%	0.741	75%	0.753	S	S	*	*			trans	-89	160.5	177.6	55.8	0	0	0	0	113.7
25	T	31.2	Very low	34	Very low	129 Å²	129	129.5 Å²	129.5	79%	0.791	75%	0.75	S	S	*	*				155.5	135	121	-70.9	0	0	0	0	113.5
26	T	31.8	Very low	33.5	Very low	109 Å²	109	129 Å²	129	67%	0.669	75%	0.745	S	S	*	*			trans	-53.2	154.6	-172.2	48.3	0	0	0	0	120.7	Q1083	T26-Q1083 PolarHBondContact O-NE2 2.91Å; T26-Q1083 PolarHBondContact O-OE1 2.94Å
27	G	31.4	Very low	32.8	Very low	39 Å²	39	130.7 Å²	130.7	40%	0.402	75%	0.745	S	S	.	*			trans	132	117.5	133.2	0	0	0	0	0	116.2	Q1083	G27-Q1083 VanDerWaalsContact CA-NE2 3.34Å; G27-Q1083 PolarHBondContact O-NE2 2.76Å; G27-Q1083 VanDerWaalsContact O-NE2 3.12Å
28	N	37	Very low	32.2	Very low	82 Å²	82	136 Å²	136	44%	0.439	75%	0.748	S	S	.	*				69	120.2	91.4	-94.9	62.5	0	0	0	113.1	Q1083	N28-Q1083 HydrophobicContact CB-CB 4.43Å; N28-Q1083 HydrophobicContact CB-CG 4.11Å; N28-Q1083 WeakPolarHBondContact O-CG 3.32Å; N28-Q1083 PolarHBondContact O-N 3.19Å; N28-Q1083 VanDerWaalsContact O-N 3.08Å
29	F	30.6	Very low	32.2	Very low	145 Å²	145	137.1 Å²	137.1	64%	0.636	75%	0.747	S	S	*	*			cis	-148.6	160.7	41.9	-108.4	-99.7	0	0	0	114.2	V1084	F29-V1084 VanDerWaalsContact CE2-N 3.35Å
30	G	30.5	Very low	31.8	Very low	67 Å²	67	142.3 Å²	142.3	69%	0.691	76%	0.757	S	S	*	*			trans	72.7	140.7	155.2	0	0	0	0	0	118
31	T	34.1	Very low	31.5	Very low	143 Å²	143	144.5 Å²	144.5	88%	0.877	75%	0.754	S	S	*	*			cis	-148	138	-8.8	-65.8	0	0	0	0	109
32	R	33.6	Very low	31.4	Very low	231 Å²	231	146.3 Å²	146.3	87%	0.872	76%	0.764	S	S	*	*			trans	-78.7	139.2	178.5	-67.1	174.3	168.4	-176.4	-5.1	112.1
33	R	29.1	Very low	31.5	Very low	229 Å²	229	146.2 Å²	146.2	86%	0.864	76%	0.759	S	S	*	*				150.8	159.3	128.4	-84.2	170.7	169.9	169.5	-2.5	112.5
34	R	28.9	Very low	31.4	Very low	235 Å²	235	148.9 Å²	148.9	89%	0.887	75%	0.753	S	S	*	*			trans	73.5	95.9	172.2	-59.8	178	175.5	162.9	-2	117.4
35	L	31.6	Very low	31.5	Very low	140 Å²	140	151.9 Å²	151.9	73%	0.733	76%	0.76	S	S	*	*			trans	-136.3	45.3	137.9	-157.9	75.1	0	0	0	111.3
36	V	31.4	Very low	31.8	Very low	122 Å²	122	154.6 Å²	154.6	74%	0.739	76%	0.764	S	S	*	*	S	Bend	trans	-122.3	139.1	158.6	-176.6	0	0	0	0	104.8
37	N	28.2	Very low	31.8	Very low	155 Å²	155	155 Å²	155	83%	0.829	77%	0.768	S	S	*	*			trans	83.7	96.1	-157.7	-56.4	-5.3	0	0	0	114
38	R	31.2	Very low	31.7	Very low	219 Å²	219	158 Å²	158	83%	0.826	79%	0.789	S	S	*	*			trans	-147.2	27.9	168	-139.9	179.4	-160.7	177.9	6.3	115.6
39	I	37.2	Very low	31.3	Very low	169 Å²	169	162 Å²	162	87%	0.867	81%	0.805	S	S	*	*	S	Bend	trans	-131.8	71	171.2	-49.2	179	0	0	0	109.1
40	K	30.5	Very low	31.3	Very low	209 Å²	209	162.4 Å²	162.4	91%	0.909	81%	0.809	S	S	*	*	S	Bend	trans	-171	56	169.5	-110.4	159.8	-174.3	171	0	112.3
41	K	28.5	Very low	31.2	Very low	151 Å²	151	165.9 Å²	165.9	66%	0.657	81%	0.812	S	S	*	*			trans	179.2	114.5	155.6	-111.1	-165.1	168.5	-126.7	0	108.6	D43 E44	K41-D43 PolarHBondContact NZ-O 3.46Å; K41-E44 IonicContact NZ-OE2 2.97Å
42	V	31.8	Very low	30.9	Very low	157 Å²	157	165 Å²	165	95%	0.952	81%	0.809	S	S	*	*			trans	-127.8	64.5	157.5	-175	0	0	0	0	105.6
43	D	31.5	Very low	30.7	Very low	128 Å²	128	160.1 Å²	160.1	68%	0.684	80%	0.804	S	S	*	*	S	Bend	trans	-154	129.6	178.6	-125.9	-25.5	0	0	0	107.6	K41	K41-D43 PolarHBondContact NZ-O 3.46Å
44	E	30.6	Very low	30.7	Very low	161 Å²	161	158.3 Å²	158.3	75%	0.752	81%	0.808	S	S	*	*			trans	54.2	99.7	-174.7	-57.4	179.2	123.2	0	0	116.5	K41	K41-E44 IonicContact NZ-OE2 2.97Å
45	L	30	Very low	30.8	Very low	169 Å²	169	150.4 Å²	150.4	89%	0.885	80%	0.8	S	S	*	*			trans	-172	89.6	137.8	-106	173	0	0	0	111.3
46	H	37.8	Very low	31.2	Very low	187 Å²	187	149 Å²	149	87%	0.866	80%	0.802	S	S	*	*			trans	-136.7	123.8	157.8	-117.2	-104.2	0	0	0	106.8
47	P	31.6	Very low	32	Very low	116 Å²	116	147.7 Å²	147.7	75%	0.753	79%	0.787	S	S	*	*			trans	-73.5	147.3	-175.9	30.4	-34.7	0	0	0	111.3	Q49	P47-Q49 PolarHBondContact O-N 2.92Å
48	A	29.9	Very low	33.4	Very low	104 Å²	104	147.9 Å²	147.9	86%	0.86	78%	0.776	S	S	*	*			trans	-83.8	102.9	178.6	0	0	0	0	0	111.3
49	Q	29.4	Very low	34.9	Very low	166 Å²	166	138.5 Å²	138.5	78%	0.776	74%	0.743	S	S	*	*			trans	-151.1	116.4	156.8	-116	-172.3	-63.2	0	0	112.9	P47	P47-Q49 PolarHBondContact O-N 2.92Å
50	E	29.4	Very low	36.7	Very low	152 Å²	152	132.9 Å²	132.9	71%	0.71	72%	0.719	S	S	*	*			trans	44.9	91.3	137.1	-60.4	172.7	138.8	0	0	119.7
51	N	28.4	Very low	38.7	Very low	141 Å²	141	130.4 Å²	130.4	75%	0.754	71%	0.71	S	S	*	*				-173.7	131.2	105.6	-102.6	-67.1	0	0	0	112.9	T53	N51-T53 PolarHBondContact O-N 3.21Å
52	P	27.3	Very low	41	Very low	125 Å²	125	129.1 Å²	129.1	81%	0.812	71%	0.706	S	S	*	*			trans	-83	74.3	-177.5	34.7	-35.9	0	0	0	112.6
53	T	29.4	Very low	43.1	Very low	127 Å²	127	122.1 Å²	122.1	78%	0.779	66%	0.663	S	S	*	*			trans	-84.8	109.7	167.5	40.8	0	0	0	0	110.3	N51	N51-T53 PolarHBondContact O-N 3.21Å
54	M	29.4	Very low	45.4	Very low	192 Å²	192	121.2 Å²	121.2	95%	0.946	65%	0.65	S	S	*	*			trans	-63	138.2	176.3	-57.6	-176.3	-165.4	0	0	110.6
55	G	30.7	Very low	47.9	Very low	69 Å²	69	116.5 Å²	116.5	71%	0.711	64%	0.635	S	S	*	*	S	Bend	trans	166.9	-22.6	167.2	0	0	0	0	0	118.4
56	S	40.6	Very low	50.3	Low	110 Å²	110	111.6 Å²	111.6	77%	0.769	61%	0.605	S	S	*	*	S	Bend	trans	-123.8	-1.6	-161.3	56.8	0	0	0	0	117.3
57	H	49.5	Very low	52.3	Low	95 Å²	95	103 Å²	103	44%	0.44	57%	0.565	S	S	.	*			trans	-133.5	101	-176	-156.4	-102.9	0	0	0	114.8	L59 R64	H57-L59 PolarHBondContact CE1-O 3.45Å; H57-L59 PolarHBondContact ND1-O 3.08Å; H57-R64 PolarHBondContact CD2-NH2 3.08Å; H57-R64 VanDerWaalsContact CD2-NH2 3.26Å; H57-R64 PolarHBondContact CE1-NE 2.89Å; H57-R64 PolarHBondContact CE1-NH2 2.87Å; H57-R64 VanDerWaalsContact NE2-CZ 3.34Å; H57-R64 PolarHBondContact NE2-NE 3.41Å; H57-R64 PolarHBondContact NE2-NH2 2.96Å
58	W	56.6	Low	54.6	Low	158 Å²	158	102.4 Å²	102.4	60%	0.598	55%	0.553	S	S	*	*			trans	-92	-9.6	-174.3	-67.1	92.8	0	0	0	115.1
59	L	63.7	Low	57.1	Low	23 Å²	23	98.2 Å²	98.2	12%	0.12	52%	0.518	C	S	.	.	S	Bend	trans	-95.1	142.3	175.3	-62.7	165.1	0	0	0	109.5	H57 E63 R64 L67 V438	H57-L59 PolarHBondContact CE1-O 3.45Å; H57-L59 PolarHBondContact ND1-O 3.08Å; L59-E63 HydrophobicContact CB-CB 4.26Å; L59-E63 HydrophobicContact CD2-CB 3.95Å; L59-R64 HydrophobicContact CB-CG 4.38Å; L59-R64 HydrophobicContact CD1-CG 4.36Å; L59-L67 HydrophobicContact CD1-CD1 3.61Å; L59-L67 HydrophobicContact CD2-CD1 3.94Å; L59-L67 HydrophobicContact CG-CD1 4.45Å; L59-V438 HydrophobicContact CD2-CG2 4.22Å
60	S	74.1	Confident	59.4	Low	51 Å²	51	90.4 Å²	90.4	36%	0.357	48%	0.482	S	S	.	.			trans	-69.9	160.1	158	62.8	0	0	0	0	110.6	Q62 E63 R64	S60-Q62 PolarHBondContact O-N 2.69Å; S60-E63 WeakPolarHBondContact CB-OE2 3.35Å; S60-E63 PolarHBondContact N-OE2 2.99Å; S60-E63 PolarHBondContact O-N 3.07Å; S60-E63 WeakPolarHBondContact OG-CG 3.15Å; S60-E63 PolarHBondContact OG-N 3.12Å; S60-E63 PolarHBondContact OG-OE2 2.86Å; S60-R64 PolarHBondContact O-N 3.05Å
61	E	73.4	Confident	61.7	Low	157 Å²	157	84.8 Å²	84.8	73%	0.734	46%	0.455	S	S	*	.	H	α-helix	trans	-59.8	-34	172.5	-60.4	-173.5	141.5	0	0	111.7	E63 R64 S65	E61-E63 VanDerWaalsContact C-N 3.25Å; E61-E63 PolarHBondContact O-N 2.68Å; E61-R64 PolarHBondContact O-N 3.09Å; E61-S65 WeakPolarHBondContact O-CB 3.47Å; E61-S65 PolarHBondContact O-N 3.32Å
62	Q	76.4	Confident	64.1	Low	123 Å²	123	82.5 Å²	82.5	58%	0.575	44%	0.44	S	S	*	.	H	α-helix	trans	-62	-32.7	173.4	-176.9	58.7	95.7	0	0	112.2	S60 R66	S60-Q62 PolarHBondContact O-N 2.69Å; Q62-R66 VanDerWaalsContact O-CG 3.26Å; Q62-R66 WeakPolarHBondContact O-CG 3.03Å; Q62-R66 PolarHBondContact O-N 3.24Å; Q62-R66 VanDerWaalsContact O-N 3.13Å
63	E	75.5	Confident	66.2	Low	11 Å²	11	79.1 Å²	79.1	5%	0.051	42%	0.415	C	S	.	.	H	α-helix	trans	-82.3	-33.3	176.4	-72.2	151.5	158.2	0	0	113.2	L59 S60 E61 R66 L67 N435 V438	L59-E63 HydrophobicContact CB-CB 4.26Å; L59-E63 HydrophobicContact CD2-CB 3.95Å; S60-E63 WeakPolarHBondContact CB-OE2 3.35Å; S60-E63 PolarHBondContact N-OE2 2.99Å; S60-E63 PolarHBondContact O-N 3.07Å; S60-E63 WeakPolarHBondContact OG-CG 3.15Å; S60-E63 PolarHBondContact OG-N 3.12Å; S60-E63 PolarHBondContact OG-OE2 2.86Å; E61-E63 VanDerWaalsContact C-N 3.25Å; E61-E63 PolarHBondContact O-N 2.68Å; E63-R66 WeakPolarHBondContact O-CB 3.48Å; E63-R66 PolarHBondContact O-N 2.66Å; E63-L67 WeakPolarHBondContact O-CG 3.26Å; E63-L67 PolarHBondContact O-N 2.78Å; E63-N435 WeakPolarHBondContact OE1-CB 3.47Å; E63-N435 VanDerWaalsContact OE1-CG 3.26Å; E63-N435 PolarHBondContact OE1-ND2 2.94Å; E63-V438 HydrophobicContact CG-CG2 4.29Å; E63-V438 VanDerWaalsContact OE1-CG2 3.29Å; E63-V438 WeakPolarHBondContact OE1-CG2 3.34Å
64	R	80.3	Confident	67.9	Low	109 Å²	109	75.1 Å²	75.1	41%	0.411	39%	0.386	S	S	.	.	H	α-helix	trans	-55.7	-53.2	165.5	-74.1	-174.5	174.9	171.9	1.2	110.7	H57 L59 S60 E61 R66 L67 E68	H57-R64 PolarHBondContact CD2-NH2 3.08Å; H57-R64 VanDerWaalsContact CD2-NH2 3.26Å; H57-R64 PolarHBondContact CE1-NE 2.89Å; H57-R64 PolarHBondContact CE1-NH2 2.87Å; H57-R64 VanDerWaalsContact NE2-CZ 3.34Å; H57-R64 PolarHBondContact NE2-NE 3.41Å; H57-R64 PolarHBondContact NE2-NH2 2.96Å; L59-R64 HydrophobicContact CB-CG 4.38Å; L59-R64 HydrophobicContact CD1-CG 4.36Å; S60-R64 PolarHBondContact O-N 3.05Å; E61-R64 PolarHBondContact O-N 3.09Å; R64-R66 PolarHBondContact O-N 2.91Å; R64-L67 PolarHBondContact O-N 2.79Å; R64-E68 WeakPolarHBondContact O-CG 3.47Å; R64-E68 PolarHBondContact O-N 3.25Å
65	S	82.8	Confident	69.8	Low	62 Å²	62	71.9 Å²	71.9	43%	0.434	36%	0.363	S	S	.	.	H	α-helix	trans	-58	-36.8	178.7	-179	0	0	0	0	112.2	E61 A69	E61-S65 WeakPolarHBondContact O-CB 3.47Å; E61-S65 PolarHBondContact O-N 3.32Å; S65-A69 WeakPolarHBondContact O-CB 3.32Å; S65-A69 PolarHBondContact O-N 3.17Å
66	R	80.3	Confident	71.5	Confident	66 Å²	66	77.8 Å²	77.8	25%	0.249	36%	0.364	C	S	.	.	H	α-helix	trans	-63.4	-48.1	171.1	-77.4	176	173.9	-152.2	1.6	112.4	Q62 E63 R64 A69 V70 Y427 F431 R433	Q62-R66 VanDerWaalsContact O-CG 3.26Å; Q62-R66 WeakPolarHBondContact O-CG 3.03Å; Q62-R66 PolarHBondContact O-N 3.24Å; Q62-R66 VanDerWaalsContact O-N 3.13Å; E63-R66 WeakPolarHBondContact O-CB 3.48Å; E63-R66 PolarHBondContact O-N 2.66Å; R64-R66 PolarHBondContact O-N 2.91Å; R66-A69 WeakPolarHBondContact O-CB 3.3Å; R66-A69 PolarHBondContact O-N 3.12Å; R66-V70 PolarHBondContact O-N 2.7Å; R66-Y427 HydrophobicContact CB-CE2 4.29Å; R66-F431 VanDerWaalsContact CA-CZ 3.5Å; R66-F431 HydrophobicContact CB-CD2 4.03Å; R66-F431 HydrophobicContact CB-CE1 4.15Å; R66-F431 HydrophobicContact CB-CE2 3.48Å; R66-F431 VanDerWaalsContact CB-CE2 3.48Å; R66-F431 HydrophobicContact CB-CZ 3.57Å; R66-F431 HydrophobicContact CG-CD1 3.98Å; R66-F431 HydrophobicContact CG-CD2 4.23Å; R66-F431 HydrophobicContact CG-CE1 3.68Å; R66-F431 HydrophobicContact CG-CE2 3.92Å; R66-F431 HydrophobicContact CG-CG 4.25Å; R66-F431 HydrophobicContact CG-CZ 3.65Å; R66-F431 WeakPolarHBondContact O-CE2 3.43Å; R66-F431 VanDerWaalsContact O-CZ 3.31Å; R66-F431 WeakPolarHBondContact O-CZ 3.39Å; R66-R433 PolarHBondContact NH1-O 2.66Å
67	L	78.6	Confident	72.5	Confident	5 Å²	5	76.5 Å²	76.5	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-44.7	179.1	-73.1	168.9	0	0	0	112.3	L59 E63 R64 A69 V70 Q71 Y427 W442 I472	L59-L67 HydrophobicContact CD1-CD1 3.61Å; L59-L67 HydrophobicContact CD2-CD1 3.94Å; L59-L67 HydrophobicContact CG-CD1 4.45Å; E63-L67 WeakPolarHBondContact O-CG 3.26Å; E63-L67 PolarHBondContact O-N 2.78Å; R64-L67 PolarHBondContact O-N 2.79Å; L67-A69 VanDerWaalsContact C-N 3.29Å; L67-A69 PolarHBondContact O-N 3.47Å; L67-V70 PolarHBondContact O-N 3.24Å; L67-Q71 WeakPolarHBondContact O-CB 3.34Å; L67-Q71 PolarHBondContact O-N 2.8Å; L67-Y427 HydrophobicContact CD2-CD2 3.96Å; L67-Y427 HydrophobicContact CD2-CE2 3.77Å; L67-Y427 HydrophobicContact CG-CE2 4.24Å; L67-W442 HydrophobicContact CD2-CZ2 4.4Å; L67-I472 HydrophobicContact CD2-CD1 4.42Å; L67-I472 HydrophobicContact CD2-CG2 3.73Å
68	E	81.9	Confident	72.7	Confident	105 Å²	105	74.1 Å²	74.1	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-56.8	-43.7	172.2	-72.9	167.3	-159.9	0	0	111.5	R64 Q71 Q72	R64-E68 WeakPolarHBondContact O-CG 3.47Å; R64-E68 PolarHBondContact O-N 3.25Å; E68-Q71 CarbonylContact O-C 3.55Å; E68-Q71 WeakPolarHBondContact O-CB 3.5Å; E68-Q71 PolarHBondContact O-N 2.83Å; E68-Q71 VanDerWaalsContact O-N 3.16Å; E68-Q72 WeakPolarHBondContact O-CG 3.29Å; E68-Q72 PolarHBondContact O-N 3.03Å
69	A	80.8	Confident	71.9	Confident	16 Å²	16	69.9 Å²	69.9	13%	0.132	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-43	177.7	0	0	0	0	0	112.2	S65 R66 L67 Q71 Q72 D73 R430 F431	S65-A69 WeakPolarHBondContact O-CB 3.32Å; S65-A69 PolarHBondContact O-N 3.17Å; R66-A69 WeakPolarHBondContact O-CB 3.3Å; R66-A69 PolarHBondContact O-N 3.12Å; L67-A69 VanDerWaalsContact C-N 3.29Å; L67-A69 PolarHBondContact O-N 3.47Å; A69-Q71 VanDerWaalsContact C-N 3.32Å; A69-Q71 PolarHBondContact O-N 2.84Å; A69-Q72 PolarHBondContact O-N 3.49Å; A69-D73 PolarHBondContact O-N 2.85Å; A69-R430 PolarHBondContact O-NH1 2.98Å; A69-F431 HydrophobicContact CB-CZ 4.18Å
70	V	77.7	Confident	70.7	Confident	2 Å²	2	76.6 Å²	76.6	1%	0.012	36%	0.364	C	S	.	.	H	α-helix	trans	-60	-42.3	169.9	160.1	0	0	0	0	111.1	R66 L67 Q72 D73 W74 M426 Y427 R430 F431	R66-V70 PolarHBondContact O-N 2.7Å; L67-V70 PolarHBondContact O-N 3.24Å; V70-Q72 VanDerWaalsContact C-N 3.33Å; V70-Q72 PolarHBondContact O-N 2.94Å; V70-D73 PolarHBondContact O-N 3.24Å; V70-W74 VanDerWaalsContact O-CB 3.25Å; V70-W74 WeakPolarHBondContact O-CB 3.32Å; V70-W74 PolarHBondContact O-N 2.99Å; V70-M426 HydrophobicContact CG1-CG 4.47Å; V70-Y427 HydrophobicContact CG2-CD2 3.98Å; V70-Y427 HydrophobicContact CG2-CG 4.48Å; V70-R430 HydrophobicContact CG2-CB 4.18Å; V70-F431 HydrophobicContact CG2-CD2 4.11Å; V70-F431 HydrophobicContact CG2-CE2 3.5Å; V70-F431 HydrophobicContact CG2-CZ 4.36Å
71	Q	78.2	Confident	68.7	Low	33 Å²	33	81.2 Å²	81.2	15%	0.154	38%	0.378	C	S	.	.	H	α-helix	trans	-63.6	-37.1	177.3	-156.7	-172.1	65.8	0	0	112.1	L67 E68 A69 R75 S421	L67-Q71 WeakPolarHBondContact O-CB 3.34Å; L67-Q71 PolarHBondContact O-N 2.8Å; E68-Q71 CarbonylContact O-C 3.55Å; E68-Q71 WeakPolarHBondContact O-CB 3.5Å; E68-Q71 PolarHBondContact O-N 2.83Å; E68-Q71 VanDerWaalsContact O-N 3.16Å; A69-Q71 VanDerWaalsContact C-N 3.32Å; A69-Q71 PolarHBondContact O-N 2.84Å; Q71-R75 VanDerWaalsContact CD-NH2 3.32Å; Q71-R75 WeakPolarHBondContact O-CB 2.98Å; Q71-R75 VanDerWaalsContact O-CG 3.25Å; Q71-R75 WeakPolarHBondContact O-CG 2.9Å; Q71-R75 PolarHBondContact O-N 3.16Å; Q71-S421 PolarHBondContact NE2-OG 2.82Å
72	Q	78	Confident	66.7	Low	94 Å²	94	82.3 Å²	82.3	44%	0.439	38%	0.38	S	S	.	.	H	α-helix	trans	-66.1	-42.2	173.7	-72.7	178.2	17.5	0	0	112.5	E68 A69 V70 R75 R76	E68-Q72 WeakPolarHBondContact O-CG 3.29Å; E68-Q72 PolarHBondContact O-N 3.03Å; A69-Q72 PolarHBondContact O-N 3.49Å; V70-Q72 VanDerWaalsContact C-N 3.33Å; V70-Q72 PolarHBondContact O-N 2.94Å; Q72-R75 WeakPolarHBondContact O-CB 2.94Å; Q72-R75 PolarHBondContact O-N 2.98Å; Q72-R76 VanDerWaalsContact O-CG 3.27Å; Q72-R76 WeakPolarHBondContact O-CG 3.41Å; Q72-R76 PolarHBondContact O-N 3.22Å
73	D	73	Confident	64.4	Low	54 Å²	54	85.4 Å²	85.4	29%	0.289	40%	0.395	S	S	.	.	H	α-helix	trans	-76.1	-34.8	179.8	-176.4	59.9	0	0	0	112.5	A69 V70 R75 R76 T77	A69-D73 PolarHBondContact O-N 2.85Å; V70-D73 PolarHBondContact O-N 3.24Å; D73-R75 VanDerWaalsContact C-N 3.3Å; D73-R75 PolarHBondContact O-N 3.45Å; D73-R76 CarbonylContact O-C 3.57Å; D73-R76 PolarHBondContact O-N 2.95Å; D73-T77 WeakPolarHBondContact O-CB 3.29Å; D73-T77 WeakPolarHBondContact O-CG2 3.47Å; D73-T77 PolarHBondContact O-N 2.8Å; D73-T77 PolarHBondContact O-OG1 3.41Å
74	W	65.2	Low	62.2	Low	42 Å²	42	94.6 Å²	94.6	16%	0.159	43%	0.429	C	S	.	.	H	α-helix	trans	-60	-39.5	167.7	-177.1	89.3	0	0	0	111.6	V70 R76 R78 M419 T420	V70-W74 VanDerWaalsContact O-CB 3.25Å; V70-W74 WeakPolarHBondContact O-CB 3.32Å; V70-W74 PolarHBondContact O-N 2.99Å; W74-R76 VanDerWaalsContact C-N 3.34Å; W74-R76 PolarHBondContact O-N 3.29Å; W74-R78 VanDerWaalsContact CZ2-NE 3.31Å; W74-R78 WeakPolarHBondContact O-CD 3.38Å; W74-R78 VanDerWaalsContact O-CG 3.29Å; W74-R78 WeakPolarHBondContact O-CG 3.49Å; W74-R78 PolarHBondContact O-N 3.22Å; W74-M419 VanDerWaalsContact CZ2-O 3.22Å; W74-M419 WeakPolarHBondContact CZ2-O 3.44Å; W74-T420 VanDerWaalsContact CH2-CA 3.41Å; W74-T420 HydrophobicContact CH2-CG2 4.32Å; W74-T420 WeakPolarHBondContact CZ3-O 3.2Å
75	R	69.1	Low	59.6	Low	125 Å²	125	96 Å²	96	47%	0.472	45%	0.45	S	S	.	.	H	α-helix	trans	-64.8	-30.8	170.2	-76.2	176.5	-175.3	115.7	-0.5	113.7	Q71 Q72 D73	Q71-R75 VanDerWaalsContact CD-NH2 3.32Å; Q71-R75 WeakPolarHBondContact O-CB 2.98Å; Q71-R75 VanDerWaalsContact O-CG 3.25Å; Q71-R75 WeakPolarHBondContact O-CG 2.9Å; Q71-R75 PolarHBondContact O-N 3.16Å; Q72-R75 WeakPolarHBondContact O-CB 2.94Å; Q72-R75 PolarHBondContact O-N 2.98Å; D73-R75 VanDerWaalsContact C-N 3.3Å; D73-R75 PolarHBondContact O-N 3.45Å
76	R	66.9	Low	57.2	Low	193 Å²	193	98.2 Å²	98.2	73%	0.728	47%	0.465	S	S	*	.	H	α-helix	trans	-86.6	-30.1	-179.3	-72.5	171	-177.5	-157.2	1.9	114.3	Q72 D73 W74	Q72-R76 VanDerWaalsContact O-CG 3.27Å; Q72-R76 WeakPolarHBondContact O-CG 3.41Å; Q72-R76 PolarHBondContact O-N 3.22Å; D73-R76 CarbonylContact O-C 3.57Å; D73-R76 PolarHBondContact O-N 2.95Å; W74-R76 VanDerWaalsContact C-N 3.34Å; W74-R76 PolarHBondContact O-N 3.29Å
77	T	60.2	Low	54.8	Low	83 Å²	83	104 Å²	104	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-88.9	-15.4	-178.5	51.1	0	0	0	0	112.9	D73	D73-T77 WeakPolarHBondContact O-CB 3.29Å; D73-T77 WeakPolarHBondContact O-CG2 3.47Å; D73-T77 PolarHBondContact O-N 2.8Å; D73-T77 PolarHBondContact O-OG1 3.41Å
78	R	54.3	Low	52.4	Low	45 Å²	45	113 Å²	113	17%	0.17	53%	0.532	C	S	.	.	S	Bend	trans	-52.9	138.4	161.7	-88	163.9	153.1	-103	-7	111	W74 M80 E338	W74-R78 VanDerWaalsContact CZ2-NE 3.31Å; W74-R78 WeakPolarHBondContact O-CD 3.38Å; W74-R78 VanDerWaalsContact O-CG 3.29Å; W74-R78 WeakPolarHBondContact O-CG 3.49Å; W74-R78 PolarHBondContact O-N 3.22Å; R78-M80 PolarHBondContact O-N 3.42Å; R78-E338 IonicContact CZ-OE1 3.49Å; R78-E338 IonicContact NH1-OE1 2.76Å; R78-E338 PolarHBondContact NH1-OE1 3.42Å
79	P	39.3	Very low	49.9	Very low	69 Å²	69	119 Å²	119	45%	0.448	55%	0.55	S	S	.	.			trans	-74.1	84.5	-177.8	31.3	-35.8	0	0	0	111.7	K81 E339	P79-K81 PolarHBondContact O-N 3Å; P79-E339 VanDerWaalsContact CG-O 3.32Å; P79-E339 WeakPolarHBondContact CG-O 3.49Å
80	M	38.4	Very low	47.6	Very low	163 Å²	163	122.9 Å²	122.9	80%	0.803	57%	0.574	S	S	*	*			trans	-64.6	74.6	170.6	-78.8	-74	-173.3	0	0	111.6	R78 F82	R78-M80 PolarHBondContact O-N 3.42Å; M80-F82 PolarHBondContact O-N 3.36Å
81	K	32.6	Very low	45.5	Very low	149 Å²	149	130 Å²	130	65%	0.648	61%	0.611	S	S	*	*			trans	-78.1	47	179.1	-74.3	179	-179.9	161.2	0	113.5	P79 E339	P79-K81 PolarHBondContact O-N 3Å; K81-E339 IonicContact NZ-OE2 3.74Å; K81-E339 PolarHBondContact NZ-OE2 2.97Å
82	F	30.6	Very low	43.3	Very low	179 Å²	179	135.8 Å²	135.8	79%	0.785	64%	0.644	S	S	*	*			trans	-147.4	88.4	162.1	-97.6	-71.3	0	0	0	111.8	M80	M80-F82 PolarHBondContact O-N 3.36Å
83	Q	28.1	Very low	41.3	Very low	189 Å²	189	136.2 Å²	136.2	88%	0.883	65%	0.654	S	S	*	*			trans	-122.6	135.8	153.2	-85.6	-168	-27.1	0	0	108.6
84	W	29.2	Very low	39.4	Very low	203 Å²	203	140.2 Å²	140.2	77%	0.769	68%	0.681	S	S	*	*			trans	-66.4	147	-167.9	-75.9	10	0	0	0	114.5
85	T	27.4	Very low	37.7	Very low	139 Å²	139	144.2 Å²	144.2	85%	0.853	71%	0.71	S	S	*	*			trans	-131.1	52	158.5	58.6	0	0	0	0	111.9
86	S	32.5	Very low	35.8	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	73%	0.726	S	S	*	*			trans	-69	141.3	164.3	-76.1	0	0	0	0	110.4
87	K	28.3	Very low	34.1	Very low	188 Å²	188	139.4 Å²	139.4	82%	0.817	73%	0.725	S	S	*	*			trans	-128.1	146.3	-157.3	-171	173.4	-175.7	172	0	111.9
88	K	28.2	Very low	33	Very low	195 Å²	195	140.7 Å²	140.7	85%	0.848	74%	0.735	S	S	*	*			trans	86.3	145.9	-175.3	-55.6	163.4	-176.1	174.2	0	112.8
89	R	29.8	Very low	31.7	Very low	230 Å²	230	143.3 Å²	143.3	87%	0.868	76%	0.76	S	S	*	*			cis	-148.9	165.5	-1.2	-121.8	175.4	-173.7	179.2	0.4	108.2
90	P	32.6	Very low	31.1	Very low	98 Å²	98	146.1 Å²	146.1	64%	0.636	78%	0.776	S	S	*	*			trans	-95	164.7	-172.8	39.3	-35.5	0	0	0	114.7
91	D	33.6	Very low	30.5	Very low	151 Å²	151	143.9 Å²	143.9	81%	0.807	77%	0.771	S	S	*	*			trans	63.6	147.4	163.6	-41.2	-38.4	0	0	0	117
92	D	32.6	Very low	30.1	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	78%	0.775	S	S	*	*			cis	-144.4	161.8	19.5	-151.9	21.5	0	0	0	110.4
93	P	36.4	Very low	30	Very low	102 Å²	102	140.5 Å²	140.5	66%	0.662	78%	0.775	S	S	*	*			trans	-112.2	156.6	-166	39.9	-32.8	0	0	0	117
94	T	31.4	Very low	29.9	Very low	139 Å²	139	136 Å²	136	85%	0.853	76%	0.764	S	S	*	*			trans	-161.7	154.6	150.4	-1.6	0	0	0	0	115
95	T	29.7	Very low	30.1	Very low	126 Å²	126	133.5 Å²	133.5	77%	0.773	77%	0.766	S	S	*	*			trans	-23.7	156.8	164.5	45.1	0	0	0	0	120.1
96	S	30	Very low	30.4	Very low	113 Å²	113	131.2 Å²	131.2	79%	0.79	76%	0.762	S	S	*	*			cis	-169.3	157	-5.6	44.7	0	0	0	0	113.2
97	S	30.4	Very low	30.4	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	76%	0.764	S	S	*	*			trans	-83	-178.9	175.9	57	0	0	0	0	114.8
98	P	37.4	Very low	30.7	Very low	109 Å²	109	131.6 Å²	131.6	71%	0.708	76%	0.759	S	S	*	*			cis	-141.6	-177.9	-32.6	31.3	-9.2	0	0	0	115.9
99	S	26.8	Very low	31	Very low	100 Å²	100	128.8 Å²	128.8	70%	0.699	75%	0.753	S	S	*	*				117.9	132.1	122.3	85.7	0	0	0	0	122.1
100	T	26.3	Very low	31.4	Very low	129 Å²	129	123.3 Å²	123.3	79%	0.791	75%	0.75	S	S	*	*			trans	78.1	146.6	143.4	-21.2	0	0	0	0	122.1
101	V	26.3	Very low	31.7	Very low	115 Å²	115	125 Å²	125	70%	0.697	76%	0.759	S	S	*	*			trans	85.4	83.8	159.7	-163.6	0	0	0	0	120.1
102	S	25.1	Very low	32.3	Very low	103 Å²	103	123.4 Å²	123.4	72%	0.72	76%	0.756	S	S	*	*				65.2	153.5	117.8	-50.1	0	0	0	0	124.9
103	I	27.4	Very low	32.5	Very low	154 Å²	154	121.1 Å²	121.1	79%	0.79	75%	0.753	S	S	*	*			trans	85.2	80.5	153.5	-62.3	145.5	0	0	0	119.9
104	S	27.2	Very low	32.5	Very low	94 Å²	94	123 Å²	123	66%	0.657	76%	0.756	S	S	*	*			trans	31.5	117.6	131	63.5	0	0	0	0	125.4
105	N	32.7	Very low	32.8	Very low	151 Å²	151	123 Å²	123	81%	0.807	75%	0.751	S	S	*	*				60	148.6	123.9	-74.1	66.9	0	0	0	125.8
106	A	33.5	Very low	33.1	Very low	92 Å²	92	123.6 Å²	123.6	76%	0.76	75%	0.75	S	S	*	*			trans	100.3	145.4	152.9	0	0	0	0	0	116.9
107	L	34	Very low	33.4	Very low	154 Å²	154	123.7 Å²	123.7	81%	0.806	75%	0.745	S	S	*	*			cis	-152.7	-164.5	-2.3	-150.9	55.4	0	0	0	112.7
108	E	34.1	Very low	33.7	Very low	150 Å²	150	124.1 Å²	124.1	70%	0.701	75%	0.748	S	S	*	*			trans	-124.8	-174.4	-156.8	-42.5	145.6	111.1	0	0	116.6
109	N	35	Very low	33.6	Very low	136 Å²	136	124.3 Å²	124.3	73%	0.727	75%	0.752	S	S	*	*			trans	102	150.3	155.8	-52.9	-64.6	0	0	0	118.3
110	S	36.2	Very low	33.9	Very low	114 Å²	114	127 Å²	127	80%	0.797	76%	0.757	S	S	*	*			cis	-152	177.6	21.7	-45.3	0	0	0	0	115.9
111	T	40.6	Very low	34.3	Very low	135 Å²	135	125.9 Å²	125.9	83%	0.828	75%	0.75	S	S	*	*			trans	-140.2	-167.2	-176.7	59.7	0	0	0	0	112.5
112	P	46.2	Very low	34.5	Very low	117 Å²	117	127.6 Å²	127.6	76%	0.76	76%	0.755	S	S	*	*			cis	-138.2	-153.8	-5.1	45.2	-24.1	0	0	0	115
113	S	36.9	Very low	35	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	75%	0.754	S	S	*	*				155.3	149.7	122.3	-150.4	0	0	0	0	121.2
114	L	36.6	Very low	35.2	Very low	142 Å²	142	124.6 Å²	124.6	74%	0.743	75%	0.748	S	S	*	*			trans	89.1	109.5	153.6	-76.5	168.7	0	0	0	128
115	N	37.1	Very low	35.4	Very low	138 Å²	138	125.3 Å²	125.3	74%	0.738	75%	0.753	S	S	*	*			trans	39.5	147.4	136.3	-58.5	8.1	0	0	0	124.6
116	N	36.2	Very low	35.7	Very low	139 Å²	139	123.3 Å²	123.3	74%	0.743	75%	0.748	S	S	*	*			cis	-176.1	157.9	49.1	-141.9	13.5	0	0	0	116.1
117	V	36.1	Very low	35.6	Very low	114 Å²	114	128.3 Å²	128.3	69%	0.691	75%	0.753	S	S	*	*			trans	44.8	112.3	155.3	178.1	0	0	0	0	120.4
118	S	36.1	Very low	35.4	Very low	113 Å²	113	125.3 Å²	125.3	79%	0.79	75%	0.745	S	S	*	*			cis	80.2	141.6	49.5	-61.3	0	0	0	0	116.3
119	S	35	Very low	35.2	Very low	114 Å²	114	125.6 Å²	125.6	80%	0.797	75%	0.751	S	S	*	*			cis	-161.8	-125.4	-5.7	59.4	0	0	0	0	113.3
120	I	34.4	Very low	34.9	Very low	157 Å²	157	124.4 Å²	124.4	81%	0.805	75%	0.753	S	S	*	*			trans	100.4	170.2	173.2	-58.2	173.6	0	0	0	118.1
121	T	33.9	Very low	34.6	Very low	105 Å²	105	123.9 Å²	123.9	64%	0.644	75%	0.749	S	S	*	*			trans	-145.7	144.1	-137.9	57.1	0	0	0	0	120.1
122	N	31.4	Very low	34	Very low	151 Å²	151	121.9 Å²	121.9	81%	0.807	75%	0.746	S	S	*	*			trans	59.7	153	130.1	-61.4	-5.6	0	0	0	123.8
123	S	33.7	Very low	33.1	Very low	99 Å²	99	120.5 Å²	120.5	69%	0.692	75%	0.745	S	S	*	*			cis	-169.1	168	-14.2	53.5	0	0	0	0	114.3
124	S	33	Very low	32.7	Very low	95 Å²	95	121 Å²	121	66%	0.664	74%	0.744	S	S	*	*			trans	64.8	104.6	146.6	54.8	0	0	0	0	124
125	S	31.1	Very low	32.3	Very low	108 Å²	108	119.3 Å²	119.3	76%	0.755	74%	0.744	S	S	*	*				33.2	160.4	112.1	62	0	0	0	0	123.5
126	P	39.3	Very low	31.9	Very low	109 Å²	109	118.8 Å²	118.8	71%	0.708	75%	0.746	S	S	*	*			cis	-145.8	-178	-25.2	39.2	-19	0	0	0	117.4
127	F	30	Very low	31.6	Very low	198 Å²	198	116.5 Å²	116.5	87%	0.868	75%	0.746	S	S	*	*			trans	68.5	139.9	145.8	-99.7	-70.9	0	0	0	124.7
128	S	30	Very low	31.5	Very low	91 Å²	91	116.2 Å²	116.2	64%	0.636	75%	0.749	S	S	*	*			trans	101.2	103.5	142.8	-64.2	0	0	0	0	123.6
129	L	29.7	Very low	31.2	Very low	156 Å²	156	114.6 Å²	114.6	82%	0.817	74%	0.742	S	S	*	*				71.5	141	126.4	-70.3	166.8	0	0	0	124.2
130	S	30.3	Very low	31.1	Very low	111 Å²	111	117.2 Å²	117.2	78%	0.776	75%	0.746	S	S	*	*			trans	70.6	156.8	154.9	75.6	0	0	0	0	118.7
131	S	28.4	Very low	31	Very low	103 Å²	103	116.4 Å²	116.4	72%	0.72	74%	0.742	S	S	*	*			cis	-173.1	158.3	-32.7	55.2	0	0	0	0	109.9
132	A	27.8	Very low	31.2	Very low	92 Å²	92	116 Å²	116	76%	0.76	74%	0.741	S	S	*	*			trans	70.2	130.8	168.8	0	0	0	0	0	115
133	A	28.7	Very low	31.3	Very low	89 Å²	89	117.1 Å²	117.1	74%	0.736	74%	0.739	S	S	*	*				98	147	90.4	0	0	0	0	0	112.6
134	T	27.9	Very low	31.2	Very low	118 Å²	118	117.8 Å²	117.8	72%	0.724	74%	0.739	S	S	*	*			cis	-162.8	131.3	-15.2	-90.6	0	0	0	0	109
135	S	29	Very low	31.1	Very low	106 Å²	106	117.1 Å²	117.1	74%	0.741	73%	0.734	S	S	*	*			trans	57.3	-176.8	163.9	-56.3	0	0	0	0	116.2
136	T	28.6	Very low	30.9	Very low	127 Å²	127	118.9 Å²	118.9	78%	0.779	74%	0.735	S	S	*	*			cis	-154.5	145.4	5	-29.5	0	0	0	0	111.7
137	A	29.9	Very low	30.5	Very low	90 Å²	90	120.4 Å²	120.4	74%	0.744	74%	0.742	S	S	*	*			trans	59.3	167.5	158.1	0	0	0	0	0	117.9
138	S	32.6	Very low	30.4	Very low	108 Å²	108	114.3 Å²	114.3	76%	0.755	73%	0.729	S	S	*	*			cis	-132.3	143.2	-5.2	-59	0	0	0	0	107.8
139	A	29.6	Very low	30.4	Very low	80 Å²	80	115.4 Å²	115.4	66%	0.661	73%	0.732	S	S	*	*			cis	86	79.7	41.5	0	0	0	0	0	115.3
140	I	34.6	Very low	30.5	Very low	168 Å²	168	115.3 Å²	115.3	86%	0.862	73%	0.732	S	S	*	*			trans	-150.6	104.1	161.8	-56.1	-178.4	0	0	0	104.2
141	I	32.1	Very low	30.3	Very low	141 Å²	141	117.4 Å²	117.4	72%	0.723	73%	0.729	S	S	*	*			cis	53.4	146.3	30.6	45.6	175	0	0	0	116.7
142	P	38.6	Very low	30.8	Very low	97 Å²	97	118.3 Å²	118.3	63%	0.63	73%	0.732	S	S	*	*			cis	-133.9	-153	-19.7	34.8	-14.8	0	0	0	113.6
143	F	33.5	Very low	30.8	Very low	173 Å²	173	120.1 Å²	120.1	76%	0.759	73%	0.725	S	S	*	*			trans	115.8	97.2	159.7	-71.4	-76	0	0	0	115.9
144	T	31.4	Very low	31	Very low	114 Å²	114	123.3 Å²	123.3	70%	0.699	73%	0.729	S	S	*	*				76.4	150.4	86.5	58.4	0	0	0	0	115.4
145	S	29.8	Very low	30.9	Very low	81 Å²	81	123.4 Å²	123.4	57%	0.566	73%	0.725	S	S	*	*			cis	-178.7	160.7	-14.2	54.9	0	0	0	0	110.8
146	N	27.6	Very low	31.2	Very low	144 Å²	144	126 Å²	126	77%	0.77	73%	0.725	S	S	*	*			trans	67.2	168.2	148.3	-63	-12	0	0	0	119.4
147	V	30.5	Very low	31.2	Very low	141 Å²	141	127 Å²	127	86%	0.855	72%	0.721	S	S	*	*			trans	77.5	129.2	161.5	-167.9	0	0	0	0	116.6
148	A	28.6	Very low	31.3	Very low	71 Å²	71	129 Å²	129	59%	0.587	72%	0.723	S	S	*	*			cis	-170.7	169.6	-24	0	0	0	0	0	109.7
149	T	28.2	Very low	31.1	Very low	114 Å²	114	127.2 Å²	127.2	70%	0.699	71%	0.711	S	S	*	*			trans	36.9	124.1	141.4	58	0	0	0	0	119.4
150	N	31.6	Very low	31	Very low	154 Å²	154	134.2 Å²	134.2	82%	0.824	72%	0.72	S	S	*	*				-172.5	157.2	72.3	-96.3	-55.5	0	0	0	114.9
151	H	28.2	Very low	30.7	Very low	154 Å²	154	133.5 Å²	133.5	71%	0.713	72%	0.716	S	S	*	*			trans	-71.5	156.4	161.7	-85.8	-79.5	0	0	0	111.3
152	P	36.9	Very low	30.6	Very low	122 Å²	122	132 Å²	132	79%	0.792	72%	0.716	S	S	*	*				-125.2	151.1	72.6	38.3	-28.1	0	0	0	113.6
153	H	28.6	Very low	29.9	Very low	131 Å²	131	136.1 Å²	136.1	61%	0.606	73%	0.727	S	S	*	*			cis	69.1	97.9	46.4	-101.1	-74.3	0	0	0	115.6
154	L	33.1	Very low	29.6	Very low	156 Å²	156	131.9 Å²	131.9	82%	0.817	72%	0.724	S	S	*	*			trans	178.6	100.6	144.6	-97.6	153.8	0	0	0	106.5
155	N	25.9	Very low	29.2	Very low	119 Å²	119	134.1 Å²	134.1	64%	0.636	73%	0.73	S	S	*	*				46.9	103	70.4	-73	-3.3	0	0	0	114.1
156	H	34.7	Very low	29.1	Very low	161 Å²	161	136.4 Å²	136.4	75%	0.745	74%	0.74	S	S	*	*				-164	139.1	103.3	-92	-72.6	0	0	0	107.8
157	H	28.9	Very low	29.1	Very low	149 Å²	149	135.9 Å²	135.9	69%	0.69	74%	0.742	S	S	*	*				43.7	127.8	84	-82.9	-81.4	0	0	0	112.7	S159	H157-S159 PolarHBondContact ND1-OG 3.32Å
158	V	32.2	Very low	29	Very low	130 Å²	130	133.1 Å²	133.1	79%	0.788	74%	0.742	S	S	*	*				-148.1	133.7	53.9	160	0	0	0	0	108
159	S	27.4	Very low	29.1	Very low	72 Å²	72	133.1 Å²	133.1	50%	0.503	75%	0.749	S	S	.	*			cis	85.6	145.8	40.1	-54.1	0	0	0	0	115.6	H157	H157-S159 PolarHBondContact ND1-OG 3.32Å
160	R	28.2	Very low	29.2	Very low	226 Å²	226	133.3 Å²	133.3	85%	0.853	75%	0.751	S	S	*	*			trans	83.9	134.5	176.9	-48	-179.1	178.2	-173.4	-0.9	114.6
161	I	28.6	Very low	29	Very low	154 Å²	154	133.1 Å²	133.1	79%	0.79	75%	0.749	S	S	*	*			cis	73.9	136.5	29.5	-51	168.4	0	0	0	110.3
162	P	29.7	Very low	29.2	Very low	110 Å²	110	128.1 Å²	128.1	71%	0.714	74%	0.74	S	S	*	*			cis	-118.4	173.3	19.7	26.1	-1.2	0	0	0	113.3
163	Q	24.9	Very low	28.8	Very low	182 Å²	182	127.3 Å²	127.3	85%	0.85	74%	0.737	S	S	*	*				50.2	113.8	65	-66.5	-175.3	-9.3	0	0	116.8
164	A	25.5	Very low	28.8	Very low	85 Å²	85	128.6 Å²	128.6	70%	0.702	75%	0.748	S	S	*	*			trans	167.4	118.1	144.5	0	0	0	0	0	109.2
165	I	24.9	Very low	28.8	Very low	161 Å²	161	126.6 Å²	126.6	83%	0.826	74%	0.744	S	S	*	*				73.5	147.8	81.9	-55.4	155.2	0	0	0	113.2
166	V	26.5	Very low	29.3	Very low	128 Å²	128	126.1 Å²	126.1	78%	0.776	75%	0.747	S	S	*	*			trans	82.2	134.3	175	-166.7	0	0	0	0	115.9
167	T	27.7	Very low	29.1	Very low	133 Å²	133	125.8 Å²	125.8	82%	0.816	75%	0.75	S	S	*	*				-171.7	153.1	-52.5	32.3	0	0	0	0	110.6
168	G	28.8	Very low	29	Very low	83 Å²	83	125.7 Å²	125.7	86%	0.856	75%	0.754	S	S	*	*			trans	88.5	151.2	175.5	0	0	0	0	0	113.7
169	G	29.6	Very low	29	Very low	72 Å²	72	127.3 Å²	127.3	74%	0.742	76%	0.756	S	S	*	*			cis	128.7	140.7	11.7	0	0	0	0	0	109.2
170	T	30.3	Very low	29	Very low	118 Å²	118	128.9 Å²	128.9	72%	0.724	77%	0.768	S	S	*	*			cis	-160.3	144.3	5.5	47.6	0	0	0	0	112.4
171	N	28.6	Very low	29.5	Very low	149 Å²	149	123.3 Å²	123.3	80%	0.797	76%	0.761	S	S	*	*			trans	54.7	131.9	138.6	-51.1	-7.1	0	0	0	123.6
172	G	32	Very low	29.6	Very low	50 Å²	50	121.8 Å²	121.8	52%	0.515	76%	0.759	S	S	.	*			trans	124.3	163.2	138.9	0	0	0	0	0	118.2
173	S	29.2	Very low	29.5	Very low	105 Å²	105	122.2 Å²	122.2	73%	0.734	76%	0.764	S	S	*	*				-178.8	107.1	-69	166.3	0	0	0	0	113.7
174	L	28.2	Very low	29.7	Very low	158 Å²	158	117.6 Å²	117.6	83%	0.827	76%	0.757	S	S	*	*			trans	64.7	176.2	145.7	-62.1	176.9	0	0	0	117.3
175	P	33.6	Very low	29.8	Very low	114 Å²	114	118.3 Å²	118.3	74%	0.74	76%	0.763	S	S	*	*				-121.1	-106.3	-93.5	24.8	0.7	0	0	0	118.1
176	P	36.1	Very low	30	Very low	108 Å²	108	115.4 Å²	115.4	70%	0.701	76%	0.763	S	S	*	*			trans	-122.4	-177.4	-134.2	40.7	-22.1	0	0	0	115.1
177	L	30.1	Very low	30.1	Very low	155 Å²	155	113.5 Å²	113.5	81%	0.812	76%	0.761	S	S	*	*			trans	172.3	120.3	143	-89.8	164.4	0	0	0	107.2
178	L	26.5	Very low	30.1	Very low	147 Å²	147	113.5 Å²	113.5	77%	0.77	76%	0.761	S	S	*	*				54.1	116.8	91.2	-93.1	175.6	0	0	0	115.9
179	I	31.8	Very low	30.5	Very low	163 Å²	163	114.9 Å²	114.9	84%	0.836	76%	0.755	S	S	*	*				172.5	139.6	127.1	-88.3	156.6	0	0	0	110
180	S	29.3	Very low	30.5	Very low	106 Å²	106	118.4 Å²	118.4	74%	0.741	76%	0.756	S	S	*	*			trans	-111	-166.9	174	-44.9	0	0	0	0	108.8
181	P	37.7	Very low	30.5	Very low	108 Å²	108	119.8 Å²	119.8	70%	0.701	76%	0.757	S	S	*	*			cis	-139.8	-157.4	-5	36.4	-12.4	0	0	0	114
182	T	29.8	Very low	30.6	Very low	122 Å²	122	117.8 Å²	117.8	75%	0.748	76%	0.755	S	S	*	*			trans	74.8	110.4	146.8	39.6	0	0	0	0	122.9
183	S	28.1	Very low	30.6	Very low	119 Å²	119	119 Å²	119	83%	0.832	77%	0.767	S	S	*	*				91.3	153	117.4	-153.7	0	0	0	0	121.6
184	A	28.5	Very low	30.8	Very low	85 Å²	85	122.5 Å²	122.5	70%	0.702	77%	0.769	S	S	*	*			trans	73.3	93.8	158.3	0	0	0	0	0	121.3
185	A	28.5	Very low	31	Very low	101 Å²	101	120 Å²	120	84%	0.835	77%	0.772	S	S	*	*				81	154.6	117.8	0	0	0	0	0	123.1
186	A	28.6	Very low	30.9	Very low	99 Å²	99	118.1 Å²	118.1	82%	0.818	77%	0.772	S	S	*	*			trans	85.4	121.6	151.1	0	0	0	0	0	122.1
187	A	28.7	Very low	31	Very low	89 Å²	89	118.8 Å²	118.8	74%	0.736	78%	0.777	S	S	*	*			trans	74.1	88.7	133.1	0	0	0	0	0	122.2
188	T	28.9	Very low	31.2	Very low	132 Å²	132	120.4 Å²	120.4	81%	0.81	78%	0.782	S	S	*	*				60.8	128.1	116.9	-44.5	0	0	0	0	121.6
189	P	36.9	Very low	31.4	Very low	112 Å²	112	118.7 Å²	118.7	73%	0.727	78%	0.783	S	S	*	*			trans	-101.6	-173.8	178	42.3	-37.4	0	0	0	114.2
190	L	28.4	Very low	31.7	Very low	146 Å²	146	116.1 Å²	116.1	76%	0.764	78%	0.777	S	S	*	*			trans	179.6	132.6	142.8	-113.3	76.7	0	0	0	110
191	I	30.2	Very low	31.6	Very low	147 Å²	147	116 Å²	116	75%	0.754	78%	0.776	S	S	*	*				74.5	142.4	84	-72.3	-171.2	0	0	0	115.8
192	S	31.9	Very low	31.2	Very low	107 Å²	107	117.5 Å²	117.5	75%	0.748	78%	0.783	S	S	*	*			cis	-176	160.8	-26.8	74.6	0	0	0	0	112.7
193	G	32	Very low	31.2	Very low	75 Å²	75	115.5 Å²	115.5	77%	0.773	79%	0.787	S	S	*	*			trans	84.9	174.5	148.3	0	0	0	0	0	119.8
194	K	32.9	Very low	31.5	Very low	180 Å²	180	115.4 Å²	115.4	78%	0.783	79%	0.786	S	S	*	*			cis	-168.8	142.7	-14.6	-155.7	173.7	-175.2	170.5	0	113.1
195	A	32.9	Very low	31.9	Very low	106 Å²	106	116.4 Å²	116.4	88%	0.876	79%	0.785	S	S	*	*			trans	63.6	147.4	154.6	0	0	0	0	0	123.2
196	G	31.1	Very low	32	Very low	73 Å²	73	118.5 Å²	118.5	75%	0.753	78%	0.781	S	S	*	*			trans	161.5	127.7	167.5	0	0	0	0	0	113.9
197	P	38	Very low	32.2	Very low	122 Å²	122	120 Å²	120	79%	0.792	78%	0.775	S	S	*	*			trans	-115.1	161.7	-172.9	40.7	-33.1	0	0	0	115.7
198	M	33.9	Very low	32.2	Very low	189 Å²	189	121.6 Å²	121.6	93%	0.931	78%	0.776	S	S	*	*			trans	-177.6	166.2	137.1	-100	166	84.4	0	0	112.7
199	S	32	Very low	32.5	Very low	112 Å²	112	119.5 Å²	119.5	78%	0.783	77%	0.772	S	S	*	*			trans	-123.3	-175.5	179.3	-47.6	0	0	0	0	108.8
200	P	37	Very low	32.4	Very low	109 Å²	109	118.5 Å²	118.5	71%	0.708	77%	0.773	S	S	*	*			cis	-139.5	-165.9	3.5	44.3	-25.8	0	0	0	115.4
201	S	28.4	Very low	32.5	Very low	102 Å²	102	117.3 Å²	117.3	71%	0.713	77%	0.772	S	S	*	*			trans	67.8	159.9	155.1	75.8	0	0	0	0	118
202	T	28.2	Very low	32.5	Very low	141 Å²	141	116.1 Å²	116.1	87%	0.865	77%	0.771	S	S	*	*			cis	-169.2	145.5	-25.5	26.1	0	0	0	0	106.4
203	G	30	Very low	32.6	Very low	80 Å²	80	117.9 Å²	117.9	83%	0.825	77%	0.771	S	S	*	*			trans	137.6	107.3	158.9	0	0	0	0	0	117.8
204	S	33.8	Very low	32.5	Very low	117 Å²	117	121.5 Å²	121.5	82%	0.818	77%	0.768	S	S	*	*			trans	-75.9	170.7	150.7	-28.3	0	0	0	0	109.3
205	P	38.1	Very low	32.2	Very low	105 Å²	105	119.7 Å²	119.7	68%	0.682	77%	0.767	S	S	*	*				-158.8	-171.3	60.6	40.3	-16.4	0	0	0	117.4
206	I	29.7	Very low	32	Very low	145 Å²	145	119.3 Å²	119.3	74%	0.744	76%	0.764	S	S	*	*			trans	64.5	139.9	139.1	-81.6	162.3	0	0	0	117.9
207	N	32.7	Very low	31.9	Very low	131 Å²	131	122.1 Å²	122.1	70%	0.701	77%	0.767	S	S	*	*			cis	-169.5	176.3	2	-110.5	0.1	0	0	0	107.9
208	V	29.9	Very low	31.3	Very low	123 Å²	123	122 Å²	122	75%	0.745	77%	0.768	S	S	*	*			cis	-176.1	-175.4	-23.8	67.6	0	0	0	0	108.3
209	A	33.4	Very low	31.1	Very low	88 Å²	88	118 Å²	118	73%	0.727	76%	0.759	S	S	*	*			trans	81.7	140.3	165.4	0	0	0	0	0	117.7
210	A	35.4	Very low	31	Very low	91 Å²	91	118.5 Å²	118.5	75%	0.752	76%	0.76	S	S	*	*			cis	-163.6	172.1	-13.7	0	0	0	0	0	109.3
211	T	31.9	Very low	30.7	Very low	121 Å²	121	121.2 Å²	121.2	74%	0.742	76%	0.763	S	S	*	*			cis	173.7	164	-31.4	-60.3	0	0	0	0	105.1
212	V	28.6	Very low	30.7	Very low	121 Å²	121	125.1 Å²	125.1	73%	0.733	77%	0.77	S	S	*	*			trans	84.1	132.5	161.1	-128.1	0	0	0	0	121.4
213	L	35.3	Very low	30.8	Very low	144 Å²	144	122.8 Å²	122.8	75%	0.754	76%	0.759	S	S	*	*			trans	72.9	147.5	162.4	-53.5	-177.3	0	0	0	119.7
214	Q	28.9	Very low	30.8	Very low	152 Å²	152	125.7 Å²	125.7	71%	0.71	75%	0.754	S	S	*	*			cis	-163.9	149.3	-45.9	-131.1	-178.4	2.8	0	0	110.3
215	N	26.4	Very low	30.7	Very low	141 Å²	141	126.2 Å²	126.2	75%	0.754	74%	0.742	S	S	*	*			trans	52.6	103.1	159.2	-54.7	-21.2	0	0	0	120.5
216	A	28.6	Very low	30.3	Very low	99 Å²	99	128 Å²	128	82%	0.818	75%	0.746	S	S	*	*			trans	-172.3	138	134.7	0	0	0	0	0	114.1
217	V	29	Very low	30.4	Very low	132 Å²	132	129 Å²	129	80%	0.8	74%	0.74	S	S	*	*			trans	32.4	113.7	153.1	-173	0	0	0	0	120.3
218	S	26.7	Very low	30.4	Very low	119 Å²	119	127.7 Å²	127.7	83%	0.832	74%	0.741	S	S	*	*			trans	-81.5	133.2	156.9	-46.7	0	0	0	0	111.6
219	S	28	Very low	30.3	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	75%	0.75	S	S	*	*			trans	-162.3	122.9	159.5	-84.4	0	0	0	0	113
220	P	30.1	Very low	30.2	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	76%	0.756	S	S	*	*			trans	-83.2	129.5	167.8	32.4	-30.8	0	0	0	110.9	H222	P220-H222 PolarHBondContact O-N 3.43Å
221	Q	31.6	Very low	30	Very low	165 Å²	165	139.9 Å²	139.9	77%	0.771	76%	0.758	S	S	*	*			trans	-59.2	124.4	178.3	-83.6	-95.3	2.4	0	0	112.1
222	H	27.6	Very low	30	Very low	185 Å²	185	143.9 Å²	143.9	86%	0.856	77%	0.765	S	S	*	*			trans	-138.2	91.9	-178.1	-156	-67	0	0	0	109.3	P220	P220-H222 PolarHBondContact O-N 3.43Å
223	S	30.6	Very low	30.3	Very low	92 Å²	92	145 Å²	145	64%	0.643	77%	0.765	S	S	*	*			trans	-158.8	144.6	-169.1	178.1	0	0	0	0	113
224	I	31	Very low	30.3	Very low	141 Å²	141	143.3 Å²	143.3	72%	0.723	76%	0.763	S	S	*	*	S	Bend	cis	-148	128.6	-21.8	-105.9	166.9	0	0	0	105.1
225	F	30.9	Very low	30.6	Very low	128 Å²	128	141.2 Å²	141.2	56%	0.561	76%	0.763	S	S	*	*			trans	-177.3	73.9	145.5	-116.1	-75.6	0	0	0	109.7	C406	F225-C406 HydrophobicContact CE1-CB 3.71Å; F225-C406 HydrophobicContact CZ-CB 3.77Å
226	D	30	Very low	30.9	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	76%	0.763	S	S	*	*			trans	-132.3	126.9	167.6	-170.2	-7	0	0	0	107.8
227	R	32.3	Very low	31	Very low	166 Å²	166	142.6 Å²	142.6	63%	0.626	76%	0.761	S	S	*	*			trans	-155.9	44.2	-167.5	-135.9	178.7	-166.3	-123.7	-0.1	115	L405	R227-L405 HydrophobicContact CB-CB 4.48Å
228	S	32.1	Very low	31.1	Very low	103 Å²	103	140.7 Å²	140.7	72%	0.72	75%	0.754	S	S	*	*			trans	-105.6	34.7	176.4	55.4	0	0	0	0	114.2
229	R	28.3	Very low	31.3	Very low	247 Å²	247	143.2 Å²	143.2	93%	0.932	76%	0.757	S	S	*	*			trans	-97.7	81.9	164.7	-84.2	-164.7	176	-158.3	2.7	111.9
230	L	31.3	Very low	31.4	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	75%	0.751	S	S	*	*			trans	-160.3	85.8	149.9	-141.7	76.3	0	0	0	112.9
231	N	29.9	Very low	31.5	Very low	148 Å²	148	141.1 Å²	141.1	79%	0.791	75%	0.75	S	S	*	*			trans	-177.8	106.1	139.2	-100.3	-15	0	0	0	110.9
232	K	32.6	Very low	31.4	Very low	206 Å²	206	139 Å²	139	90%	0.896	75%	0.753	S	S	*	*			trans	-144.4	81.2	159.7	-154	175.8	-169.9	-178.3	0	109.4
233	I	34.7	Very low	31.7	Very low	144 Å²	144	135 Å²	135	74%	0.738	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-78.1	123.5	173.6	-61.7	173.1	0	0	0	107.8
234	P	36.4	Very low	31.8	Very low	108 Å²	108	136.2 Å²	136.2	70%	0.701	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-81.4	147.4	169.1	33.9	-33	0	0	0	110.6
235	P	34.3	Very low	32	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-83.6	155.7	175.8	33.8	-34.6	0	0	0	113.2
236	N	33.3	Very low	32	Very low	141 Å²	141	133.6 Å²	133.6	75%	0.754	76%	0.762	S	S	*	*			trans	73.7	113.3	150.6	-66.1	2.9	0	0	0	120.5
237	T	30.7	Very low	32.1	Very low	127 Å²	127	134.4 Å²	134.4	78%	0.779	77%	0.766	S	S	*	*				43.8	142.8	122.8	60.6	0	0	0	0	120.4
238	S	30.8	Very low	32.1	Very low	93 Å²	93	131.1 Å²	131.1	65%	0.65	78%	0.775	S	S	*	*			cis	-174	151.5	26.7	25.5	0	0	0	0	112.7
239	L	30.5	Very low	32.3	Very low	171 Å²	171	130 Å²	130	90%	0.895	77%	0.772	S	S	*	*			trans	57.2	163.1	152.3	-81.1	84.2	0	0	0	118.4
240	A	29.9	Very low	32.6	Very low	73 Å²	73	125.2 Å²	125.2	60%	0.603	77%	0.765	S	S	*	*			cis	-165.9	163.3	-33.3	0	0	0	0	0	110.1
241	S	32.5	Very low	32.9	Very low	111 Å²	111	123.7 Å²	123.7	78%	0.776	76%	0.757	S	S	*	*			trans	30.2	119.4	152	57.7	0	0	0	0	120.8
242	S	28.8	Very low	33.2	Very low	120 Å²	120	121.5 Å²	121.5	84%	0.839	75%	0.745	S	S	*	*			trans	-69.3	137.7	157.6	43.6	0	0	0	0	113.2
243	S	34	Very low	33.4	Very low	102 Å²	102	120.2 Å²	120.2	71%	0.713	74%	0.74	S	S	*	*			trans	-177.5	100.1	141.4	56.3	0	0	0	0	115.5
244	S	32.9	Very low	33.5	Very low	118 Å²	118	118.1 Å²	118.1	83%	0.825	74%	0.736	S	S	*	*			trans	66	177.3	145.5	82	0	0	0	0	117
245	P	36.1	Very low	33.2	Very low	112 Å²	112	119.7 Å²	119.7	73%	0.727	74%	0.737	S	S	*	*				-136.5	-162.9	-113.6	37.7	-14.2	0	0	0	116
246	S	30.4	Very low	33	Very low	102 Å²	102	123.6 Å²	123.6	71%	0.713	75%	0.745	S	S	*	*			trans	90.3	130.1	169.8	69.3	0	0	0	0	118.4
247	D	33.3	Very low	33	Very low	159 Å²	159	124.7 Å²	124.7	85%	0.85	75%	0.746	S	S	*	*			trans	52.6	145.7	153.4	-51.2	-14.7	0	0	0	120.2
248	A	31.9	Very low	33.2	Very low	97 Å²	97	130.7 Å²	130.7	80%	0.802	75%	0.754	S	S	*	*			cis	-176.8	153	-16.5	0	0	0	0	0	105.6
249	A	35.6	Very low	33.4	Very low	80 Å²	80	134.1 Å²	134.1	66%	0.661	76%	0.76	S	S	*	*			cis	-160	170.2	-7.3	0	0	0	0	0	109.2
250	N	35.6	Very low	33.6	Very low	146 Å²	146	128.3 Å²	128.3	78%	0.781	73%	0.733	S	S	*	*			trans	65.6	141.5	159.9	-56	-14.8	0	0	0	118.3
251	N	36.5	Very low	34	Very low	130 Å²	130	132 Å²	132	70%	0.695	74%	0.741	S	S	*	*			cis	-156.7	160.5	-16	-125.9	13.9	0	0	0	111.6
252	D	36.7	Very low	34.3	Very low	102 Å²	102	133.6 Å²	133.6	55%	0.545	74%	0.74	S	S	.	*			trans	25.7	120.1	149.7	-74.8	-48	0	0	0	121.4
253	K	35.5	Very low	34.8	Very low	180 Å²	180	130 Å²	130	78%	0.783	72%	0.715	S	S	*	*				95.1	156.3	71.2	-90.8	-160.5	-153.6	96.7	0	113.6
254	P	37.8	Very low	35.2	Very low	99 Å²	99	130.4 Å²	130.4	64%	0.643	71%	0.71	S	S	*	*				-137.6	-164.8	-112	38.7	-16.7	0	0	0	115.8
255	I	30.6	Very low	35.6	Very low	142 Å²	142	130 Å²	130	73%	0.728	70%	0.702	S	S	*	*			trans	69	95.4	163.5	-51.7	156.3	0	0	0	115.9
256	Q	29.9	Very low	35.8	Very low	190 Å²	190	134.1 Å²	134.1	89%	0.888	70%	0.703	S	S	*	*			trans	171.1	102.9	132.7	-98.2	165.2	73.9	0	0	112.4
257	Q	32.9	Very low	36.4	Very low	165 Å²	165	134 Å²	134	77%	0.771	70%	0.698	S	S	*	*			trans	-154.5	41.5	160.4	-141.1	168.5	10.7	0	0	115.8	S260	Q257-S260 PolarHBondContact NE2-OG 2.96Å
258	R	35.3	Very low	36.6	Very low	252 Å²	252	133.3 Å²	133.3	95%	0.951	69%	0.694	S	S	*	*	S	Bend	trans	-95.7	19.4	173.2	-132.2	173.6	-170.6	162.1	3.6	114.5
259	H	34.9	Very low	37	Very low	166 Å²	166	134.5 Å²	134.5	77%	0.769	69%	0.691	S	S	*	*	S	Bend	trans	-130.9	-2.2	-176.4	-107.2	-100.5	0	0	0	115	I261	H259-I261 PolarHBondContact O-N 2.94Å
260	S	34.1	Very low	37.2	Very low	48 Å²	48	138.8 Å²	138.8	34%	0.336	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.7	12.5	-161.6	-162	0	0	0	0	116.7	Q257 S263	Q257-S260 PolarHBondContact NE2-OG 2.96Å; S260-S263 VanDerWaalsContact C-OG 3.3Å; S260-S263 PolarHBondContact O-OG 2.88Å
261	I	38.8	Very low	37.4	Very low	150 Å²	150	135.7 Å²	135.7	77%	0.769	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-19	177.1	-62	179.6	0	0	0	111.6	H259	H259-I261 PolarHBondContact O-N 2.94Å
262	L	39	Very low	37.5	Very low	145 Å²	145	138.2 Å²	138.2	76%	0.759	70%	0.702	S	S	*	*	S	Bend	trans	-92.7	-4.4	171.6	-68.5	172.6	0	0	0	113.4
263	S	39	Very low	37.9	Very low	44 Å²	44	139 Å²	139	31%	0.308	71%	0.71	S	S	.	*	S	Bend	trans	-73.9	-44.1	171.2	44.6	0	0	0	0	112.3	S260 V265 R266 T267	S260-S263 VanDerWaalsContact C-OG 3.3Å; S260-S263 PolarHBondContact O-OG 2.88Å; S263-V265 VanDerWaalsContact C-N 3.32Å; S263-V265 PolarHBondContact O-N 3.2Å; S263-R266 PolarHBondContact O-N 2.85Å; S263-T267 PolarHBondContact O-N 3.11Å; S263-T267 PolarHBondContact O-OG1 3.19Å
264	N	42.4	Very low	38.1	Very low	112 Å²	112	137.7 Å²	137.7	60%	0.599	71%	0.711	S	S	*	*	H	α-helix	trans	-74.9	-23.9	-164.1	-61.1	13.6	0	0	0	112.8
265	V	41.5	Very low	38.3	Very low	108 Å²	108	141.4 Å²	141.4	66%	0.655	73%	0.726	S	S	*	*	H	α-helix	trans	-76.6	-25.6	172.2	-176.1	0	0	0	0	111.7	S263 T269	S263-V265 VanDerWaalsContact C-N 3.32Å; S263-V265 PolarHBondContact O-N 3.2Å; V265-T269 PolarHBondContact O-OG1 3.14Å
266	R	41	Very low	38.8	Very low	200 Å²	200	137.3 Å²	137.3	76%	0.755	72%	0.719	S	S	*	*	H	α-helix	trans	-84	-25.8	-177.9	-148.5	178.9	-161.9	110.6	2	113.2	S263	S263-R266 PolarHBondContact O-N 2.85Å
267	T	42.4	Very low	39.3	Very low	100 Å²	100	134.7 Å²	134.7	61%	0.613	72%	0.718	S	S	*	*	H	α-helix	trans	-76	-28.7	180	-48.1	0	0	0	0	112.8	S263	S263-T267 PolarHBondContact O-N 3.11Å; S263-T267 PolarHBondContact O-OG1 3.19Å
268	L	38.1	Very low	39.8	Very low	144 Å²	144	138.3 Å²	138.3	75%	0.754	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-75.3	-25.2	-178.7	-140.7	75.3	0	0	0	113.2	Q270	L268-Q270 VanDerWaalsContact C-N 3.29Å; L268-Q270 PolarHBondContact O-N 2.61Å
269	T	39.2	Very low	40.1	Very low	121 Å²	121	133.2 Å²	133.2	74%	0.742	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-81.3	-5	-179	-22.1	0	0	0	0	113.8	V265	V265-T269 PolarHBondContact O-OG1 3.14Å
270	Q	39.2	Very low	40.5	Very low	170 Å²	170	130.4 Å²	130.4	79%	0.794	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-116.3	5.6	-172.1	-153.4	166	11.6	0	0	113.6	L268	L268-Q270 VanDerWaalsContact C-N 3.29Å; L268-Q270 PolarHBondContact O-N 2.61Å
271	A	39.8	Very low	41.3	Very low	82 Å²	82	132.5 Å²	132.5	68%	0.678	72%	0.723	S	S	*	*	S	Bend	trans	-111.1	11.3	-176.4	0	0	0	0	0	114.4
272	M	40	Very low	41.9	Very low	183 Å²	183	127.9 Å²	127.9	90%	0.901	71%	0.712	S	S	*	*			trans	-109.9	30.4	179.8	-74.2	-176.2	153.5	0	0	113.2
273	V	43.6	Very low	42.6	Very low	117 Å²	117	127 Å²	127	71%	0.709	71%	0.708	S	S	*	*	S	Bend	trans	-119.8	125.7	169.6	-178.6	0	0	0	0	107.2
274	N	40.6	Very low	43.3	Very low	153 Å²	153	127.7 Å²	127.7	82%	0.818	71%	0.709	S	S	*	*			trans	84.4	83.3	-169.2	-48.8	-26.8	0	0	0	115.2
275	D	41.8	Very low	43.7	Very low	178 Å²	178	126.4 Å²	126.4	95%	0.952	70%	0.7	S	S	*	*				-159.7	162.2	107.3	-121.2	-34.6	0	0	0	112.5
276	G	41.3	Very low	44.4	Very low	56 Å²	56	127.2 Å²	127.2	58%	0.577	70%	0.701	S	S	*	*			trans	-81.4	157.5	-167.9	0	0	0	0	0	116.2
277	P	39.9	Very low	45.1	Very low	135 Å²	135	124.4 Å²	124.4	88%	0.877	69%	0.694	S	S	*	*			trans	-74.8	140.7	-173.5	30.7	-35.7	0	0	0	113.3
278	R	44.6	Very low	45.8	Very low	241 Å²	241	124.3 Å²	124.3	91%	0.909	69%	0.688	S	S	*	*			trans	-116.2	133.2	158.3	-75	-169.7	171	-151.2	-2.5	109.6
279	T	41.1	Very low	46.8	Very low	145 Å²	145	121.5 Å²	121.5	89%	0.89	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-71.5	126.8	-178.6	47.4	0	0	0	0	111.2
280	L	43.1	Very low	48	Very low	107 Å²	107	118.6 Å²	118.6	56%	0.56	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-84.5	150.6	173.2	-68.7	166.4	0	0	0	111	D284 M285 M288	L280-D284 HydrophobicContact CB-CB 4.43Å; L280-D284 HydrophobicContact CD2-CB 4.36Å; L280-M285 HydrophobicContact CB-CE 4.1Å; L280-M285 HydrophobicContact CD1-CE 3.52Å; L280-M285 HydrophobicContact CG-CE 4.45Å; L280-M288 HydrophobicContact CD1-SD 3.76Å
281	T	50.7	Low	49.2	Very low	92 Å²	92	117.1 Å²	117.1	56%	0.564	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-87.3	160.8	178.3	4.9	0	0	0	0	111.2	D283 D284 M285	T281-D283 VanDerWaalsContact C-N 3.31Å; T281-D283 PolarHBondContact O-N 2.73Å; T281-D284 VanDerWaalsContact CB-OD2 3.31Å; T281-D284 WeakPolarHBondContact CB-OD2 3.48Å; T281-D284 PolarHBondContact N-OD2 2.67Å; T281-D284 VanDerWaalsContact N-OD2 3.16Å; T281-D284 WeakPolarHBondContact O-CB 3.46Å; T281-D284 PolarHBondContact O-N 2.72Å; T281-D284 PolarHBondContact OG1-OD2 3.15Å; T281-M285 PolarHBondContact O-N 2.83Å
282	G	52.1	Low	50.5	Low	53 Å²	53	117.7 Å²	117.7	55%	0.546	64%	0.643	S	S	.	*	H	α-helix	trans	-56.7	-41.9	-174.6	0	0	0	0	0	113.7	D284 M285 D286	G282-D284 PolarHBondContact O-N 3.01Å; G282-M285 WeakPolarHBondContact O-CB 3.44Å; G282-M285 PolarHBondContact O-N 2.79Å; G282-M285 VanDerWaalsContact O-N 3.09Å; G282-D286 PolarHBondContact O-N 2.9Å
283	D	53.5	Low	51.9	Low	125 Å²	125	113.7 Å²	113.7	67%	0.668	62%	0.622	S	S	*	*	H	α-helix	trans	-67.1	-20.7	179.1	-51.3	-62.8	0	0	0	113.4	T281 K287	T281-D283 VanDerWaalsContact C-N 3.31Å; T281-D283 PolarHBondContact O-N 2.73Å; D283-K287 WeakPolarHBondContact O-CG 3.4Å; D283-K287 PolarHBondContact O-N 2.92Å
284	D	52.6	Low	53.3	Low	59 Å²	59	115.9 Å²	115.9	32%	0.316	62%	0.617	S	S	.	*	H	α-helix	trans	-80.1	-29.6	174.4	-55.2	-60.5	0	0	0	111.5	L280 T281 G282 M288	L280-D284 HydrophobicContact CB-CB 4.43Å; L280-D284 HydrophobicContact CD2-CB 4.36Å; T281-D284 VanDerWaalsContact CB-OD2 3.31Å; T281-D284 WeakPolarHBondContact CB-OD2 3.48Å; T281-D284 PolarHBondContact N-OD2 2.67Å; T281-D284 VanDerWaalsContact N-OD2 3.16Å; T281-D284 WeakPolarHBondContact O-CB 3.46Å; T281-D284 PolarHBondContact O-N 2.72Å; T281-D284 PolarHBondContact OG1-OD2 3.15Å; G282-D284 PolarHBondContact O-N 3.01Å; D284-M288 WeakPolarHBondContact O-CB 3.48Å; D284-M288 WeakPolarHBondContact O-CG 3.27Å; D284-M288 PolarHBondContact O-N 3.23Å
285	M	50.7	Low	54.9	Low	86 Å²	86	111.4 Å²	111.4	42%	0.424	60%	0.601	S	S	.	*	H	α-helix	trans	-68.3	-46.8	175.1	-65.6	-79	85.3	0	0	111.4	L280 T281 G282 K287 M288 V289	L280-M285 HydrophobicContact CB-CE 4.1Å; L280-M285 HydrophobicContact CD1-CE 3.52Å; L280-M285 HydrophobicContact CG-CE 4.45Å; T281-M285 PolarHBondContact O-N 2.83Å; G282-M285 WeakPolarHBondContact O-CB 3.44Å; G282-M285 PolarHBondContact O-N 2.79Å; G282-M285 VanDerWaalsContact O-N 3.09Å; M285-K287 VanDerWaalsContact C-N 3.26Å; M285-K287 PolarHBondContact O-N 2.97Å; M285-M288 HydrophobicContact CE-CE 4.43Å; M285-M288 HydrophobicContact CE-SD 3.65Å; M285-M288 PolarHBondContact O-N 3.25Å; M285-V289 WeakPolarHBondContact O-CB 3.38Å; M285-V289 WeakPolarHBondContact O-CG2 3.22Å; M285-V289 PolarHBondContact O-N 3.09Å
286	D	57.6	Low	56.6	Low	125 Å²	125	110.7 Å²	110.7	67%	0.668	59%	0.585	S	S	*	*	H	α-helix	trans	-63.2	-33.2	176.7	-81.8	-17.6	0	0	0	112.1	G282 S290	G282-D286 PolarHBondContact O-N 2.9Å; D286-S290 WeakPolarHBondContact O-CB 3.39Å; D286-S290 PolarHBondContact O-N 3.36Å
287	K	55.9	Low	58.1	Low	140 Å²	140	113.7 Å²	113.7	61%	0.609	58%	0.583	S	S	*	*	H	α-helix	trans	-68.1	-49	171	-80	179.9	178.6	173	0	112.7	D283 M285 V289 S290 E291	D283-K287 WeakPolarHBondContact O-CG 3.4Å; D283-K287 PolarHBondContact O-N 2.92Å; M285-K287 VanDerWaalsContact C-N 3.26Å; M285-K287 PolarHBondContact O-N 2.97Å; K287-V289 VanDerWaalsContact C-N 3.28Å; K287-V289 PolarHBondContact O-N 2.95Å; K287-S290 PolarHBondContact O-N 3.23Å; K287-S290 VanDerWaalsContact O-N 3.09Å; K287-E291 PolarHBondContact O-N 3.47Å
288	M	55.4	Low	59.7	Low	98 Å²	98	114.1 Å²	114.1	48%	0.483	57%	0.573	S	S	.	*	H	α-helix	trans	-58.4	-40.8	176.7	-81.1	-175.3	61.3	0	0	111.6	L280 D284 M285 E291 E292	L280-M288 HydrophobicContact CD1-SD 3.76Å; D284-M288 WeakPolarHBondContact O-CB 3.48Å; D284-M288 WeakPolarHBondContact O-CG 3.27Å; D284-M288 PolarHBondContact O-N 3.23Å; M285-M288 HydrophobicContact CE-CE 4.43Å; M285-M288 HydrophobicContact CE-SD 3.65Å; M285-M288 PolarHBondContact O-N 3.25Å; M288-E291 PolarHBondContact O-N 3.02Å; M288-E292 VanDerWaalsContact O-CB 3.27Å; M288-E292 WeakPolarHBondContact O-CB 3.41Å; M288-E292 PolarHBondContact O-N 2.87Å
289	V	60.3	Low	61	Low	86 Å²	86	108.2 Å²	108.2	52%	0.521	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-41	174.7	172.3	0	0	0	0	111.2	M285 K287 E292 E293	M285-V289 WeakPolarHBondContact O-CB 3.38Å; M285-V289 WeakPolarHBondContact O-CG2 3.22Å; M285-V289 PolarHBondContact O-N 3.09Å; K287-V289 VanDerWaalsContact C-N 3.28Å; K287-V289 PolarHBondContact O-N 2.95Å; V289-E292 PolarHBondContact O-N 3.44Å; V289-E293 WeakPolarHBondContact O-CB 3.3Å; V289-E293 PolarHBondContact O-N 2.72Å
290	S	64.5	Low	62.6	Low	59 Å²	59	107.8 Å²	107.8	41%	0.413	54%	0.544	S	S	.	.	H	α-helix	trans	-70.6	-28.2	177.7	-159.8	0	0	0	0	114.3	D286 K287 R294	D286-S290 WeakPolarHBondContact O-CB 3.39Å; D286-S290 PolarHBondContact O-N 3.36Å; K287-S290 PolarHBondContact O-N 3.23Å; K287-S290 VanDerWaalsContact O-N 3.09Å; S290-R294 WeakPolarHBondContact O-CG 3.48Å; S290-R294 PolarHBondContact O-N 3.42Å; S290-R294 PolarHBondContact O-NH1 3.21Å; S290-R294 PolarHBondContact OG-NH1 2.85Å
291	E	63.9	Low	64.2	Low	139 Å²	139	108 Å²	108	65%	0.65	54%	0.54	S	S	*	.	H	α-helix	trans	-80.9	-39.3	172.1	-72.7	-168.5	129.3	0	0	112	K287 M288 R294 A295	K287-E291 PolarHBondContact O-N 3.47Å; M288-E291 PolarHBondContact O-N 3.02Å; E291-R294 WeakPolarHBondContact O-CB 3.32Å; E291-R294 PolarHBondContact O-N 3.5Å; E291-A295 WeakPolarHBondContact O-CB 3.34Å; E291-A295 PolarHBondContact O-N 3.31Å
292	E	66.6	Low	65.5	Low	95 Å²	95	112.8 Å²	112.8	44%	0.444	55%	0.548	S	S	.	.	H	α-helix	trans	-66.8	-39.7	175.4	-161.6	-169.4	142	0	0	111.4	M288 V289 R294 A295 R296	M288-E292 VanDerWaalsContact O-CB 3.27Å; M288-E292 WeakPolarHBondContact O-CB 3.41Å; M288-E292 PolarHBondContact O-N 2.87Å; V289-E292 PolarHBondContact O-N 3.44Å; E292-R294 VanDerWaalsContact C-N 3.32Å; E292-R294 PolarHBondContact O-N 3.47Å; E292-A295 PolarHBondContact O-N 3.3Å; E292-R296 WeakPolarHBondContact O-CB 3.3Å; E292-R296 VanDerWaalsContact O-CG 3.29Å; E292-R296 WeakPolarHBondContact O-CG 3.33Å; E292-R296 PolarHBondContact O-N 2.94Å; E292-R296 IonicContact OE1-CZ 3.42Å; E292-R296 IonicContact OE1-NE 2.8Å; E292-R296 PolarHBondContact OE1-NE 2.62Å; E292-R296 IonicContact OE1-NH2 3Å; E292-R296 PolarHBondContact OE1-NH2 2.63Å
293	E	70.8	Confident	66.6	Low	99 Å²	99	115.5 Å²	115.5	46%	0.463	55%	0.546	S	S	.	.	H	α-helix	trans	-68.9	-30.5	175.3	-157.6	-172.6	128.5	0	0	112.2	V289 K297	V289-E293 WeakPolarHBondContact O-CB 3.3Å; V289-E293 PolarHBondContact O-N 2.72Å; E293-K297 WeakPolarHBondContact O-CB 3.24Å; E293-K297 WeakPolarHBondContact O-CG 3.4Å; E293-K297 PolarHBondContact O-N 2.82Å; E293-K297 IonicContact OE1-NZ 3.61Å; E293-K297 PolarHBondContact OE1-NZ 3.36Å
294	R	72.9	Confident	67.6	Low	163 Å²	163	115.9 Å²	115.9	62%	0.615	54%	0.544	S	S	*	.	H	α-helix	trans	-64.4	-50.1	167.2	-88.1	-175.9	175.7	78.1	-1.6	111.5	S290 E291 E292 R296 K297 E298	S290-R294 WeakPolarHBondContact O-CG 3.48Å; S290-R294 PolarHBondContact O-N 3.42Å; S290-R294 PolarHBondContact O-NH1 3.21Å; S290-R294 PolarHBondContact OG-NH1 2.85Å; E291-R294 WeakPolarHBondContact O-CB 3.32Å; E291-R294 PolarHBondContact O-N 3.5Å; E292-R294 VanDerWaalsContact C-N 3.32Å; E292-R294 PolarHBondContact O-N 3.47Å; R294-R296 VanDerWaalsContact C-N 3.31Å; R294-R296 PolarHBondContact O-N 3.46Å; R294-K297 PolarHBondContact O-N 3.4Å; R294-E298 WeakPolarHBondContact O-CB 3.44Å; R294-E298 PolarHBondContact O-N 2.86Å
295	A	73.1	Confident	68.6	Low	58 Å²	58	118.2 Å²	118.2	48%	0.479	55%	0.553	S	S	.	*	H	α-helix	trans	-59.8	-41.2	179.7	0	0	0	0	0	111.8	E291 E292 E298 Q299	E291-A295 WeakPolarHBondContact O-CB 3.34Å; E291-A295 PolarHBondContact O-N 3.31Å; E292-A295 PolarHBondContact O-N 3.3Å; A295-E298 PolarHBondContact O-N 3.47Å; A295-Q299 WeakPolarHBondContact O-CB 3.21Å; A295-Q299 PolarHBondContact O-N 3.16Å
296	R	76.9	Confident	69.7	Low	164 Å²	164	118.8 Å²	118.8	62%	0.619	55%	0.554	S	S	*	*	H	α-helix	trans	-61.7	-48	173.7	-73.5	171.9	179.8	-126.4	7.7	111.9	E292 R294 E298 Q299 E300	E292-R296 WeakPolarHBondContact O-CB 3.3Å; E292-R296 VanDerWaalsContact O-CG 3.29Å; E292-R296 WeakPolarHBondContact O-CG 3.33Å; E292-R296 PolarHBondContact O-N 2.94Å; E292-R296 IonicContact OE1-CZ 3.42Å; E292-R296 IonicContact OE1-NE 2.8Å; E292-R296 PolarHBondContact OE1-NE 2.62Å; E292-R296 IonicContact OE1-NH2 3Å; E292-R296 PolarHBondContact OE1-NH2 2.63Å; R294-R296 VanDerWaalsContact C-N 3.31Å; R294-R296 PolarHBondContact O-N 3.46Å; R296-E298 VanDerWaalsContact C-N 3.35Å; R296-E298 PolarHBondContact O-N 2.95Å; R296-Q299 PolarHBondContact O-N 3.15Å; R296-E300 VanDerWaalsContact O-CB 3.31Å; R296-E300 WeakPolarHBondContact O-CB 3.41Å; R296-E300 PolarHBondContact O-N 2.96Å
297	K	73.9	Confident	70.6	Confident	119 Å²	119	119.1 Å²	119.1	52%	0.517	55%	0.55	S	S	.	.	H	α-helix	trans	-65	-35.4	177.4	-80.8	168.4	172	162	0	113.2	E293 R294 K301	E293-K297 WeakPolarHBondContact O-CB 3.24Å; E293-K297 WeakPolarHBondContact O-CG 3.4Å; E293-K297 PolarHBondContact O-N 2.82Å; E293-K297 IonicContact OE1-NZ 3.61Å; E293-K297 PolarHBondContact OE1-NZ 3.36Å; R294-K297 PolarHBondContact O-N 3.4Å; K297-K301 VanDerWaalsContact O-CB 3.28Å; K297-K301 WeakPolarHBondContact O-CB 3.45Å; K297-K301 PolarHBondContact O-N 2.78Å
298	E	73.1	Confident	71.4	Confident	144 Å²	144	114.4 Å²	114.4	67%	0.673	54%	0.537	S	S	*	.	H	α-helix	trans	-75.6	-33.7	177.5	-168.2	150.2	-140.8	0	0	112.1	R294 A295 R296 R302	R294-E298 WeakPolarHBondContact O-CB 3.44Å; R294-E298 PolarHBondContact O-N 2.86Å; A295-E298 PolarHBondContact O-N 3.47Å; R296-E298 VanDerWaalsContact C-N 3.35Å; R296-E298 PolarHBondContact O-N 2.95Å; E298-R302 WeakPolarHBondContact O-CB 3.21Å; E298-R302 PolarHBondContact O-N 3.27Å
299	Q	72.3	Confident	72.2	Confident	117 Å²	117	112 Å²	112	55%	0.547	53%	0.533	S	S	.	.	H	α-helix	trans	-69.5	-43.6	169.3	-177.3	171.6	-27.5	0	0	112.1	A295 R296 K301 R302 E303	A295-Q299 WeakPolarHBondContact O-CB 3.21Å; A295-Q299 PolarHBondContact O-N 3.16Å; R296-Q299 PolarHBondContact O-N 3.15Å; Q299-K301 PolarHBondContact O-N 3.42Å; Q299-R302 CarbonylContact O-C 3.59Å; Q299-R302 WeakPolarHBondContact O-CB 3.31Å; Q299-R302 PolarHBondContact O-N 3.32Å; Q299-R302 VanDerWaalsContact O-N 3.08Å; Q299-E303 PolarHBondContact NE2-OE1 2.99Å; Q299-E303 VanDerWaalsContact NE2-OE1 3.09Å; Q299-E303 PolarHBondContact O-N 3.48Å
300	E	75.5	Confident	72.6	Confident	136 Å²	136	115.4 Å²	115.4	64%	0.636	54%	0.536	S	S	*	.	H	α-helix	trans	-59.3	-45.5	175.7	-178.5	174.6	-149.7	0	0	111.1	R296 R302 E303 E304	R296-E300 VanDerWaalsContact O-CB 3.31Å; R296-E300 WeakPolarHBondContact O-CB 3.41Å; R296-E300 PolarHBondContact O-N 2.96Å; E300-R302 VanDerWaalsContact C-N 3.31Å; E300-R302 PolarHBondContact O-N 2.92Å; E300-E303 PolarHBondContact O-N 3.46Å; E300-E304 PolarHBondContact O-N 3.42Å
301	K	76.6	Confident	72.6	Confident	111 Å²	111	119.5 Å²	119.5	48%	0.483	54%	0.542	S	S	.	.	H	α-helix	trans	-58.3	-41	171.9	178.2	179.2	176.1	-68.7	0	112.1	K297 Q299 E304 E305	K297-K301 VanDerWaalsContact O-CB 3.28Å; K297-K301 WeakPolarHBondContact O-CB 3.45Å; K297-K301 PolarHBondContact O-N 2.78Å; Q299-K301 PolarHBondContact O-N 3.42Å; K301-E304 PolarHBondContact O-N 2.98Å; K301-E305 WeakPolarHBondContact CE-OE1 3.47Å; K301-E305 IonicContact NZ-OE1 3.16Å; K301-E305 PolarHBondContact NZ-OE1 3.5Å; K301-E305 IonicContact NZ-OE2 2.61Å; K301-E305 PolarHBondContact NZ-OE2 2.92Å; K301-E305 WeakPolarHBondContact O-CB 3.49Å; K301-E305 WeakPolarHBondContact O-CG 3.32Å; K301-E305 PolarHBondContact O-N 3.22Å
302	R	76.6	Confident	72.4	Confident	193 Å²	193	117.7 Å²	117.7	73%	0.728	54%	0.536	S	S	*	.	H	α-helix	trans	-70.4	-38.2	-179.9	-161	177.8	-160.3	162.8	6.4	112.2	E298 Q299 E300 E306	E298-R302 WeakPolarHBondContact O-CB 3.21Å; E298-R302 PolarHBondContact O-N 3.27Å; Q299-R302 CarbonylContact O-C 3.59Å; Q299-R302 WeakPolarHBondContact O-CB 3.31Å; Q299-R302 PolarHBondContact O-N 3.32Å; Q299-R302 VanDerWaalsContact O-N 3.08Å; E300-R302 VanDerWaalsContact C-N 3.31Å; E300-R302 PolarHBondContact O-N 2.92Å; R302-E306 WeakPolarHBondContact O-CB 3.38Å; R302-E306 PolarHBondContact O-N 2.88Å
303	E	75.9	Confident	71.6	Confident	110 Å²	110	118.6 Å²	118.6	51%	0.514	54%	0.544	S	S	.	.	H	α-helix	trans	-67.8	-36.8	171.6	-74.9	-174.4	-154.4	0	0	111.5	Q299 E300 K307	Q299-E303 PolarHBondContact NE2-OE1 2.99Å; Q299-E303 VanDerWaalsContact NE2-OE1 3.09Å; Q299-E303 PolarHBondContact O-N 3.48Å; E300-E303 PolarHBondContact O-N 3.46Å; E303-K307 WeakPolarHBondContact O-CB 3.45Å; E303-K307 PolarHBondContact O-N 3.32Å
304	E	74.7	Confident	70.8	Confident	132 Å²	132	117.7 Å²	117.7	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-69.8	-40.5	173.8	-172.5	164.4	-129.1	0	0	112.3	E300 K301 K307 A308	E300-E304 PolarHBondContact O-N 3.42Å; K301-E304 PolarHBondContact O-N 2.98Å; E304-K307 CarbonylContact O-C 3.54Å; E304-K307 PolarHBondContact O-N 3Å; E304-A308 VanDerWaalsContact O-CB 3.27Å; E304-A308 WeakPolarHBondContact O-CB 3.39Å; E304-A308 PolarHBondContact O-N 3.13Å
305	E	73	Confident	69.7	Low	108 Å²	108	116.4 Å²	116.4	51%	0.505	55%	0.546	S	S	.	.	H	α-helix	trans	-63.7	-40.8	173	-78.1	175.2	156.6	0	0	111.7	K301 A308 A309	K301-E305 WeakPolarHBondContact CE-OE1 3.47Å; K301-E305 IonicContact NZ-OE1 3.16Å; K301-E305 PolarHBondContact NZ-OE1 3.5Å; K301-E305 IonicContact NZ-OE2 2.61Å; K301-E305 PolarHBondContact NZ-OE2 2.92Å; K301-E305 WeakPolarHBondContact O-CB 3.49Å; K301-E305 WeakPolarHBondContact O-CG 3.32Å; K301-E305 PolarHBondContact O-N 3.22Å; E305-A308 PolarHBondContact O-N 3.36Å; E305-A309 WeakPolarHBondContact O-CB 3.46Å; E305-A309 PolarHBondContact O-N 3.33Å
306	E	74.1	Confident	68.4	Low	98 Å²	98	118.8 Å²	118.8	46%	0.458	55%	0.551	S	S	.	*	H	α-helix	trans	-68.9	-36.9	174	-165.7	-177	168.3	0	0	111.9	R302 A308 A309 R310	R302-E306 WeakPolarHBondContact O-CB 3.38Å; R302-E306 PolarHBondContact O-N 2.88Å; E306-A308 VanDerWaalsContact C-N 3.31Å; E306-A308 PolarHBondContact O-N 3.48Å; E306-A309 PolarHBondContact O-N 2.86Å; E306-R310 HydrophobicContact CG-CG 4.41Å; E306-R310 VanDerWaalsContact O-CB 3.28Å; E306-R310 WeakPolarHBondContact O-CB 3.27Å; E306-R310 WeakPolarHBondContact O-CG 3.48Å; E306-R310 PolarHBondContact O-N 2.89Å; E306-R310 IonicContact OE1-CZ 2.65Å; E306-R310 IonicContact OE1-NE 2.66Å; E306-R310 PolarHBondContact OE1-NE 3.18Å; E306-R310 IonicContact OE1-NH2 3.51Å; E306-R310 PolarHBondContact OE1-NH2 3.19Å
307	K	75.8	Confident	66.9	Low	133 Å²	133	115.7 Å²	115.7	58%	0.578	55%	0.547	S	S	*	.	H	α-helix	trans	-73.7	-22	176.6	-168.1	177.3	-164.1	169.9	0	112.4	E303 E304 R311	E303-K307 WeakPolarHBondContact O-CB 3.45Å; E303-K307 PolarHBondContact O-N 3.32Å; E304-K307 CarbonylContact O-C 3.54Å; E304-K307 PolarHBondContact O-N 3Å; K307-R311 WeakPolarHBondContact O-CD 3.45Å; K307-R311 VanDerWaalsContact O-CG 3.22Å; K307-R311 WeakPolarHBondContact O-CG 3.36Å; K307-R311 PolarHBondContact O-N 3.27Å
308	A	73.5	Confident	65.4	Low	40 Å²	40	116.6 Å²	116.6	33%	0.331	55%	0.551	S	S	.	*	H	α-helix	trans	-78.4	-44.9	167	0	0	0	0	0	111.3	E304 E305 E306 R310 R311 I312	E304-A308 VanDerWaalsContact O-CB 3.27Å; E304-A308 WeakPolarHBondContact O-CB 3.39Å; E304-A308 PolarHBondContact O-N 3.13Å; E305-A308 PolarHBondContact O-N 3.36Å; E306-A308 VanDerWaalsContact C-N 3.31Å; E306-A308 PolarHBondContact O-N 3.48Å; A308-R310 PolarHBondContact O-N 3.22Å; A308-R311 WeakPolarHBondContact O-CA 3.28Å; A308-R311 WeakPolarHBondContact O-CB 3.33Å; A308-R311 PolarHBondContact O-N 2.76Å; A308-I312 WeakPolarHBondContact O-CG1 3.36Å; A308-I312 PolarHBondContact O-N 2.83Å
309	A	72.5	Confident	64.2	Low	48 Å²	48	116.6 Å²	116.6	40%	0.397	56%	0.556	S	S	.	*	H	α-helix	trans	-58.7	-47.3	173.7	0	0	0	0	0	111.5	E305 E306 R311 I312 D313	E305-A309 WeakPolarHBondContact O-CB 3.46Å; E305-A309 PolarHBondContact O-N 3.33Å; E306-A309 PolarHBondContact O-N 2.86Å; A309-R311 PolarHBondContact O-N 3.13Å; A309-I312 PolarHBondContact O-N 2.9Å; A309-D313 PolarHBondContact O-N 3.15Å
310	R	69.1	Low	63	Low	157 Å²	157	112.5 Å²	112.5	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-66.8	-13.2	173.2	-68.4	172.5	-179.4	-147.9	11.4	114.2	E306 A308 V314	E306-R310 HydrophobicContact CG-CG 4.41Å; E306-R310 VanDerWaalsContact O-CB 3.28Å; E306-R310 WeakPolarHBondContact O-CB 3.27Å; E306-R310 WeakPolarHBondContact O-CG 3.48Å; E306-R310 PolarHBondContact O-N 2.89Å; E306-R310 IonicContact OE1-CZ 2.65Å; E306-R310 IonicContact OE1-NE 2.66Å; E306-R310 PolarHBondContact OE1-NE 3.18Å; E306-R310 IonicContact OE1-NH2 3.51Å; E306-R310 PolarHBondContact OE1-NH2 3.19Å; A308-R310 PolarHBondContact O-N 3.22Å; R310-V314 WeakPolarHBondContact O-CB 3.45Å; R310-V314 WeakPolarHBondContact O-CG2 3.21Å
311	R	64.4	Low	61.8	Low	145 Å²	145	111.5 Å²	111.5	55%	0.547	54%	0.537	S	S	.	.	H	α-helix	trans	-83.9	-40.6	167	-82.5	166.7	175.4	163.8	-3.2	110.8	K307 A308 A309 V314 E315	K307-R311 WeakPolarHBondContact O-CD 3.45Å; K307-R311 VanDerWaalsContact O-CG 3.22Å; K307-R311 WeakPolarHBondContact O-CG 3.36Å; K307-R311 PolarHBondContact O-N 3.27Å; A308-R311 WeakPolarHBondContact O-CA 3.28Å; A308-R311 WeakPolarHBondContact O-CB 3.33Å; A308-R311 PolarHBondContact O-N 2.76Å; A309-R311 PolarHBondContact O-N 3.13Å; R311-V314 CarbonylContact O-C 3.58Å; R311-V314 PolarHBondContact O-N 2.81Å; R311-E315 WeakPolarHBondContact O-CB 3.38Å; R311-E315 WeakPolarHBondContact O-CG 3.5Å; R311-E315 PolarHBondContact O-N 3.48Å
312	I	58.4	Low	61.2	Low	101 Å²	101	111.1 Å²	111.1	52%	0.518	54%	0.537	S	S	.	.	H	α-helix	trans	-65.8	-46.7	177	-64.6	163.7	0	0	0	110.6	A308 A309 V314 E315 D316	A308-I312 WeakPolarHBondContact O-CG1 3.36Å; A308-I312 PolarHBondContact O-N 2.83Å; A309-I312 PolarHBondContact O-N 2.9Å; I312-V314 PolarHBondContact O-N 3.2Å; I312-E315 PolarHBondContact O-N 3.32Å; I312-D316 PolarHBondContact O-N 2.96Å
313	D	51.1	Low	61.2	Low	114 Å²	114	108.8 Å²	108.8	61%	0.61	53%	0.532	S	S	*	.	H	α-helix	trans	-55.6	-36.8	172.3	-90.4	-25.2	0	0	0	112	A309 D317	A309-D313 PolarHBondContact O-N 3.15Å; D313-D317 WeakPolarHBondContact O-CB 3.4Å; D313-D317 PolarHBondContact O-N 3.18Å
314	V	53	Low	61.7	Low	80 Å²	80	106.8 Å²	106.8	49%	0.485	53%	0.528	S	S	.	.	H	α-helix	trans	-78.7	-27.3	178.5	168	0	0	0	0	112.3	R310 R311 I312 F318	R310-V314 WeakPolarHBondContact O-CB 3.45Å; R310-V314 WeakPolarHBondContact O-CG2 3.21Å; R311-V314 CarbonylContact O-C 3.58Å; R311-V314 PolarHBondContact O-N 2.81Å; I312-V314 PolarHBondContact O-N 3.2Å; V314-F318 WeakPolarHBondContact O-CD2 3.4Å; V314-F318 PolarHBondContact O-N 2.83Å
315	E	49.4	Very low	62.5	Low	136 Å²	136	104.8 Å²	104.8	64%	0.636	52%	0.521	S	S	*	.	H	α-helix	trans	-77.7	-33.6	173.4	-75.3	177.8	-175.9	0	0	111.9	R311 I312 F318	R311-E315 WeakPolarHBondContact O-CB 3.38Å; R311-E315 WeakPolarHBondContact O-CG 3.5Å; R311-E315 PolarHBondContact O-N 3.48Å; I312-E315 PolarHBondContact O-N 3.32Å; E315-F318 WeakPolarHBondContact O-CB 3.3Å; E315-F318 PolarHBondContact O-N 3Å
316	D	45.8	Very low	63.3	Low	109 Å²	109	101.8 Å²	101.8	58%	0.583	51%	0.509	S	S	*	.	H	α-helix	trans	-71.4	-33	169.5	-83.5	-20.6	0	0	0	112	I312 F318 D319 A320	I312-D316 PolarHBondContact O-N 2.96Å; D316-F318 PolarHBondContact O-N 3.4Å; D316-D319 PolarHBondContact O-N 3.32Å; D316-A320 PolarHBondContact O-N 3.37Å; D316-A320 VanDerWaalsContact O-N 3.15Å
317	D	46.2	Very low	64.2	Low	98 Å²	98	103.7 Å²	103.7	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-73.2	-8.3	175.2	-154.5	35.4	0	0	0	113.2	D313 A320	D313-D317 WeakPolarHBondContact O-CB 3.4Å; D313-D317 PolarHBondContact O-N 3.18Å; D317-A320 WeakPolarHBondContact OD1-CB 3.5Å
318	F	43	Very low	65	Low	139 Å²	139	97.5 Å²	97.5	61%	0.61	49%	0.489	S	S	*	.	H	α-helix	trans	-73.8	-46.3	167.2	-105.6	-86.7	0	0	0	111.6	V314 E315 D316 A320 Q321	V314-F318 WeakPolarHBondContact O-CD2 3.4Å; V314-F318 PolarHBondContact O-N 2.83Å; E315-F318 WeakPolarHBondContact O-CB 3.3Å; E315-F318 PolarHBondContact O-N 3Å; D316-F318 PolarHBondContact O-N 3.4Å; F318-A320 PolarHBondContact O-N 2.87Å; F318-Q321 PolarHBondContact O-N 3.1Å
319	D	47	Very low	65.8	Low	144 Å²	144	103 Å²	103	77%	0.77	51%	0.505	S	S	*	.	H	α-helix	trans	-68	-25.7	173.9	-83.2	-3.8	0	0	0	111.2	D316 Q321	D316-D319 PolarHBondContact O-N 3.32Å; D319-Q321 PolarHBondContact O-N 2.95Å; D319-Q321 VanDerWaalsContact O-N 3.16Å
320	A	47.3	Very low	66.7	Low	31 Å²	31	105.6 Å²	105.6	26%	0.256	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-8.1	174.3	0	0	0	0	0	114.6	D316 D317 F318 K323	D316-A320 PolarHBondContact O-N 3.37Å; D316-A320 VanDerWaalsContact O-N 3.15Å; D317-A320 WeakPolarHBondContact OD1-CB 3.5Å; F318-A320 PolarHBondContact O-N 2.87Å; A320-K323 WeakPolarHBondContact O-CG 3.48Å; A320-K323 PolarHBondContact O-NZ 3.16Å
321	Q	51.6	Low	67.8	Low	114 Å²	114	99.5 Å²	99.5	53%	0.533	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-18.6	-177.5	-72.2	178.1	19.8	0	0	114.8	F318 D319 K323	F318-Q321 PolarHBondContact O-N 3.1Å; D319-Q321 PolarHBondContact O-N 2.95Å; D319-Q321 VanDerWaalsContact O-N 3.16Å; Q321-K323 PolarHBondContact O-N 2.89Å
322	E	63	Low	69.3	Low	103 Å²	103	95.4 Å²	95.4	48%	0.481	48%	0.483	S	S	.	.			trans	-80.6	44.3	177	-157.8	165.1	-100.4	0	0	112.2	F336 R350	E322-F336 HydrophobicContact CG-CD1 3.66Å; E322-F336 HydrophobicContact CG-CE1 3.78Å; E322-F336 HydrophobicContact CG-CG 4.31Å; E322-F336 WeakPolarHBondContact O-CE1 3.34Å; E322-R350 IonicContact OE1-CZ 3.78Å; E322-R350 IonicContact OE1-NH1 3.52Å; E322-R350 PolarHBondContact OE1-NH1 3.05Å; E322-R350 IonicContact OE1-NH2 2.66Å; E322-R350 PolarHBondContact OE1-NH2 3.3Å; E322-R350 IonicContact OE2-NH2 3.21Å; E322-R350 PolarHBondContact OE2-NH2 2.98Å
323	K	76.4	Confident	71.1	Confident	144 Å²	144	90.8 Å²	90.8	63%	0.626	46%	0.459	S	S	*	.			trans	-73.6	130.2	177	-70.7	-174.9	176.2	80.4	0	110.4	A320 Q321 I325	A320-K323 WeakPolarHBondContact O-CG 3.48Å; A320-K323 PolarHBondContact O-NZ 3.16Å; Q321-K323 PolarHBondContact O-N 2.89Å; K323-I325 PolarHBondContact O-N 2.88Å
324	P	87	Confident	73.2	Confident	68 Å²	68	87 Å²	87	44%	0.442	44%	0.439	S	S	.	.			trans	-70.6	132.4	179.1	29.3	-35.3	0	0	0	111.3	L334 K335 F336	P324-L334 HydrophobicContact CB-CB 4Å; P324-L334 HydrophobicContact CB-CD1 4.31Å; P324-L334 HydrophobicContact CB-CD2 4.26Å; P324-L334 HydrophobicContact CB-CG 4.42Å; P324-L334 HydrophobicContact CG-CD1 4.33Å; P324-L334 HydrophobicContact CG-CD2 4.46Å; P324-K335 CarbonylContact C-O 3.49Å; P324-K335 WeakPolarHBondContact CA-O 3.48Å; P324-F336 HydrophobicContact CB-CD1 4.44Å; P324-F336 HydrophobicContact CB-CE1 4.13Å
325	I	90.8	Very high	75.3	Confident	91 Å²	91	84 Å²	84	47%	0.467	42%	0.419	S	S	.	.	S	Bend	trans	-93.2	-22.8	-175.7	53.6	159.4	0	0	0	113.8	K323 K335 D337	K323-I325 PolarHBondContact O-N 2.88Å; I325-K335 HydrophobicContact CD1-CD 3.75Å; I325-K335 HydrophobicContact CD1-CG 4.08Å; I325-K335 HydrophobicContact CG1-CB 4.24Å; I325-K335 HydrophobicContact CG1-CD 3.93Å; I325-K335 HydrophobicContact CG1-CG 3.97Å; I325-K335 WeakPolarHBondContact CG1-O 3.45Å; I325-K335 PolarHBondContact N-O 3.12Å; I325-D337 HydrophobicContact CD1-CB 3.91Å; I325-D337 HydrophobicContact CG2-CB 4.21Å
326	D	90.5	Very high	77.3	Confident	45 Å²	45	78.3 Å²	78.3	24%	0.241	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	164.1	174.7	-162.5	2.6	0	0	0	109.3	K335 W362 Y411	D326-K335 HydrophobicContact CB-CB 3.86Å; D326-K335 HydrophobicContact CB-CD 3.73Å; D326-K335 HydrophobicContact CB-CG 4.44Å; D326-K335 PolarHBondContact O-N 2.99Å; D326-W362 HydrophobicContact CB-CH2 4.13Å; D326-W362 HydrophobicContact CB-CZ2 3.94Å; D326-W362 WeakPolarHBondContact OD2-CZ2 3.42Å; D326-Y411 PolarHBondContact OD2-OH 3Å
327	K	92.7	Very high	79.5	Confident	138 Å²	138	79.2 Å²	79.2	60%	0.6	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.1	145.1	177.9	63.7	-179.8	-179.2	176.4	0	112.1	F333 L334	K327-F333 WeakPolarHBondContact CA-O 3.34Å; K327-L334 HydrophobicContact CB-CD2 3.87Å
328	S	93	Very high	81.6	Confident	3 Å²	3	77.4 Å²	77.4	2%	0.021	39%	0.386	C	S	.	.			trans	-53	157.1	169	54.9	0	0	0	0	113.1	N330 G331 R332 F333 W400	S328-N330 VanDerWaalsContact C-N 3.28Å; S328-N330 WeakPolarHBondContact CB-OD1 3.47Å; S328-N330 PolarHBondContact O-N 3.07Å; S328-N330 PolarHBondContact OG-OD1 2.99Å; S328-G331 WeakPolarHBondContact O-CA 3.46Å; S328-G331 PolarHBondContact O-N 3.49Å; S328-G331 PolarHBondContact OG-N 3.28Å; S328-R332 PolarHBondContact OG-N 3.03Å; S328-F333 PolarHBondContact N-O 2.87Å; S328-F333 PolarHBondContact OG-N 3.43Å; S328-F333 PolarHBondContact OG-O 3.43Å; S328-W400 VanDerWaalsContact CB-CH2 3.41Å
329	K	89.9	Confident	83.9	Confident	156 Å²	156	73 Å²	73	68%	0.678	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-31.2	-175.3	-62.6	179.4	-177.4	175.7	0	113.8	W400 E401	K329-W400 HydrophobicContact CD-CB 4.23Å; K329-W400 HydrophobicContact CD-CG 4.34Å; K329-W400 HydrophobicContact CG-CG 4.42Å; K329-E401 WeakPolarHBondContact CE-O 3.39Å; K329-E401 PolarHBondContact NZ-O 3.11Å
330	N	91	Very high	85.8	Confident	102 Å²	102	67.6 Å²	67.6	55%	0.545	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-6.4	173.3	56.2	11	0	0	0	113.1	S328 R332	S328-N330 VanDerWaalsContact C-N 3.28Å; S328-N330 WeakPolarHBondContact CB-OD1 3.47Å; S328-N330 PolarHBondContact O-N 3.07Å; S328-N330 PolarHBondContact OG-OD1 2.99Å; N330-R332 VanDerWaalsContact C-N 3.26Å; N330-R332 PolarHBondContact O-N 3.23Å; N330-R332 WeakPolarHBondContact OD1-CB 3.41Å; N330-R332 PolarHBondContact OD1-N 3.06Å; N330-R332 VanDerWaalsContact OD1-N 3.13Å
331	G	92	Very high	87.5	Confident	29 Å²	29	67.7 Å²	67.7	30%	0.299	34%	0.342	S	S	.	.	S	Bend	trans	78.8	-2.9	-177.1	0	0	0	0	0	115.4	S328	S328-G331 WeakPolarHBondContact O-CA 3.46Å; S328-G331 PolarHBondContact O-N 3.49Å; S328-G331 PolarHBondContact OG-N 3.28Å
332	R	96.1	Very high	88.9	Confident	59 Å²	59	70.4 Å²	70.4	22%	0.223	35%	0.347	C	S	.	.			trans	-64.4	-47.2	-176.2	176.5	178.8	176.1	162.1	-9.4	113.1	S328 N330 D353 T354 E355	S328-R332 PolarHBondContact OG-N 3.03Å; N330-R332 VanDerWaalsContact C-N 3.26Å; N330-R332 PolarHBondContact O-N 3.23Å; N330-R332 WeakPolarHBondContact OD1-CB 3.41Å; N330-R332 PolarHBondContact OD1-N 3.06Å; N330-R332 VanDerWaalsContact OD1-N 3.13Å; R332-D353 WeakPolarHBondContact CG-OD1 3.33Å; R332-D353 IonicContact CZ-OD1 2.69Å; R332-D353 IonicContact CZ-OD2 3.64Å; R332-D353 IonicContact NE-OD1 3.73Å; R332-D353 PolarHBondContact NE-OD1 3.17Å; R332-D353 IonicContact NE-OD2 2.81Å; R332-D353 PolarHBondContact NE-OD2 3.17Å; R332-D353 IonicContact NH2-OD1 3.32Å; R332-D353 IonicContact NH2-OD2 2.63Å; R332-D353 PolarHBondContact NH2-OD2 3.07Å; R332-T354 WeakPolarHBondContact O-CG2 3.35Å; R332-T354 PolarHBondContact O-N 2.87Å; R332-T354 PolarHBondContact O-OG1 2.97Å; R332-E355 VanDerWaalsContact CD-CD 3.41Å; R332-E355 WeakPolarHBondContact CD-OE1 3.42Å; R332-E355 WeakPolarHBondContact CD-OE2 3.38Å; R332-E355 HydrophobicContact CG-CB 4.43Å; R332-E355 HydrophobicContact CG-CG 3.97Å; R332-E355 IonicContact CZ-OE2 3.18Å; R332-E355 IonicContact NE-OE2 3.31Å; R332-E355 PolarHBondContact NE-OE2 3.26Å; R332-E355 IonicContact NH1-OE2 3.97Å; R332-E355 PolarHBondContact NH1-OE2 3.01Å; R332-E355 IonicContact NH2-OE2 2.76Å
333	F	96.7	Very high	89.1	Confident	3 Å²	3	67.9 Å²	67.9	1%	0.013	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	133.6	178.2	-49.8	-71.2	0	0	0	110.9	K327 S328 L352 D353 V360 W362 Y397 D398 W400 V415	K327-F333 WeakPolarHBondContact CA-O 3.34Å; S328-F333 PolarHBondContact N-O 2.87Å; S328-F333 PolarHBondContact OG-N 3.43Å; S328-F333 PolarHBondContact OG-O 3.43Å; F333-L352 WeakPolarHBondContact CA-O 3.43Å; F333-D353 HydrophobicContact CD1-CB 3.86Å; F333-D353 HydrophobicContact CE1-CB 3.79Å; F333-V360 HydrophobicContact CD1-CG2 4.28Å; F333-W362 HydrophobicContact CB-CE3 4.41Å; F333-W362 HydrophobicContact CB-CZ3 4.24Å; F333-Y397 HydrophobicContact CE1-CG 4.43Å; F333-Y397 HydrophobicContact CZ-CG 4.45Å; F333-D398 HydrophobicContact CE2-CB 3.71Å; F333-D398 HydrophobicContact CZ-CB 4.4Å; F333-W400 HydrophobicContact CB-CH2 4.33Å; F333-W400 HydrophobicContact CD2-CH2 4.13Å; F333-W400 AromaticContact CD2-CZ3 3.96Å; F333-W400 HydrophobicContact CD2-CZ3 3.96Å; F333-V415 HydrophobicContact CB-CG2 4.29Å; F333-V415 HydrophobicContact CD1-CG1 3.73Å; F333-V415 HydrophobicContact CD2-CB 4.47Å; F333-V415 HydrophobicContact CD2-CG1 4.44Å; F333-V415 HydrophobicContact CD2-CG2 4.04Å; F333-V415 HydrophobicContact CE1-CG1 3.95Å; F333-V415 HydrophobicContact CG-CB 4.45Å; F333-V415 HydrophobicContact CG-CG1 3.99Å; F333-V415 HydrophobicContact CG-CG2 4.06Å; F333-V415 HydrophobicContact CZ-CG1 4.41Å
334	L	95.6	Very high	88.3	Confident	36 Å²	36	65.8 Å²	65.8	19%	0.188	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	147.5	172.6	-59.1	177.8	0	0	0	110.4	P324 K327 F336 G351 L352 T354	P324-L334 HydrophobicContact CB-CB 4Å; P324-L334 HydrophobicContact CB-CD1 4.31Å; P324-L334 HydrophobicContact CB-CD2 4.26Å; P324-L334 HydrophobicContact CB-CG 4.42Å; P324-L334 HydrophobicContact CG-CD1 4.33Å; P324-L334 HydrophobicContact CG-CD2 4.46Å; K327-L334 HydrophobicContact CB-CD2 3.87Å; L334-F336 HydrophobicContact CB-CZ 4.33Å; L334-G351 CarbonylContact O-C 3.58Å; L334-G351 WeakPolarHBondContact O-CA 3.37Å; L334-L352 PolarHBondContact N-O 2.95Å; L334-L352 PolarHBondContact O-N 3.41Å; L334-T354 HydrophobicContact CD1-CG2 3.64Å; L334-T354 HydrophobicContact CG-CG2 3.76Å
335	K	95.5	Very high	87.2	Confident	17 Å²	17	65.7 Å²	65.7	7%	0.074	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.1	173.9	-173	-168	-177.1	179.2	0	110.6	P324 I325 D326 F349 W362 E364	P324-K335 CarbonylContact C-O 3.49Å; P324-K335 WeakPolarHBondContact CA-O 3.48Å; I325-K335 HydrophobicContact CD1-CD 3.75Å; I325-K335 HydrophobicContact CD1-CG 4.08Å; I325-K335 HydrophobicContact CG1-CB 4.24Å; I325-K335 HydrophobicContact CG1-CD 3.93Å; I325-K335 HydrophobicContact CG1-CG 3.97Å; I325-K335 WeakPolarHBondContact CG1-O 3.45Å; I325-K335 PolarHBondContact N-O 3.12Å; D326-K335 HydrophobicContact CB-CB 3.86Å; D326-K335 HydrophobicContact CB-CD 3.73Å; D326-K335 HydrophobicContact CB-CG 4.44Å; D326-K335 PolarHBondContact O-N 2.99Å; K335-F349 HydrophobicContact CG-CB 4.12Å; K335-F349 HydrophobicContact CG-CG 4.44Å; K335-W362 HydrophobicContact CB-CD2 3.72Å; K335-W362 HydrophobicContact CB-CE3 3.82Å; K335-W362 HydrophobicContact CB-CG 4.26Å; K335-W362 HydrophobicContact CB-CH2 3.98Å; K335-W362 HydrophobicContact CB-CZ2 3.92Å; K335-W362 HydrophobicContact CB-CZ3 3.95Å; K335-W362 HydrophobicContact CD-CD2 4.32Å; K335-W362 HydrophobicContact CD-CG 4.43Å; K335-W362 HydrophobicContact CD-CZ2 4.07Å; K335-W362 HydrophobicContact CG-CD2 3.92Å; K335-W362 HydrophobicContact CG-CG 3.97Å; K335-W362 HydrophobicContact CG-CZ2 4.37Å; K335-E364 WeakPolarHBondContact CE-OE1 3.44Å; K335-E364 IonicContact NZ-OE1 2.64Å; K335-E364 PolarHBondContact NZ-OE1 3.3Å; K335-E364 IonicContact NZ-OE2 3.48Å; K335-E364 PolarHBondContact NZ-OE2 2.99Å
336	F	93.3	Very high	86.5	Confident	15 Å²	15	63.3 Å²	63.3	7%	0.066	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	159.1	169.9	-52.4	-81	0	0	0	110.8	E322 P324 L334 E338 R350 L352	E322-F336 HydrophobicContact CG-CD1 3.66Å; E322-F336 HydrophobicContact CG-CE1 3.78Å; E322-F336 HydrophobicContact CG-CG 4.31Å; E322-F336 WeakPolarHBondContact O-CE1 3.34Å; P324-F336 HydrophobicContact CB-CD1 4.44Å; P324-F336 HydrophobicContact CB-CE1 4.13Å; L334-F336 HydrophobicContact CB-CZ 4.33Å; F336-E338 PolarHBondContact O-N 3.27Å; F336-R350 HydrophobicContact CD2-CG 4.47Å; F336-R350 PolarHBondContact N-O 3.25Å; F336-L352 HydrophobicContact CE2-CB 3.67Å; F336-L352 HydrophobicContact CZ-CB 4Å
337	D	90.8	Very high	86.2	Confident	128 Å²	128	61.9 Å²	61.9	68%	0.684	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	34.1	-179.2	-156.8	27.7	0	0	0	113.6	I325	I325-D337 HydrophobicContact CD1-CB 3.91Å; I325-D337 HydrophobicContact CG2-CB 4.21Å
338	E	90.6	Very high	86.1	Confident	61 Å²	61	56.4 Å²	56.4	29%	0.285	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	91.8	177.3	-165.7	-167	118	0	0	109	R78 F336 L340 F349 R350	R78-E338 IonicContact CZ-OE1 3.49Å; R78-E338 IonicContact NH1-OE1 2.76Å; R78-E338 PolarHBondContact NH1-OE1 3.42Å; F336-E338 PolarHBondContact O-N 3.27Å; E338-L340 HydrophobicContact CB-CD2 4.5Å; E338-L340 HydrophobicContact CG-CD2 3.97Å; E338-L340 WeakPolarHBondContact O-CD2 3.38Å; E338-L340 PolarHBondContact O-N 2.95Å; E338-L340 WeakPolarHBondContact OE1-CD2 3.44Å; E338-F349 CarbonylContact O-C 3.59Å; E338-F349 VanDerWaalsContact O-CA 3.3Å; E338-F349 WeakPolarHBondContact O-CA 3.26Å; E338-R350 HydrophobicContact CB-CB 3.88Å; E338-R350 VanDerWaalsContact CD-CD 3.44Å; E338-R350 HydrophobicContact CG-CB 4.42Å; E338-R350 PolarHBondContact O-N 3.42Å; E338-R350 WeakPolarHBondContact OE1-CD 3.41Å; E338-R350 WeakPolarHBondContact OE2-CD 3.43Å; E338-R350 IonicContact OE2-CZ 3.47Å; E338-R350 IonicContact OE2-NE 3.67Å; E338-R350 IonicContact OE2-NH1 3.69Å; E338-R350 PolarHBondContact OE2-NH1 3.45Å
339	E	91.4	Very high	86.1	Confident	45 Å²	45	57.3 Å²	57.3	21%	0.21	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	107	174.8	-174.9	-177.2	-174.1	0	0	110	P79 K81 R342 T347 V348 F349	P79-E339 VanDerWaalsContact CG-O 3.32Å; P79-E339 WeakPolarHBondContact CG-O 3.49Å; K81-E339 IonicContact NZ-OE2 3.74Å; K81-E339 PolarHBondContact NZ-OE2 2.97Å; E339-R342 WeakPolarHBondContact OE1-CD 3.41Å; E339-R342 IonicContact OE1-NH1 3.09Å; E339-T347 HydrophobicContact CG-CG2 4.11Å; E339-V348 CarbonylContact C-O 3.35Å; E339-F349 HydrophobicContact CB-CE1 4.48Å
340	L	87	Confident	86.4	Confident	32 Å²	32	52.8 Å²	52.8	17%	0.168	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-28.2	-177.5	-54.8	-168.3	0	0	0	113.3	E338 V348 R350 L418	E338-L340 HydrophobicContact CB-CD2 4.5Å; E338-L340 HydrophobicContact CG-CD2 3.97Å; E338-L340 WeakPolarHBondContact O-CD2 3.38Å; E338-L340 PolarHBondContact O-N 2.95Å; E338-L340 WeakPolarHBondContact OE1-CD2 3.44Å; L340-V348 HydrophobicContact CB-CB 4.33Å; L340-V348 HydrophobicContact CB-CG1 4.15Å; L340-V348 HydrophobicContact CD1-CG1 4.18Å; L340-V348 HydrophobicContact CG-CG1 4.48Å; L340-V348 PolarHBondContact N-O 2.97Å; L340-R350 HydrophobicContact CD1-CB 4.34Å; L340-R350 HydrophobicContact CD2-CB 4.01Å; L340-R350 HydrophobicContact CG-CB 4.38Å; L340-L418 HydrophobicContact CD1-CD1 3.46Å; L340-L418 VanDerWaalsContact CD1-CD1 3.46Å
341	G	82.1	Confident	86.6	Confident	32 Å²	32	47.9 Å²	47.9	33%	0.33	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.2	158	-176	0	0	0	0	0	111.7	V348	G341-V348 PolarHBondContact N-O 3.41Å; G341-V348 PolarHBondContact O-N 3.25Å
342	R	81.7	Confident	86.8	Confident	172 Å²	172	49.1 Å²	49.1	65%	0.649	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.6	127.3	-172.2	-178.2	171.9	174.3	174.6	2.2	111.6	E339 K346 T347	E339-R342 WeakPolarHBondContact OE1-CD 3.41Å; E339-R342 IonicContact OE1-NH1 3.09Å; R342-K346 WeakPolarHBondContact CA-O 3.43Å; R342-T347 HydrophobicContact CB-CG2 4.47Å; R342-T347 HydrophobicContact CG-CG2 4.45Å
343	G	67.1	Low	86.8	Confident	49 Å²	49	46.3 Å²	46.3	51%	0.505	25%	0.247	S	C	.	.			trans	-106	-162.3	174.3	0	0	0	0	0	112.6	K346	G343-K346 PolarHBondContact N-O 2.98Å
344	S	59.9	Low	86.7	Confident	101 Å²	101	49.7 Å²	49.7	71%	0.706	27%	0.268	S	S	*	.	S	Bend	trans	-68.6	-34.8	178	43.6	0	0	0	0	114
345	F	64	Low	86.6	Confident	65 Å²	65	54.1 Å²	54.1	29%	0.285	29%	0.288	S	S	.	.	S	Bend	trans	-125	-11.6	-175.8	-54	-68.7	0	0	0	114.3	L365 Q366 K369 V498	F345-L365 WeakPolarHBondContact O-CA 3.49Å; F345-Q366 PolarHBondContact O-N 3.32Å; F345-K369 HydrophobicContact CE1-CD 4.21Å; F345-V498 HydrophobicContact CE2-CB 3.93Å; F345-V498 HydrophobicContact CE2-CG1 4.08Å; F345-V498 HydrophobicContact CE2-CG2 4.41Å; F345-V498 HydrophobicContact CZ-CB 3.86Å; F345-V498 HydrophobicContact CZ-CG1 4.07Å; F345-V498 HydrophobicContact CZ-CG2 3.83Å
346	K	76.6	Confident	86.5	Confident	42 Å²	42	57 Å²	57	18%	0.183	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	132.7	-169	-172.3	-165.2	-168.2	-160.8	0	110.5	R342 G343 V348 C363 E364 L365 D483	R342-K346 WeakPolarHBondContact CA-O 3.43Å; G343-K346 PolarHBondContact N-O 2.98Å; K346-V348 HydrophobicContact CD-CG2 3.9Å; K346-V348 HydrophobicContact CG-CG2 4.11Å; K346-C363 WeakPolarHBondContact CE-SG 3.36Å; K346-C363 HydrophobicContact CG-CB 4.48Å; K346-E364 WeakPolarHBondContact CA-O 3.45Å; K346-L365 HydrophobicContact CB-CD2 3.68Å; K346-L365 HydrophobicContact CG-CD2 3.86Å; K346-D483 IonicContact NZ-OD1 3.91Å; K346-D483 PolarHBondContact NZ-OD1 2.92Å; K346-D483 IonicContact NZ-OD2 3.24Å; K346-D483 PolarHBondContact NZ-OD2 3.37Å
347	T	84.4	Confident	86.5	Confident	15 Å²	15	59 Å²	59	9%	0.092	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.6	160.9	-49.1	0	0	0	0	108.4	E339 R342 F349 C363 E364	E339-T347 HydrophobicContact CG-CG2 4.11Å; R342-T347 HydrophobicContact CB-CG2 4.47Å; R342-T347 HydrophobicContact CG-CG2 4.45Å; T347-F349 HydrophobicContact CG2-CD2 4.09Å; T347-F349 HydrophobicContact CG2-CE2 3.4Å; T347-F349 HydrophobicContact CG2-CZ 3.69Å; T347-C363 CarbonylContact O-C 3.56Å; T347-C363 WeakPolarHBondContact O-CA 3.41Å; T347-E364 PolarHBondContact N-O 2.93Å; T347-E364 PolarHBondContact O-N 3.46Å
348	V	89.3	Confident	86.6	Confident	22 Å²	22	56.3 Å²	56.3	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.7	178.8	-171.8	0	0	0	0	109	E339 L340 G341 K346 A361 W362	E339-V348 CarbonylContact C-O 3.35Å; L340-V348 HydrophobicContact CB-CB 4.33Å; L340-V348 HydrophobicContact CB-CG1 4.15Å; L340-V348 HydrophobicContact CD1-CG1 4.18Å; L340-V348 HydrophobicContact CG-CG1 4.48Å; L340-V348 PolarHBondContact N-O 2.97Å; G341-V348 PolarHBondContact N-O 3.41Å; G341-V348 PolarHBondContact O-N 3.25Å; K346-V348 HydrophobicContact CD-CG2 3.9Å; K346-V348 HydrophobicContact CG-CG2 4.11Å; V348-A361 HydrophobicContact CG1-CB 4.02Å; V348-W362 CarbonylContact C-O 3.46Å; V348-W362 WeakPolarHBondContact CA-O 3.47Å
349	F	93.7	Very high	86.7	Confident	22 Å²	22	55.3 Å²	55.3	10%	0.096	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	158.6	176.9	-65.7	-93.6	0	0	0	110.5	K335 E338 E339 T347 W362 E364	K335-F349 HydrophobicContact CG-CB 4.12Å; K335-F349 HydrophobicContact CG-CG 4.44Å; E338-F349 CarbonylContact O-C 3.59Å; E338-F349 VanDerWaalsContact O-CA 3.3Å; E338-F349 WeakPolarHBondContact O-CA 3.26Å; E339-F349 HydrophobicContact CB-CE1 4.48Å; T347-F349 HydrophobicContact CG2-CD2 4.09Å; T347-F349 HydrophobicContact CG2-CE2 3.4Å; T347-F349 HydrophobicContact CG2-CZ 3.69Å; F349-W362 HydrophobicContact CB-CB 4.3Å; F349-W362 PolarHBondContact N-O 3.08Å; F349-W362 PolarHBondContact O-N 3.09Å; F349-E364 HydrophobicContact CD2-CG 4.39Å; F349-E364 HydrophobicContact CE2-CG 4.43Å; F349-E364 WeakPolarHBondContact CE2-OE2 3.32Å
350	R	94.8	Very high	86.9	Confident	61 Å²	61	53.1 Å²	53.1	23%	0.23	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	140	166.1	-170.4	174.7	156.1	-141.8	-16.7	109.6	E322 F336 E338 L340 L418	E322-R350 IonicContact OE1-CZ 3.78Å; E322-R350 IonicContact OE1-NH1 3.52Å; E322-R350 PolarHBondContact OE1-NH1 3.05Å; E322-R350 IonicContact OE1-NH2 2.66Å; E322-R350 PolarHBondContact OE1-NH2 3.3Å; E322-R350 IonicContact OE2-NH2 3.21Å; E322-R350 PolarHBondContact OE2-NH2 2.98Å; F336-R350 HydrophobicContact CD2-CG 4.47Å; F336-R350 PolarHBondContact N-O 3.25Å; E338-R350 HydrophobicContact CB-CB 3.88Å; E338-R350 VanDerWaalsContact CD-CD 3.44Å; E338-R350 HydrophobicContact CG-CB 4.42Å; E338-R350 PolarHBondContact O-N 3.42Å; E338-R350 WeakPolarHBondContact OE1-CD 3.41Å; E338-R350 WeakPolarHBondContact OE2-CD 3.43Å; E338-R350 IonicContact OE2-CZ 3.47Å; E338-R350 IonicContact OE2-NE 3.67Å; E338-R350 IonicContact OE2-NH1 3.69Å; E338-R350 PolarHBondContact OE2-NH1 3.45Å; L340-R350 HydrophobicContact CD1-CB 4.34Å; L340-R350 HydrophobicContact CD2-CB 4.01Å; L340-R350 HydrophobicContact CG-CB 4.38Å; R350-L418 HydrophobicContact CG-CD2 4.49Å
351	G	95.4	Very high	87.3	Confident	0 Å²	0	52 Å²	52	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	178.5	168.4	0	0	0	0	0	112.5	L334 A359 V360	L334-G351 CarbonylContact O-C 3.58Å; L334-G351 WeakPolarHBondContact O-CA 3.37Å; G351-A359 WeakPolarHBondContact O-CA 3.27Å; G351-V360 PolarHBondContact N-O 3.28Å; G351-V360 PolarHBondContact O-N 3.23Å
352	L	96	Very high	87.8	Confident	54 Å²	54	50.5 Å²	50.5	28%	0.283	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	133.4	175.4	177.4	70.1	0	0	0	109.1	F333 L334 F336 G357	F333-L352 WeakPolarHBondContact CA-O 3.43Å; L334-L352 PolarHBondContact N-O 2.95Å; L334-L352 PolarHBondContact O-N 3.41Å; F336-L352 HydrophobicContact CE2-CB 3.67Å; F336-L352 HydrophobicContact CZ-CB 4Å; L352-G357 WeakPolarHBondContact CD1-O 3.49Å
353	D	96.5	Very high	88.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	109.7	165.3	177	8.4	0	0	0	109.3	R332 F333 E355 T356 G357 V358 V360	R332-D353 WeakPolarHBondContact CG-OD1 3.33Å; R332-D353 IonicContact CZ-OD1 2.69Å; R332-D353 IonicContact CZ-OD2 3.64Å; R332-D353 IonicContact NE-OD1 3.73Å; R332-D353 PolarHBondContact NE-OD1 3.17Å; R332-D353 IonicContact NE-OD2 2.81Å; R332-D353 PolarHBondContact NE-OD2 3.17Å; R332-D353 IonicContact NH2-OD1 3.32Å; R332-D353 IonicContact NH2-OD2 2.63Å; R332-D353 PolarHBondContact NH2-OD2 3.07Å; F333-D353 HydrophobicContact CD1-CB 3.86Å; F333-D353 HydrophobicContact CE1-CB 3.79Å; D353-E355 VanDerWaalsContact C-N 3.27Å; D353-E355 PolarHBondContact O-N 2.97Å; D353-E355 PolarHBondContact OD1-N 3.46Å; D353-E355 VanDerWaalsContact OD1-N 3.14Å; D353-T356 WeakPolarHBondContact CB-OG1 2.99Å; D353-T356 PolarHBondContact O-N 3.43Å; D353-T356 VanDerWaalsContact OD2-CG2 3.26Å; D353-T356 WeakPolarHBondContact OD2-CG2 3.5Å; D353-T356 PolarHBondContact OD2-OG1 3.36Å; D353-G357 WeakPolarHBondContact O-CA 3.3Å; D353-G357 PolarHBondContact O-N 2.95Å; D353-V358 PolarHBondContact N-O 3.26Å; D353-V360 HydrophobicContact CB-CG1 4.03Å
354	T	94.4	Very high	89.2	Confident	74 Å²	74	41.3 Å²	41.3	45%	0.454	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-17.8	-176	63.6	0	0	0	0	113.5	R332 L334	R332-T354 WeakPolarHBondContact O-CG2 3.35Å; R332-T354 PolarHBondContact O-N 2.87Å; R332-T354 PolarHBondContact O-OG1 2.97Å; L334-T354 HydrophobicContact CD1-CG2 3.64Å; L334-T354 HydrophobicContact CG-CG2 3.76Å
355	E	94.5	Very high	90	Very high	130 Å²	130	37.2 Å²	37.2	61%	0.607	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78	-31	175.8	-73.7	175.3	-164.4	0	0	112.1	R332 D353	R332-E355 VanDerWaalsContact CD-CD 3.41Å; R332-E355 WeakPolarHBondContact CD-OE1 3.42Å; R332-E355 WeakPolarHBondContact CD-OE2 3.38Å; R332-E355 HydrophobicContact CG-CB 4.43Å; R332-E355 HydrophobicContact CG-CG 3.97Å; R332-E355 IonicContact CZ-OE2 3.18Å; R332-E355 IonicContact NE-OE2 3.31Å; R332-E355 PolarHBondContact NE-OE2 3.26Å; R332-E355 IonicContact NH1-OE2 3.97Å; R332-E355 PolarHBondContact NH1-OE2 3.01Å; R332-E355 IonicContact NH2-OE2 2.76Å; D353-E355 VanDerWaalsContact C-N 3.27Å; D353-E355 PolarHBondContact O-N 2.97Å; D353-E355 PolarHBondContact OD1-N 3.46Å; D353-E355 VanDerWaalsContact OD1-N 3.14Å
356	T	93.6	Very high	90.2	Very high	78 Å²	78	37.7 Å²	37.7	48%	0.479	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-16	-175	62.7	0	0	0	0	114	D353 V358	D353-T356 WeakPolarHBondContact CB-OG1 2.99Å; D353-T356 PolarHBondContact O-N 3.43Å; D353-T356 VanDerWaalsContact OD2-CG2 3.26Å; D353-T356 WeakPolarHBondContact OD2-CG2 3.5Å; D353-T356 PolarHBondContact OD2-OG1 3.36Å; T356-V358 PolarHBondContact O-N 3.46Å; T356-V358 WeakPolarHBondContact OG1-CB 3.49Å; T356-V358 PolarHBondContact OG1-N 3.15Å
357	G	92	Very high	89.6	Confident	57 Å²	57	36.4 Å²	36.4	59%	0.588	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	9.9	-171.4	0	0	0	0	0	113.9	L352 D353	L352-G357 WeakPolarHBondContact CD1-O 3.49Å; D353-G357 WeakPolarHBondContact O-CA 3.3Å; D353-G357 PolarHBondContact O-N 2.95Å
358	V	93.2	Very high	88.3	Confident	70 Å²	70	39.7 Å²	39.7	42%	0.424	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.5	-175.1	179.9	0	0	0	0	110.6	D353 T356	D353-V358 PolarHBondContact N-O 3.26Å; T356-V358 PolarHBondContact O-N 3.46Å; T356-V358 WeakPolarHBondContact OG1-CB 3.49Å; T356-V358 PolarHBondContact OG1-N 3.15Å
359	A	94.3	Very high	86.7	Confident	40 Å²	40	46.4 Å²	46.4	33%	0.331	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	134	173.6	0	0	0	0	0	111	G351 L418	G351-A359 WeakPolarHBondContact O-CA 3.27Å; A359-L418 HydrophobicContact CB-CD2 3.71Å; A359-L418 VanDerWaalsContact O-CB 3.27Å; A359-L418 WeakPolarHBondContact O-CB 3.44Å
360	V	95.1	Very high	85	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	162.1	-176.3	-65.2	0	0	0	0	111.2	F333 G351 D353 Y397 V415 T416	F333-V360 HydrophobicContact CD1-CG2 4.28Å; G351-V360 PolarHBondContact N-O 3.28Å; G351-V360 PolarHBondContact O-N 3.23Å; D353-V360 HydrophobicContact CB-CG1 4.03Å; V360-Y397 HydrophobicContact CG1-CD2 4.03Å; V360-Y397 HydrophobicContact CG1-CE2 3.71Å; V360-V415 HydrophobicContact CB-CG1 3.73Å; V360-V415 HydrophobicContact CG1-CG1 4.16Å; V360-V415 HydrophobicContact CG2-CG1 3.65Å; V360-T416 WeakPolarHBondContact CB-O 3.49Å
361	A	94.6	Very high	83.4	Confident	8 Å²	8	50 Å²	50	7%	0.066	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119	169.1	0	0	0	0	0	109.3	V348 V415 T416 L418	V348-A361 HydrophobicContact CG1-CB 4.02Å; A361-V415 WeakPolarHBondContact O-CA 3.38Å; A361-T416 PolarHBondContact N-O 3.07Å; A361-T416 PolarHBondContact O-N 2.88Å; A361-L418 HydrophobicContact CB-CD1 4.17Å
362	W	93.7	Very high	82.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	108.7	176.6	177	-68	0	0	0	108.5	D326 F333 K335 V348 F349 E364 W400 V413	D326-W362 HydrophobicContact CB-CH2 4.13Å; D326-W362 HydrophobicContact CB-CZ2 3.94Å; D326-W362 WeakPolarHBondContact OD2-CZ2 3.42Å; F333-W362 HydrophobicContact CB-CE3 4.41Å; F333-W362 HydrophobicContact CB-CZ3 4.24Å; K335-W362 HydrophobicContact CB-CD2 3.72Å; K335-W362 HydrophobicContact CB-CE3 3.82Å; K335-W362 HydrophobicContact CB-CG 4.26Å; K335-W362 HydrophobicContact CB-CH2 3.98Å; K335-W362 HydrophobicContact CB-CZ2 3.92Å; K335-W362 HydrophobicContact CB-CZ3 3.95Å; K335-W362 HydrophobicContact CD-CD2 4.32Å; K335-W362 HydrophobicContact CD-CG 4.43Å; K335-W362 HydrophobicContact CD-CZ2 4.07Å; K335-W362 HydrophobicContact CG-CD2 3.92Å; K335-W362 HydrophobicContact CG-CG 3.97Å; K335-W362 HydrophobicContact CG-CZ2 4.37Å; V348-W362 CarbonylContact C-O 3.46Å; V348-W362 WeakPolarHBondContact CA-O 3.47Å; F349-W362 HydrophobicContact CB-CB 4.3Å; F349-W362 PolarHBondContact N-O 3.08Å; F349-W362 PolarHBondContact O-N 3.09Å; W362-E364 PolarHBondContact NE1-OE1 2.83Å; W362-W400 HydrophobicContact CE3-CH2 4.36Å; W362-W400 HydrophobicContact CE3-CZ2 4.35Å; W362-W400 HydrophobicContact CH2-CH2 4.29Å; W362-W400 AromaticContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CZ2-CZ2 4.01Å; W362-W400 AromaticContact CZ3-CH2 3.98Å; W362-W400 HydrophobicContact CZ3-CH2 3.98Å; W362-W400 AromaticContact CZ3-CZ2 3.75Å; W362-W400 HydrophobicContact CZ3-CZ2 3.75Å; W362-V413 HydrophobicContact CD2-CG1 3.8Å; W362-V413 HydrophobicContact CE3-CG1 4.39Å; W362-V413 HydrophobicContact CG-CG1 4.13Å; W362-V413 HydrophobicContact CZ2-CG1 4Å; W362-V413 HydrophobicContact CZ2-CG2 4.11Å
363	C	90.4	Very high	80.7	Confident	4 Å²	4	59.6 Å²	59.6	3%	0.027	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.6	-174.9	-60.5	0	0	0	0	110.8	K346 T347 V413 L414	K346-C363 WeakPolarHBondContact CE-SG 3.36Å; K346-C363 HydrophobicContact CG-CB 4.48Å; T347-C363 CarbonylContact O-C 3.56Å; T347-C363 WeakPolarHBondContact O-CA 3.41Å; C363-V413 CarbonylContact O-C 3.51Å; C363-V413 VanDerWaalsContact O-CA 3.29Å; C363-V413 WeakPolarHBondContact O-CA 2.96Å; C363-L414 HydrophobicContact CB-CB 4.28Å; C363-L414 HydrophobicContact CB-CD1 4.36Å; C363-L414 PolarHBondContact N-O 2.83Å; C363-L414 PolarHBondContact O-N 3.28Å
364	E	86.8	Confident	79	Confident	25 Å²	25	61.8 Å²	61.8	12%	0.117	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	117.6	179.1	-59.9	-174.4	150.9	0	0	110.5	K335 K346 T347 F349 W362 Y411 I412 V413	K335-E364 WeakPolarHBondContact CE-OE1 3.44Å; K335-E364 IonicContact NZ-OE1 2.64Å; K335-E364 PolarHBondContact NZ-OE1 3.3Å; K335-E364 IonicContact NZ-OE2 3.48Å; K335-E364 PolarHBondContact NZ-OE2 2.99Å; K346-E364 WeakPolarHBondContact CA-O 3.45Å; T347-E364 PolarHBondContact N-O 2.93Å; T347-E364 PolarHBondContact O-N 3.46Å; F349-E364 HydrophobicContact CD2-CG 4.39Å; F349-E364 HydrophobicContact CE2-CG 4.43Å; F349-E364 WeakPolarHBondContact CE2-OE2 3.32Å; W362-E364 PolarHBondContact NE1-OE1 2.83Å; E364-Y411 HydrophobicContact CB-CD2 4.26Å; E364-Y411 HydrophobicContact CG-CD2 4.16Å; E364-Y411 HydrophobicContact CG-CE2 4.26Å; E364-Y411 WeakPolarHBondContact OE1-CE2 3.09Å; E364-I412 WeakPolarHBondContact CA-O 3.37Å; E364-V413 HydrophobicContact CG-CG2 4.5Å
365	L	75.8	Confident	77.8	Confident	14 Å²	14	60.1 Å²	60.1	7%	0.073	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.9	174.4	-63.9	-177.8	0	0	0	111	F345 K346 E367 F378 Y411 I412 L414	F345-L365 WeakPolarHBondContact O-CA 3.49Å; K346-L365 HydrophobicContact CB-CD2 3.68Å; K346-L365 HydrophobicContact CG-CD2 3.86Å; L365-E367 PolarHBondContact O-N 2.88Å; L365-F378 HydrophobicContact CD1-CE2 3.55Å; L365-F378 HydrophobicContact CD1-CZ 3.64Å; L365-Y411 VanDerWaalsContact O-CA 3.26Å; L365-Y411 WeakPolarHBondContact O-CA 3.34Å; L365-Y411 VanDerWaalsContact O-CB 3.31Å; L365-Y411 WeakPolarHBondContact O-CB 3.39Å; L365-I412 HydrophobicContact CB-CB 4.46Å; L365-I412 PolarHBondContact N-O 3.45Å; L365-I412 PolarHBondContact O-N 3.21Å; L365-L414 HydrophobicContact CD1-CD1 3.68Å; L365-L414 HydrophobicContact CG-CD1 3.68Å
366	Q	70	Confident	76.6	Confident	76 Å²	76	57.5 Å²	57.5	36%	0.355	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	112.9	179.6	-62.6	-170.1	12.1	0	0	111.5	F345 S368	F345-Q366 PolarHBondContact O-N 3.32Å; Q366-S368 VanDerWaalsContact C-N 3.28Å; Q366-S368 PolarHBondContact O-N 3.08Å
367	E	63.9	Low	75.1	Confident	14 Å²	14	56.6 Å²	56.6	7%	0.065	30%	0.304	C	S	.	.			trans	-75.2	-11.9	-170.9	-158.6	-171.9	-106.7	0	0	114.3	L365 K369 L370 R375 K410	L365-E367 PolarHBondContact O-N 2.88Å; E367-K369 PolarHBondContact O-N 3Å; E367-L370 HydrophobicContact CG-CB 4.42Å; E367-L370 HydrophobicContact CG-CD1 4.46Å; E367-L370 PolarHBondContact O-N 2.87Å; E367-R375 IonicContact OE1-CZ 2.75Å; E367-R375 IonicContact OE1-NH1 3.32Å; E367-R375 PolarHBondContact OE1-NH1 2.95Å; E367-R375 IonicContact OE1-NH2 3.64Å; E367-R375 IonicContact OE2-CZ 3.64Å; E367-R375 IonicContact OE2-NH1 3.45Å; E367-R375 PolarHBondContact OE2-NH1 3.47Å; E367-R375 IonicContact OE2-NH2 3.06Å; E367-R375 PolarHBondContact OE2-NH2 2.9Å; E367-K410 HydrophobicContact CB-CB 4.2Å; E367-K410 VanDerWaalsContact CB-O 3.26Å; E367-K410 WeakPolarHBondContact CB-O 3.23Å; E367-K410 PolarHBondContact N-O 3.31Å; E367-K410 WeakPolarHBondContact OE2-CB 3.4Å; E367-K410 WeakPolarHBondContact OE2-CD 3.49Å
368	S	55.6	Low	74	Confident	84 Å²	84	54.8 Å²	54.8	59%	0.587	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	28.6	-167.8	68.3	0	0	0	0	115.9	Q366	Q366-S368 VanDerWaalsContact C-N 3.28Å; Q366-S368 PolarHBondContact O-N 3.08Å
369	K	55.3	Low	73	Confident	163 Å²	163	55.5 Å²	55.5	71%	0.709	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.5	-1.8	170.1	-65.8	-169.3	177.6	-173.2	0	113.8	F345 E367	F345-K369 HydrophobicContact CE1-CD 4.21Å; E367-K369 PolarHBondContact O-N 3Å
370	L	59.1	Low	72	Confident	53 Å²	53	57 Å²	57	28%	0.277	28%	0.275	S	S	.	.			trans	-96.5	126.2	-175.9	-74.4	164.8	0	0	0	111.9	E367 E374 I412	E367-L370 HydrophobicContact CG-CB 4.42Å; E367-L370 HydrophobicContact CG-CD1 4.46Å; E367-L370 PolarHBondContact O-N 2.87Å; L370-E374 HydrophobicContact CD2-CB 3.87Å; L370-I412 HydrophobicContact CD1-CD1 4.48Å
371	N	61.8	Low	70.8	Confident	106 Å²	106	58.3 Å²	58.3	57%	0.567	28%	0.281	S	S	*	.			trans	-75.4	164	176.2	-163.2	-0.6	0	0	0	111.9	T373 E374 R375	N371-T373 VanDerWaalsContact C-N 3.3Å; N371-T373 PolarHBondContact O-N 2.9Å; N371-E374 HydrophobicContact CB-CG 4.23Å; N371-E374 WeakPolarHBondContact CB-OE2 3.43Å; N371-E374 PolarHBondContact N-OE2 3.29Å; N371-E374 PolarHBondContact O-N 3.18Å; N371-E374 VanDerWaalsContact O-N 3.08Å; N371-R375 PolarHBondContact O-N 3.27Å
372	K	69.7	Low	69.9	Low	174 Å²	174	58 Å²	58	76%	0.757	28%	0.279	S	S	*	.	H	α-helix	trans	-54	-43.3	-179	-171.8	-179.3	178.1	-174.4	0	112.4	Q376	K372-Q376 PolarHBondContact O-N 3.04Å; K372-Q376 VanDerWaalsContact O-N 3.12Å
373	T	64.7	Low	69.3	Low	81 Å²	81	62.4 Å²	62.4	50%	0.497	30%	0.299	S	S	.	.	H	α-helix	trans	-68.3	-36.9	178	-44	0	0	0	0	112.6	N371 Q376 R377	N371-T373 VanDerWaalsContact C-N 3.3Å; N371-T373 PolarHBondContact O-N 2.9Å; T373-Q376 PolarHBondContact O-N 3.38Å; T373-R377 WeakPolarHBondContact O-CG 3.4Å; T373-R377 PolarHBondContact O-N 3.21Å
374	E	61.1	Low	68.6	Low	47 Å²	47	65.1 Å²	65.1	22%	0.22	31%	0.312	C	S	.	.	H	α-helix	trans	-71.5	-39.2	178.8	-60.7	173.9	142.4	0	0	111	L370 N371 Q376 R377 F378	L370-E374 HydrophobicContact CD2-CB 3.87Å; N371-E374 HydrophobicContact CB-CG 4.23Å; N371-E374 WeakPolarHBondContact CB-OE2 3.43Å; N371-E374 PolarHBondContact N-OE2 3.29Å; N371-E374 PolarHBondContact O-N 3.18Å; N371-E374 VanDerWaalsContact O-N 3.08Å; E374-Q376 VanDerWaalsContact C-N 3.34Å; E374-Q376 PolarHBondContact O-N 3.2Å; E374-R377 PolarHBondContact O-N 3.39Å; E374-F378 WeakPolarHBondContact O-CB 3.38Å; E374-F378 PolarHBondContact O-N 2.87Å
375	R	67.8	Low	68.3	Low	38 Å²	38	64.5 Å²	64.5	14%	0.143	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-42.2	170.6	-172.6	-157.4	-54.7	-103.1	-17.9	111.9	E367 N371 F378 R379 E401	E367-R375 IonicContact OE1-CZ 2.75Å; E367-R375 IonicContact OE1-NH1 3.32Å; E367-R375 PolarHBondContact OE1-NH1 2.95Å; E367-R375 IonicContact OE1-NH2 3.64Å; E367-R375 IonicContact OE2-CZ 3.64Å; E367-R375 IonicContact OE2-NH1 3.45Å; E367-R375 PolarHBondContact OE2-NH1 3.47Å; E367-R375 IonicContact OE2-NH2 3.06Å; E367-R375 PolarHBondContact OE2-NH2 2.9Å; N371-R375 PolarHBondContact O-N 3.27Å; R375-F378 PolarHBondContact O-N 3.1Å; R375-R379 WeakPolarHBondContact O-CG 3.43Å; R375-R379 PolarHBondContact O-N 3.36Å; R375-E401 IonicContact CZ-OE2 2.83Å; R375-E401 IonicContact NH1-OE2 2.73Å; R375-E401 PolarHBondContact NH1-OE2 3.28Å
376	Q	69.1	Low	68.7	Low	75 Å²	75	65.6 Å²	65.6	35%	0.35	31%	0.314	S	S	.	.	H	α-helix	trans	-65.6	-47.1	178.5	178.8	55.1	30	0	0	111.6	K372 T373 E374 F378 R379 E380	K372-Q376 PolarHBondContact O-N 3.04Å; K372-Q376 VanDerWaalsContact O-N 3.12Å; T373-Q376 PolarHBondContact O-N 3.38Å; E374-Q376 VanDerWaalsContact C-N 3.34Å; E374-Q376 PolarHBondContact O-N 3.2Å; Q376-F378 VanDerWaalsContact C-N 3.31Å; Q376-F378 PolarHBondContact O-N 3.01Å; Q376-R379 PolarHBondContact O-N 2.88Å; Q376-R379 VanDerWaalsContact O-N 3.11Å; Q376-E380 WeakPolarHBondContact CG-OE1 3.33Å; Q376-E380 PolarHBondContact NE2-OE1 3.29Å; Q376-E380 PolarHBondContact O-N 3.49Å; Q376-E380 VanDerWaalsContact O-N 3.12Å
377	R	63.1	Low	69.3	Low	59 Å²	59	68 Å²	68	22%	0.223	33%	0.329	C	S	.	.	H	α-helix	trans	-56.2	-45.1	172.7	-75	164.8	166.5	170.4	-6.5	111.9	T373 E374 R379 E380 E381 K492 F494	T373-R377 WeakPolarHBondContact O-CG 3.4Å; T373-R377 PolarHBondContact O-N 3.21Å; E374-R377 PolarHBondContact O-N 3.39Å; R377-R379 VanDerWaalsContact C-N 3.29Å; R377-R379 PolarHBondContact O-N 3.31Å; R377-E380 PolarHBondContact O-N 2.87Å; R377-E381 WeakPolarHBondContact O-CB 3.41Å; R377-E381 WeakPolarHBondContact O-CG 3.42Å; R377-E381 PolarHBondContact O-N 3.46Å; R377-K492 VanDerWaalsContact CZ-O 3.28Å; R377-K492 PolarHBondContact NE-O 3.27Å; R377-K492 PolarHBondContact NH2-O 2.84Å; R377-F494 PolarHBondContact NH1-O 2.8Å
378	F	68.9	Low	70.4	Confident	19 Å²	19	67.9 Å²	67.9	8%	0.083	33%	0.329	C	S	.	.	H	α-helix	trans	-58.4	-38.3	176.5	-173.8	-78.2	0	0	0	112.5	L365 E374 R375 Q376 A382 I412 L414 G485	L365-F378 HydrophobicContact CD1-CE2 3.55Å; L365-F378 HydrophobicContact CD1-CZ 3.64Å; E374-F378 WeakPolarHBondContact O-CB 3.38Å; E374-F378 PolarHBondContact O-N 2.87Å; R375-F378 PolarHBondContact O-N 3.1Å; Q376-F378 VanDerWaalsContact C-N 3.31Å; Q376-F378 PolarHBondContact O-N 3.01Å; F378-A382 HydrophobicContact CD1-CB 4.22Å; F378-A382 HydrophobicContact CE1-CB 3.87Å; F378-A382 WeakPolarHBondContact O-CB 3.38Å; F378-A382 PolarHBondContact O-N 2.89Å; F378-I412 HydrophobicContact CD1-CD1 3.66Å; F378-I412 HydrophobicContact CD1-CG2 4.35Å; F378-I412 HydrophobicContact CE1-CB 4.38Å; F378-I412 HydrophobicContact CE1-CD1 3.83Å; F378-I412 HydrophobicContact CE1-CG2 3.66Å; F378-I412 HydrophobicContact CG-CD1 4.1Å; F378-I412 HydrophobicContact CZ-CD1 4.34Å; F378-I412 HydrophobicContact CZ-CG2 4.28Å; F378-L414 HydrophobicContact CZ-CD1 4.28Å; F378-L414 HydrophobicContact CZ-CD2 3.95Å; F378-L414 HydrophobicContact CZ-CG 4.31Å; F378-G485 WeakPolarHBondContact CE2-O 3.39Å
379	R	73.1	Confident	72.1	Confident	86 Å²	86	69.3 Å²	69.3	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-68.6	-41.5	176.9	-72.5	-167.3	-64.9	-141	12.6	112.8	R375 Q376 R377 E383 Y399 E401	R375-R379 WeakPolarHBondContact O-CG 3.43Å; R375-R379 PolarHBondContact O-N 3.36Å; Q376-R379 PolarHBondContact O-N 2.88Å; Q376-R379 VanDerWaalsContact O-N 3.11Å; R377-R379 VanDerWaalsContact C-N 3.29Å; R377-R379 PolarHBondContact O-N 3.31Å; R379-E383 WeakPolarHBondContact O-CB 3.47Å; R379-E383 PolarHBondContact O-N 3.33Å; R379-Y399 WeakPolarHBondContact CB-OH 3.48Å; R379-Y399 HydrophobicContact CG-CE2 4.04Å; R379-Y399 PolarHBondContact O-OH 3.22Å; R379-E401 WeakPolarHBondContact CD-OE1 3.38Å; R379-E401 IonicContact CZ-OE1 2.87Å; R379-E401 IonicContact NE-OE1 2.92Å; R379-E401 IonicContact NH1-OE1 3.05Å; R379-E401 PolarHBondContact NH1-OE1 3.24Å
380	E	71.4	Confident	74	Confident	71 Å²	71	63.5 Å²	63.5	33%	0.332	30%	0.301	S	S	.	.	H	α-helix	trans	-62.6	-46.7	173.6	-71.7	168.1	-140	0	0	110.6	Q376 R377 E383 M384	Q376-E380 WeakPolarHBondContact CG-OE1 3.33Å; Q376-E380 PolarHBondContact NE2-OE1 3.29Å; Q376-E380 PolarHBondContact O-N 3.49Å; Q376-E380 VanDerWaalsContact O-N 3.12Å; R377-E380 PolarHBondContact O-N 2.87Å; E380-E383 PolarHBondContact O-N 2.92Å; E380-M384 VanDerWaalsContact O-CE 3.27Å; E380-M384 WeakPolarHBondContact O-CE 3.43Å; E380-M384 PolarHBondContact O-N 3.42Å
381	E	70.7	Confident	75.6	Confident	27 Å²	27	65.2 Å²	65.2	13%	0.126	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-51.7	176.7	-74.9	164.7	174.6	0	0	111.5	R377 E383 M384 L385 T488 L489 S493	R377-E381 WeakPolarHBondContact O-CB 3.41Å; R377-E381 WeakPolarHBondContact O-CG 3.42Å; R377-E381 PolarHBondContact O-N 3.46Å; E381-E383 PolarHBondContact O-N 2.92Å; E381-M384 HydrophobicContact CG-CE 4.46Å; E381-M384 PolarHBondContact O-N 3.08Å; E381-L385 WeakPolarHBondContact O-CG 3.3Å; E381-L385 PolarHBondContact O-N 2.96Å; E381-T488 WeakPolarHBondContact OE1-CA 3.38Å; E381-T488 WeakPolarHBondContact OE1-CB 3.47Å; E381-L489 HydrophobicContact CG-CG 4.09Å; E381-L489 PolarHBondContact OE1-N 2.83Å; E381-S493 PolarHBondContact OE1-OG 3.16Å
382	A	76.7	Confident	77.2	Confident	2 Å²	2	60.8 Å²	60.8	2%	0.017	29%	0.292	C	S	.	.	H	α-helix	trans	-72.1	-19.5	-177.5	0	0	0	0	0	115	F378 F396 Y399	F378-A382 HydrophobicContact CD1-CB 4.22Å; F378-A382 HydrophobicContact CE1-CB 3.87Å; F378-A382 WeakPolarHBondContact O-CB 3.38Å; F378-A382 PolarHBondContact O-N 2.89Å; A382-F396 HydrophobicContact CB-CZ 4.41Å; A382-F396 WeakPolarHBondContact O-CE1 3.36Å; A382-Y399 VanDerWaalsContact C-CE1 3.49Å; A382-Y399 HydrophobicContact CB-CD1 3.41Å; A382-Y399 VanDerWaalsContact CB-CD1 3.41Å; A382-Y399 HydrophobicContact CB-CD2 4.16Å; A382-Y399 HydrophobicContact CB-CE1 3.63Å; A382-Y399 HydrophobicContact CB-CE2 4.38Å; A382-Y399 HydrophobicContact CB-CG 3.72Å; A382-Y399 WeakPolarHBondContact O-CD1 3.47Å
383	E	79.6	Confident	78.4	Confident	93 Å²	93	52.6 Å²	52.6	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-71.9	-48.4	172.5	-160.6	65.1	-149.5	0	0	110.5	R379 E380 E381 L385 K386 Y399	R379-E383 WeakPolarHBondContact O-CB 3.47Å; R379-E383 PolarHBondContact O-N 3.33Å; E380-E383 PolarHBondContact O-N 2.92Å; E381-E383 PolarHBondContact O-N 2.92Å; E383-L385 PolarHBondContact O-N 3.37Å; E383-K386 VanDerWaalsContact O-CB 3.27Å; E383-K386 WeakPolarHBondContact O-CB 3.34Å; E383-K386 WeakPolarHBondContact O-CG 3.45Å; E383-K386 PolarHBondContact O-N 3.46Å; E383-K386 WeakPolarHBondContact OE1-CD 3.48Å; E383-K386 IonicContact OE1-NZ 3.66Å; E383-K386 PolarHBondContact OE1-NZ 3.17Å; E383-K386 IonicContact OE2-NZ 2.69Å; E383-K386 PolarHBondContact OE2-NZ 3.46Å; E383-Y399 HydrophobicContact CB-CE1 4.3Å; E383-Y399 WeakPolarHBondContact OE2-CE1 3.34Å
384	M	75.6	Confident	79.8	Confident	60 Å²	60	49.3 Å²	49.3	30%	0.296	24%	0.237	S	C	.	.	H	α-helix	trans	-64.7	-27.1	177.7	-55.7	167.2	-57.6	0	0	112.6	E380 E381 K386 D387 P458 L489	E380-M384 VanDerWaalsContact O-CE 3.27Å; E380-M384 WeakPolarHBondContact O-CE 3.43Å; E380-M384 PolarHBondContact O-N 3.42Å; E381-M384 HydrophobicContact CG-CE 4.46Å; E381-M384 PolarHBondContact O-N 3.08Å; M384-K386 PolarHBondContact O-N 2.87Å; M384-D387 PolarHBondContact O-N 2.66Å; M384-P458 HydrophobicContact SD-CG 4.47Å; M384-L489 HydrophobicContact CE-CD1 3.78Å; M384-L489 HydrophobicContact CE-CD2 3.34Å; M384-L489 HydrophobicContact CE-CG 3.64Å; M384-L489 HydrophobicContact SD-CD1 4.19Å; M384-L489 HydrophobicContact SD-CD2 3.92Å; M384-L489 HydrophobicContact SD-CG 4.48Å
385	L	80.7	Confident	81.3	Confident	12 Å²	12	51 Å²	51	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-57.9	-30.1	174.1	-69.7	-175.8	0	0	0	112.2	E381 E383 D387 L388 F396 L484	E381-L385 WeakPolarHBondContact O-CG 3.3Å; E381-L385 PolarHBondContact O-N 2.96Å; E383-L385 PolarHBondContact O-N 3.37Å; L385-D387 VanDerWaalsContact C-N 3.28Å; L385-D387 PolarHBondContact O-N 3.23Å; L385-L388 HydrophobicContact CD2-CD1 3.56Å; L385-L388 WeakPolarHBondContact O-CB 3.4Å; L385-L388 PolarHBondContact O-N 3.43Å; L385-F396 HydrophobicContact CB-CB 4.28Å; L385-F396 HydrophobicContact CB-CD1 3.8Å; L385-F396 HydrophobicContact CB-CD2 4.04Å; L385-F396 HydrophobicContact CB-CE1 4.02Å; L385-F396 HydrophobicContact CB-CE2 4.25Å; L385-F396 HydrophobicContact CB-CG 3.8Å; L385-F396 HydrophobicContact CB-CZ 4.24Å; L385-F396 HydrophobicContact CD1-CD2 4.19Å; L385-F396 HydrophobicContact CD1-CE2 3.89Å; L385-F396 HydrophobicContact CD1-CZ 4.21Å; L385-F396 VanDerWaalsContact O-CB 3.24Å; L385-F396 WeakPolarHBondContact O-CB 3.5Å; L385-L484 HydrophobicContact CD2-CB 3.95Å; L385-L484 HydrophobicContact CD2-CD1 4.48Å
386	K	85.3	Confident	82.3	Confident	38 Å²	38	49.8 Å²	49.8	17%	0.165	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-33.1	178.2	-62.6	169.1	174.5	174.3	0	113	E383 M384 L388 F396 D398	E383-K386 VanDerWaalsContact O-CB 3.27Å; E383-K386 WeakPolarHBondContact O-CB 3.34Å; E383-K386 WeakPolarHBondContact O-CG 3.45Å; E383-K386 PolarHBondContact O-N 3.46Å; E383-K386 WeakPolarHBondContact OE1-CD 3.48Å; E383-K386 IonicContact OE1-NZ 3.66Å; E383-K386 PolarHBondContact OE1-NZ 3.17Å; E383-K386 IonicContact OE2-NZ 2.69Å; E383-K386 PolarHBondContact OE2-NZ 3.46Å; M384-K386 PolarHBondContact O-N 2.87Å; K386-L388 VanDerWaalsContact C-N 3.32Å; K386-F396 HydrophobicContact CB-CD1 4.43Å; K386-F396 HydrophobicContact CG-CD1 3.77Å; K386-F396 HydrophobicContact CG-CE1 4.02Å; K386-D398 WeakPolarHBondContact CE-OD1 3.18Å; K386-D398 IonicContact NZ-OD1 3.46Å; K386-D398 PolarHBondContact NZ-OD1 2.87Å
387	D	83.1	Confident	83.4	Confident	127 Å²	127	48.5 Å²	48.5	68%	0.679	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-7.8	-179.4	-67.5	-34.6	0	0	0	113.1	M384 L385 Q389	M384-D387 PolarHBondContact O-N 2.66Å; L385-D387 VanDerWaalsContact C-N 3.28Å; L385-D387 PolarHBondContact O-N 3.23Å; D387-Q389 PolarHBondContact O-N 2.67Å
388	L	86.5	Confident	84.7	Confident	10 Å²	10	47.3 Å²	47.3	5%	0.052	23%	0.227	C	C	.	.			trans	-75.4	93.2	179.6	-60.2	-172.5	0	0	0	112	L385 K386 F452 L453 R456 L484	L385-L388 HydrophobicContact CD2-CD1 3.56Å; L385-L388 WeakPolarHBondContact O-CB 3.4Å; L385-L388 PolarHBondContact O-N 3.43Å; K386-L388 VanDerWaalsContact C-N 3.32Å; L388-F452 HydrophobicContact CB-CE1 4.12Å; L388-F452 HydrophobicContact CD2-CE1 3.95Å; L388-F452 HydrophobicContact CD2-CZ 4.32Å; L388-L453 HydrophobicContact CD1-CD2 3.81Å; L388-R456 HydrophobicContact CD2-CG 3.74Å; L388-L484 HydrophobicContact CD1-CD1 4.04Å
389	Q	91.3	Very high	85.6	Confident	114 Å²	114	47.9 Å²	47.9	53%	0.533	23%	0.229	S	C	.	.			trans	-117.1	104.9	178.2	-54.6	-169.7	42.6	0	0	111	D387	D387-Q389 PolarHBondContact O-N 2.67Å
390	H	93.9	Very high	86.3	Confident	41 Å²	41	44.6 Å²	44.6	19%	0.19	22%	0.216	C	C	.	.			trans	-149.9	140.2	177.7	-179.6	-99.5	0	0	0	110.1	N392 I393 F452	H390-N392 PolarHBondContact ND1-N 2.72Å; H390-N392 PolarHBondContact O-N 3.05Å; H390-N392 VanDerWaalsContact O-N 3.13Å; H390-I393 HydrophobicContact CB-CB 4.24Å; H390-I393 HydrophobicContact CB-CG1 3.85Å; H390-I393 PolarHBondContact O-N 2.93Å; H390-F452 HydrophobicContact CB-CB 4.32Å; H390-F452 HydrophobicContact CB-CD1 3.59Å; H390-F452 HydrophobicContact CB-CD2 3.85Å; H390-F452 HydrophobicContact CB-CE1 3.75Å; H390-F452 HydrophobicContact CB-CE2 3.99Å; H390-F452 HydrophobicContact CB-CG 3.64Å; H390-F452 HydrophobicContact CB-CZ 3.95Å; H390-F452 AromaticContact CD2-CD2 3.84Å; H390-F452 AromaticContact CD2-CG 3.82Å; H390-F452 AromaticContact CG-CG 3.7Å
391	P	93.8	Very high	87	Confident	90 Å²	90	43.2 Å²	43.2	58%	0.584	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-31.3	-176	20.2	-34.6	0	0	0	114.3	K480	P391-K480 VanDerWaalsContact O-CE 3.27Å; P391-K480 WeakPolarHBondContact O-CE 3.47Å; P391-K480 VanDerWaalsContact O-CG 3.27Å; P391-K480 WeakPolarHBondContact O-CG 3.26Å
392	N	95.9	Very high	87.6	Confident	12 Å²	12	43.1 Å²	43.1	6%	0.064	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	18.8	178.8	-53.2	114.5	0	0	0	114.2	H390 Q445 V479 K480 I481	H390-N392 PolarHBondContact ND1-N 2.72Å; H390-N392 PolarHBondContact O-N 3.05Å; H390-N392 VanDerWaalsContact O-N 3.13Å; N392-Q445 VanDerWaalsContact CB-O 3.29Å; N392-Q445 WeakPolarHBondContact CB-O 3.47Å; N392-Q445 WeakPolarHBondContact ND2-CB 3.37Å; N392-Q445 PolarHBondContact ND2-OE1 3.29Å; N392-V479 WeakPolarHBondContact CA-O 3.48Å; N392-V479 WeakPolarHBondContact CB-O 3.25Å; N392-V479 PolarHBondContact ND2-O 3.5Å; N392-K480 WeakPolarHBondContact O-CA 3.29Å; N392-I481 PolarHBondContact O-N 3.26Å
393	I	94.5	Very high	87.7	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-115.9	144.3	168.1	-58.9	-61.3	0	0	0	108.4	H390 R395 F452 L453 K480 I481 L484	H390-I393 HydrophobicContact CB-CB 4.24Å; H390-I393 HydrophobicContact CB-CG1 3.85Å; H390-I393 PolarHBondContact O-N 2.93Å; I393-R395 PolarHBondContact O-N 2.89Å; I393-F452 HydrophobicContact CG1-CD1 4.04Å; I393-F452 HydrophobicContact CG1-CE1 4.46Å; I393-L453 HydrophobicContact CD1-CD1 3.86Å; I393-L453 HydrophobicContact CD1-CD2 4.15Å; I393-L453 HydrophobicContact CD1-CG 3.94Å; I393-K480 PolarHBondContact O-NZ 3.34Å; I393-I481 WeakPolarHBondContact CA-O 3.33Å; I393-I481 HydrophobicContact CD1-CB 4Å; I393-I481 HydrophobicContact CD1-CD1 4.27Å; I393-I481 HydrophobicContact CD1-CG1 4.44Å; I393-L484 HydrophobicContact CG2-CD1 3.7Å
394	V	93.2	Very high	87.4	Confident	13 Å²	13	43 Å²	43	8%	0.079	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-71.3	119.3	169.7	176.3	0	0	0	0	107.8	F396 E417 M419 F471 K480 I481	V394-F396 PolarHBondContact O-N 3.2Å; V394-E417 HydrophobicContact CG1-CB 3.93Å; V394-M419 HydrophobicContact CG1-CG 4.18Å; V394-M419 HydrophobicContact CG1-SD 4.47Å; V394-M419 HydrophobicContact CG2-CG 3.81Å; V394-M419 HydrophobicContact CG2-SD 4.01Å; V394-F471 HydrophobicContact CG2-CD2 3.83Å; V394-F471 HydrophobicContact CG2-CE2 4.47Å; V394-F471 HydrophobicContact CG2-CG 4.48Å; V394-K480 HydrophobicContact CG2-CB 3.75Å; V394-I481 PolarHBondContact N-O 3.27Å
395	R	92.2	Very high	86.9	Confident	82 Å²	82	46.8 Å²	46.8	31%	0.309	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-63.5	130.4	-174.5	174	176.6	177.4	101.8	19.9	111.2	I393 Y397 T416 E417	I393-R395 PolarHBondContact O-N 2.89Å; R395-Y397 HydrophobicContact CG-CD1 4.42Å; R395-Y397 HydrophobicContact CG-CE1 4.22Å; R395-Y397 VanDerWaalsContact NE-CE1 3.34Å; R395-T416 CarbonylContact O-C 3.18Å; R395-T416 VanDerWaalsContact O-CA 3.27Å; R395-T416 WeakPolarHBondContact O-CA 3.5Å; R395-T416 WeakPolarHBondContact O-CB 3.34Å; R395-E417 HydrophobicContact CB-CB 4.13Å; R395-E417 PolarHBondContact N-OE2 3.4Å; R395-E417 PolarHBondContact O-N 3.26Å
396	F	90.4	Very high	86.1	Confident	13 Å²	13	48.2 Å²	48.2	6%	0.057	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	141.4	163.7	-154.7	-102.8	0	0	0	109.6	A382 L385 K386 V394 Y399 L414 T416	A382-F396 HydrophobicContact CB-CZ 4.41Å; A382-F396 WeakPolarHBondContact O-CE1 3.36Å; L385-F396 HydrophobicContact CB-CB 4.28Å; L385-F396 HydrophobicContact CB-CD1 3.8Å; L385-F396 HydrophobicContact CB-CD2 4.04Å; L385-F396 HydrophobicContact CB-CE1 4.02Å; L385-F396 HydrophobicContact CB-CE2 4.25Å; L385-F396 HydrophobicContact CB-CG 3.8Å; L385-F396 HydrophobicContact CB-CZ 4.24Å; L385-F396 HydrophobicContact CD1-CD2 4.19Å; L385-F396 HydrophobicContact CD1-CE2 3.89Å; L385-F396 HydrophobicContact CD1-CZ 4.21Å; L385-F396 VanDerWaalsContact O-CB 3.24Å; L385-F396 WeakPolarHBondContact O-CB 3.5Å; K386-F396 HydrophobicContact CB-CD1 4.43Å; K386-F396 HydrophobicContact CG-CD1 3.77Å; K386-F396 HydrophobicContact CG-CE1 4.02Å; V394-F396 PolarHBondContact O-N 3.2Å; F396-Y399 HydrophobicContact CE1-CD1 4.32Å; F396-L414 HydrophobicContact CE2-CB 3.93Å; F396-L414 HydrophobicContact CE2-CD2 3.71Å; F396-L414 HydrophobicContact CE2-CG 4.33Å; F396-L414 HydrophobicContact CZ-CB 4.05Å; F396-L414 HydrophobicContact CZ-CD2 3.95Å; F396-L414 HydrophobicContact CZ-CG 4.28Å; F396-T416 HydrophobicContact CD2-CG2 3.82Å; F396-T416 HydrophobicContact CE2-CG2 4.29Å
397	Y	91.6	Very high	85.3	Confident	48 Å²	48	49.1 Å²	49.1	19%	0.188	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-53.7	176.8	-67.4	-76.4	0	0	0	112.2	F333 V360 R395 V415 E417	F333-Y397 HydrophobicContact CE1-CG 4.43Å; F333-Y397 HydrophobicContact CZ-CG 4.45Å; V360-Y397 HydrophobicContact CG1-CD2 4.03Å; V360-Y397 HydrophobicContact CG1-CE2 3.71Å; R395-Y397 HydrophobicContact CG-CD1 4.42Å; R395-Y397 HydrophobicContact CG-CE1 4.22Å; R395-Y397 VanDerWaalsContact NE-CE1 3.34Å; Y397-V415 HydrophobicContact CD2-CG1 4.17Å; Y397-V415 PolarHBondContact N-O 2.82Å; Y397-E417 HydrophobicContact CE2-CB 4.32Å
398	D	90.6	Very high	84.6	Confident	33 Å²	33	51 Å²	51	18%	0.176	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	168	-175.9	-159.7	8.4	0	0	0	111.7	F333 K386 W400 V415	F333-D398 HydrophobicContact CE2-CB 3.71Å; F333-D398 HydrophobicContact CZ-CB 4.4Å; K386-D398 WeakPolarHBondContact CE-OD1 3.18Å; K386-D398 IonicContact NZ-OD1 3.46Å; K386-D398 PolarHBondContact NZ-OD1 2.87Å; D398-W400 HydrophobicContact CB-CZ3 4.3Å; D398-V415 PolarHBondContact O-N 2.83Å
399	Y	88.1	Confident	83.9	Confident	32 Å²	32	55.7 Å²	55.7	13%	0.125	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.7	170	85.6	-90.4	0	0	0	111.9	R379 A382 E383 F396 I412 V413	R379-Y399 WeakPolarHBondContact CB-OH 3.48Å; R379-Y399 HydrophobicContact CG-CE2 4.04Å; R379-Y399 PolarHBondContact O-OH 3.22Å; A382-Y399 VanDerWaalsContact C-CE1 3.49Å; A382-Y399 HydrophobicContact CB-CD1 3.41Å; A382-Y399 VanDerWaalsContact CB-CD1 3.41Å; A382-Y399 HydrophobicContact CB-CD2 4.16Å; A382-Y399 HydrophobicContact CB-CE1 3.63Å; A382-Y399 HydrophobicContact CB-CE2 4.38Å; A382-Y399 HydrophobicContact CB-CG 3.72Å; A382-Y399 WeakPolarHBondContact O-CD1 3.47Å; E383-Y399 HydrophobicContact CB-CE1 4.3Å; E383-Y399 WeakPolarHBondContact OE2-CE1 3.34Å; F396-Y399 HydrophobicContact CE1-CD1 4.32Å; Y399-I412 HydrophobicContact CD2-CG2 4.27Å; Y399-V413 CarbonylContact C-O 3.11Å; Y399-V413 WeakPolarHBondContact CA-O 3.36Å; Y399-V413 VanDerWaalsContact CB-O 3.32Å; Y399-V413 WeakPolarHBondContact CB-O 3.32Å
400	W	88.1	Confident	83.1	Confident	16 Å²	16	55.2 Å²	55.2	6%	0.061	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	152.3	168.3	58.4	86.8	0	0	0	113.4	S328 K329 F333 W362 D398 S402 V413 V415	S328-W400 VanDerWaalsContact CB-CH2 3.41Å; K329-W400 HydrophobicContact CD-CB 4.23Å; K329-W400 HydrophobicContact CD-CG 4.34Å; K329-W400 HydrophobicContact CG-CG 4.42Å; F333-W400 HydrophobicContact CB-CH2 4.33Å; F333-W400 HydrophobicContact CD2-CH2 4.13Å; F333-W400 AromaticContact CD2-CZ3 3.96Å; F333-W400 HydrophobicContact CD2-CZ3 3.96Å; W362-W400 HydrophobicContact CE3-CH2 4.36Å; W362-W400 HydrophobicContact CE3-CZ2 4.35Å; W362-W400 HydrophobicContact CH2-CH2 4.29Å; W362-W400 AromaticContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CZ2-CZ2 4.01Å; W362-W400 AromaticContact CZ3-CH2 3.98Å; W362-W400 HydrophobicContact CZ3-CH2 3.98Å; W362-W400 AromaticContact CZ3-CZ2 3.75Å; W362-W400 HydrophobicContact CZ3-CZ2 3.75Å; D398-W400 HydrophobicContact CB-CZ3 4.3Å; W400-S402 VanDerWaalsContact CD1-OG 3.28Å; W400-S402 PolarHBondContact NE1-OG 3.04Å; W400-V413 HydrophobicContact CD2-CB 4.17Å; W400-V413 HydrophobicContact CH2-CB 4.42Å; W400-V413 HydrophobicContact CH2-CG1 3.82Å; W400-V413 HydrophobicContact CZ2-CB 3.77Å; W400-V413 HydrophobicContact CZ2-CG1 3.45Å; W400-V413 VanDerWaalsContact CZ2-CG1 3.45Å; W400-V413 HydrophobicContact CZ2-CG2 4.2Å; W400-V413 PolarHBondContact N-O 2.88Å; W400-V413 PolarHBondContact O-N 3.43Å; W400-V415 HydrophobicContact CH2-CG2 3.47Å; W400-V415 VanDerWaalsContact CH2-CG2 3.47Å; W400-V415 HydrophobicContact CZ3-CG2 3.67Å
401	E	84.5	Confident	82.4	Confident	43 Å²	43	54.7 Å²	54.7	20%	0.201	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	130.8	164.2	-72.1	175.8	-119.6	0	0	110.7	K329 R375 R379 I412	K329-E401 WeakPolarHBondContact CE-O 3.39Å; K329-E401 PolarHBondContact NZ-O 3.11Å; R375-E401 IonicContact CZ-OE2 2.83Å; R375-E401 IonicContact NH1-OE2 2.73Å; R375-E401 PolarHBondContact NH1-OE2 3.28Å; R379-E401 WeakPolarHBondContact CD-OE1 3.38Å; R379-E401 IonicContact CZ-OE1 2.87Å; R379-E401 IonicContact NE-OE1 2.92Å; R379-E401 IonicContact NH1-OE1 3.05Å; R379-E401 PolarHBondContact NH1-OE1 3.24Å; E401-I412 HydrophobicContact CG-CG1 4.37Å
402	S	84	Confident	81.8	Confident	24 Å²	24	50.5 Å²	50.5	17%	0.168	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	170.7	173.1	-89.8	0	0	0	0	111	W400 K410 Y411	W400-S402 VanDerWaalsContact CD1-OG 3.28Å; W400-S402 PolarHBondContact NE1-OG 3.04Å; S402-K410 WeakPolarHBondContact O-CA 3.22Å; S402-Y411 VanDerWaalsContact CB-CE2 3.49Å; S402-Y411 VanDerWaalsContact CB-CZ 3.45Å; S402-Y411 PolarHBondContact N-O 2.94Å; S402-Y411 PolarHBondContact O-N 3.27Å; S402-Y411 VanDerWaalsContact O-O 3.04Å
403	A	78.6	Confident	81.5	Confident	51 Å²	51	49.9 Å²	49.9	42%	0.421	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	147.2	172.4	0	0	0	0	0	110.9	R409 K410	A403-R409 CarbonylContact C-O 3.54Å; A403-R409 VanDerWaalsContact CA-O 3.28Å; A403-R409 WeakPolarHBondContact CA-O 3.49Å; A403-R409 WeakPolarHBondContact CB-O 3.47Å; A403-K410 HydrophobicContact CB-CG 4.3Å
404	D	73.1	Confident	81.2	Confident	42 Å²	42	50.2 Å²	50.2	23%	0.225	26%	0.256	C	S	.	.			trans	-57.8	158.4	-179.1	-63.4	2.6	0	0	0	111.1	C406 G407 R409 Y411	D404-C406 PolarHBondContact O-N 3.19Å; D404-G407 PolarHBondContact O-N 2.76Å; D404-R409 PolarHBondContact N-O 2.88Å; D404-R409 WeakPolarHBondContact OD2-CB 3.18Å; D404-R409 WeakPolarHBondContact OD2-CD 3.42Å; D404-Y411 VanDerWaalsContact OD1-CD1 3.29Å; D404-Y411 WeakPolarHBondContact OD1-CD1 3.49Å; D404-Y411 WeakPolarHBondContact OD1-CE1 3.37Å
405	L	65.7	Low	81.2	Confident	140 Å²	140	49.6 Å²	49.6	73%	0.733	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	4.8	178.7	-68.1	163.8	0	0	0	116.3	R227	R227-L405 HydrophobicContact CB-CB 4.48Å
406	C	64.3	Low	81.2	Confident	42 Å²	42	46.9 Å²	46.9	28%	0.284	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	1	174.9	-164.4	0	0	0	0	112.8	F225 D404 K408	F225-C406 HydrophobicContact CE1-CB 3.71Å; F225-C406 HydrophobicContact CZ-CB 3.77Å; D404-C406 PolarHBondContact O-N 3.19Å; C406-K408 PolarHBondContact O-N 3.07Å
407	G	68.1	Low	81.3	Confident	57 Å²	57	48.4 Å²	48.4	59%	0.588	25%	0.252	S	S	*	.	S	Bend	trans	70.7	-14.2	-178.1	0	0	0	0	0	115.8	D404 R409	D404-G407 PolarHBondContact O-N 2.76Å; G407-R409 VanDerWaalsContact C-N 3.33Å; G407-R409 PolarHBondContact O-N 2.68Å
408	K	68.8	Low	81.3	Confident	167 Å²	167	47.5 Å²	47.5	73%	0.726	25%	0.25	S	C	*	.	S	Bend	trans	-69.9	-19.4	-170.8	-66.3	-176.3	179.1	-176.6	0	115.6	C406	C406-K408 PolarHBondContact O-N 3.07Å
409	R	70.5	Confident	81.4	Confident	108 Å²	108	46.7 Å²	46.7	41%	0.408	25%	0.246	S	C	.	.			trans	-136.4	138.6	178	156.4	179.3	-83.5	159.1	-6.9	109.1	A403 D404 G407	A403-R409 CarbonylContact C-O 3.54Å; A403-R409 VanDerWaalsContact CA-O 3.28Å; A403-R409 WeakPolarHBondContact CA-O 3.49Å; A403-R409 WeakPolarHBondContact CB-O 3.47Å; D404-R409 PolarHBondContact N-O 2.88Å; D404-R409 WeakPolarHBondContact OD2-CB 3.18Å; D404-R409 WeakPolarHBondContact OD2-CD 3.42Å; G407-R409 VanDerWaalsContact C-N 3.33Å; G407-R409 PolarHBondContact O-N 2.68Å
410	K	75.4	Confident	81.3	Confident	104 Å²	104	48.2 Å²	48.2	45%	0.452	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	151.8	170.3	-67.9	179.8	176.2	-173.3	0	110.3	E367 S402 A403	E367-K410 HydrophobicContact CB-CB 4.2Å; E367-K410 VanDerWaalsContact CB-O 3.26Å; E367-K410 WeakPolarHBondContact CB-O 3.23Å; E367-K410 PolarHBondContact N-O 3.31Å; E367-K410 WeakPolarHBondContact OE2-CB 3.4Å; E367-K410 WeakPolarHBondContact OE2-CD 3.49Å; S402-K410 WeakPolarHBondContact O-CA 3.22Å; A403-K410 HydrophobicContact CB-CG 4.3Å
411	Y	79.2	Confident	81.2	Confident	29 Å²	29	47.6 Å²	47.6	11%	0.114	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	156.1	174	59.2	-84.8	0	0	0	109.8	D326 E364 L365 S402 D404 V413	D326-Y411 PolarHBondContact OD2-OH 3Å; E364-Y411 HydrophobicContact CB-CD2 4.26Å; E364-Y411 HydrophobicContact CG-CD2 4.16Å; E364-Y411 HydrophobicContact CG-CE2 4.26Å; E364-Y411 WeakPolarHBondContact OE1-CE2 3.09Å; L365-Y411 VanDerWaalsContact O-CA 3.26Å; L365-Y411 WeakPolarHBondContact O-CA 3.34Å; L365-Y411 VanDerWaalsContact O-CB 3.31Å; L365-Y411 WeakPolarHBondContact O-CB 3.39Å; S402-Y411 VanDerWaalsContact CB-CE2 3.49Å; S402-Y411 VanDerWaalsContact CB-CZ 3.45Å; S402-Y411 PolarHBondContact N-O 2.94Å; S402-Y411 PolarHBondContact O-N 3.27Å; S402-Y411 VanDerWaalsContact O-O 3.04Å; D404-Y411 VanDerWaalsContact OD1-CD1 3.29Å; D404-Y411 WeakPolarHBondContact OD1-CD1 3.49Å; D404-Y411 WeakPolarHBondContact OD1-CE1 3.37Å; Y411-V413 HydrophobicContact CD2-CG2 3.74Å; Y411-V413 HydrophobicContact CE2-CG2 3.5Å
412	I	81.5	Confident	81.4	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.5	174.7	-44.5	-179.1	0	0	0	108.2	E364 L365 L370 F378 Y399 E401	E364-I412 WeakPolarHBondContact CA-O 3.37Å; L365-I412 HydrophobicContact CB-CB 4.46Å; L365-I412 PolarHBondContact N-O 3.45Å; L365-I412 PolarHBondContact O-N 3.21Å; L370-I412 HydrophobicContact CD1-CD1 4.48Å; F378-I412 HydrophobicContact CD1-CD1 3.66Å; F378-I412 HydrophobicContact CD1-CG2 4.35Å; F378-I412 HydrophobicContact CE1-CB 4.38Å; F378-I412 HydrophobicContact CE1-CD1 3.83Å; F378-I412 HydrophobicContact CE1-CG2 3.66Å; F378-I412 HydrophobicContact CG-CD1 4.1Å; F378-I412 HydrophobicContact CZ-CD1 4.34Å; F378-I412 HydrophobicContact CZ-CG2 4.28Å; Y399-I412 HydrophobicContact CD2-CG2 4.27Å; E401-I412 HydrophobicContact CG-CG1 4.37Å
413	V	88.9	Confident	81.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.7	172.6	-173.6	0	0	0	0	109.2	W362 C363 E364 Y399 W400 Y411 V415	W362-V413 HydrophobicContact CD2-CG1 3.8Å; W362-V413 HydrophobicContact CE3-CG1 4.39Å; W362-V413 HydrophobicContact CG-CG1 4.13Å; W362-V413 HydrophobicContact CZ2-CG1 4Å; W362-V413 HydrophobicContact CZ2-CG2 4.11Å; C363-V413 CarbonylContact O-C 3.51Å; C363-V413 VanDerWaalsContact O-CA 3.29Å; C363-V413 WeakPolarHBondContact O-CA 2.96Å; E364-V413 HydrophobicContact CG-CG2 4.5Å; Y399-V413 CarbonylContact C-O 3.11Å; Y399-V413 WeakPolarHBondContact CA-O 3.36Å; Y399-V413 VanDerWaalsContact CB-O 3.32Å; Y399-V413 WeakPolarHBondContact CB-O 3.32Å; W400-V413 HydrophobicContact CD2-CB 4.17Å; W400-V413 HydrophobicContact CH2-CB 4.42Å; W400-V413 HydrophobicContact CH2-CG1 3.82Å; W400-V413 HydrophobicContact CZ2-CB 3.77Å; W400-V413 HydrophobicContact CZ2-CG1 3.45Å; W400-V413 VanDerWaalsContact CZ2-CG1 3.45Å; W400-V413 HydrophobicContact CZ2-CG2 4.2Å; W400-V413 PolarHBondContact N-O 2.88Å; W400-V413 PolarHBondContact O-N 3.43Å; Y411-V413 HydrophobicContact CD2-CG2 3.74Å; Y411-V413 HydrophobicContact CE2-CG2 3.5Å; V413-V415 HydrophobicContact CG1-CG2 4.37Å
414	L	88.2	Confident	82.5	Confident	8 Å²	8	42.7 Å²	42.7	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	138.9	169.4	-47.5	81.2	0	0	0	108	C363 L365 F378 F396	C363-L414 HydrophobicContact CB-CB 4.28Å; C363-L414 HydrophobicContact CB-CD1 4.36Å; C363-L414 PolarHBondContact N-O 2.83Å; C363-L414 PolarHBondContact O-N 3.28Å; L365-L414 HydrophobicContact CD1-CD1 3.68Å; L365-L414 HydrophobicContact CG-CD1 3.68Å; F378-L414 HydrophobicContact CZ-CD1 4.28Å; F378-L414 HydrophobicContact CZ-CD2 3.95Å; F378-L414 HydrophobicContact CZ-CG 4.31Å; F396-L414 HydrophobicContact CE2-CB 3.93Å; F396-L414 HydrophobicContact CE2-CD2 3.71Å; F396-L414 HydrophobicContact CE2-CG 4.33Å; F396-L414 HydrophobicContact CZ-CB 4.05Å; F396-L414 HydrophobicContact CZ-CD2 3.95Å; F396-L414 HydrophobicContact CZ-CG 4.28Å
415	V	92.7	Very high	83.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.4	178.6	-173.8	0	0	0	0	110.1	F333 V360 A361 Y397 D398 W400 V413	F333-V415 HydrophobicContact CB-CG2 4.29Å; F333-V415 HydrophobicContact CD1-CG1 3.73Å; F333-V415 HydrophobicContact CD2-CB 4.47Å; F333-V415 HydrophobicContact CD2-CG1 4.44Å; F333-V415 HydrophobicContact CD2-CG2 4.04Å; F333-V415 HydrophobicContact CE1-CG1 3.95Å; F333-V415 HydrophobicContact CG-CB 4.45Å; F333-V415 HydrophobicContact CG-CG1 3.99Å; F333-V415 HydrophobicContact CG-CG2 4.06Å; F333-V415 HydrophobicContact CZ-CG1 4.41Å; V360-V415 HydrophobicContact CB-CG1 3.73Å; V360-V415 HydrophobicContact CG1-CG1 4.16Å; V360-V415 HydrophobicContact CG2-CG1 3.65Å; A361-V415 WeakPolarHBondContact O-CA 3.38Å; Y397-V415 HydrophobicContact CD2-CG1 4.17Å; Y397-V415 PolarHBondContact N-O 2.82Å; D398-V415 PolarHBondContact O-N 2.83Å; W400-V415 HydrophobicContact CH2-CG2 3.47Å; W400-V415 VanDerWaalsContact CH2-CG2 3.47Å; W400-V415 HydrophobicContact CZ3-CG2 3.67Å; V413-V415 HydrophobicContact CG1-CG2 4.37Å
416	T	92.8	Very high	84.5	Confident	25 Å²	25	40.3 Å²	40.3	15%	0.153	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	167.4	-178.3	72.3	0	0	0	0	112.6	V360 A361 R395 F396 L418	V360-T416 WeakPolarHBondContact CB-O 3.49Å; A361-T416 PolarHBondContact N-O 3.07Å; A361-T416 PolarHBondContact O-N 2.88Å; R395-T416 CarbonylContact O-C 3.18Å; R395-T416 VanDerWaalsContact O-CA 3.27Å; R395-T416 WeakPolarHBondContact O-CA 3.5Å; R395-T416 WeakPolarHBondContact O-CB 3.34Å; F396-T416 HydrophobicContact CD2-CG2 3.82Å; F396-T416 HydrophobicContact CE2-CG2 4.29Å; T416-L418 PolarHBondContact O-N 3.16Å
417	E	93	Very high	85.8	Confident	45 Å²	45	38.4 Å²	38.4	21%	0.21	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	130.7	169.4	178.1	-179.3	-175	0	0	111.3	V394 R395 Y397 M419 K480	V394-E417 HydrophobicContact CG1-CB 3.93Å; R395-E417 HydrophobicContact CB-CB 4.13Å; R395-E417 PolarHBondContact N-OE2 3.4Å; R395-E417 PolarHBondContact O-N 3.26Å; Y397-E417 HydrophobicContact CE2-CB 4.32Å; E417-M419 HydrophobicContact CG-SD 4.01Å; E417-M419 PolarHBondContact O-N 3.24Å; E417-K480 VanDerWaalsContact CD-NZ 3.27Å; E417-K480 WeakPolarHBondContact OE1-CE 3.46Å; E417-K480 IonicContact OE1-NZ 3.82Å; E417-K480 PolarHBondContact OE1-NZ 3.02Å; E417-K480 IonicContact OE2-NZ 3.86Å; E417-K480 PolarHBondContact OE2-NZ 2.88Å
418	L	92.4	Very high	86.8	Confident	29 Å²	29	36.2 Å²	36.2	15%	0.152	17%	0.168	C	C	.	.			trans	-81.8	102.9	-179.6	-179.7	57.1	0	0	0	110.7	L340 R350 A359 A361 T416 T420	L340-L418 HydrophobicContact CD1-CD1 3.46Å; L340-L418 VanDerWaalsContact CD1-CD1 3.46Å; R350-L418 HydrophobicContact CG-CD2 4.49Å; A359-L418 HydrophobicContact CB-CD2 3.71Å; A359-L418 VanDerWaalsContact O-CB 3.27Å; A359-L418 WeakPolarHBondContact O-CB 3.44Å; A361-L418 HydrophobicContact CB-CD1 4.17Å; T416-L418 PolarHBondContact O-N 3.16Å; L418-T420 HydrophobicContact CD2-CG2 4.32Å; L418-T420 HydrophobicContact CG-CG2 3.98Å; L418-T420 PolarHBondContact O-N 2.97Å
419	M	91.6	Very high	87.8	Confident	17 Å²	17	36.9 Å²	36.9	8%	0.084	17%	0.171	C	C	.	.			trans	-77	107.7	178.5	-62.4	-52.1	-59.1	0	0	111.5	W74 V394 E417 F471 T473 K480	W74-M419 VanDerWaalsContact CZ2-O 3.22Å; W74-M419 WeakPolarHBondContact CZ2-O 3.44Å; V394-M419 HydrophobicContact CG1-CG 4.18Å; V394-M419 HydrophobicContact CG1-SD 4.47Å; V394-M419 HydrophobicContact CG2-CG 3.81Å; V394-M419 HydrophobicContact CG2-SD 4.01Å; E417-M419 HydrophobicContact CG-SD 4.01Å; E417-M419 PolarHBondContact O-N 3.24Å; M419-F471 HydrophobicContact CB-CB 3.8Å; M419-F471 HydrophobicContact CB-CD1 3.44Å; M419-F471 VanDerWaalsContact CB-CD1 3.44Å; M419-F471 HydrophobicContact CB-CE1 4.17Å; M419-F471 HydrophobicContact CB-CG 3.72Å; M419-F471 HydrophobicContact CE-CB 3.55Å; M419-F471 HydrophobicContact CG-CB 3.63Å; M419-F471 HydrophobicContact CG-CD1 3.86Å; M419-F471 HydrophobicContact CG-CD2 4.17Å; M419-F471 HydrophobicContact CG-CG 3.62Å; M419-F471 HydrophobicContact SD-CB 4.32Å; M419-T473 HydrophobicContact CE-CG2 3.82Å; M419-K480 HydrophobicContact CE-CB 4.13Å; M419-K480 HydrophobicContact CE-CD 3.77Å; M419-K480 HydrophobicContact CE-CG 4.5Å; M419-K480 HydrophobicContact SD-CD 3.84Å
420	T	86.7	Confident	88.3	Confident	64 Å²	64	37 Å²	37	39%	0.393	17%	0.171	S	C	.	.			trans	-99	2.2	-168.3	54.9	0	0	0	0	116.7	W74 L418	W74-T420 VanDerWaalsContact CH2-CA 3.41Å; W74-T420 HydrophobicContact CH2-CG2 4.32Å; W74-T420 WeakPolarHBondContact CZ3-O 3.2Å; L418-T420 HydrophobicContact CD2-CG2 4.32Å; L418-T420 HydrophobicContact CG-CG2 3.98Å; L418-T420 PolarHBondContact O-N 2.97Å
421	S	86.1	Confident	88.6	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.021	16%	0.156	C	C	.	.	S	Bend	trans	-126.2	25.1	-173.5	-44.9	0	0	0	0	113.8	Q71 I472 G474	Q71-S421 PolarHBondContact NE2-OG 2.82Å; S421-I472 WeakPolarHBondContact CB-O 3.46Å; S421-G474 WeakPolarHBondContact OG-CA 3.38Å; S421-G474 PolarHBondContact OG-N 3.18Å
422	G	88.5	Confident	88.3	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.01	19%	0.187	C	C	.	.			trans	76.2	-166.4	175.7	0	0	0	0	0	114.8	F471 I472	G422-F471 WeakPolarHBondContact O-CA 3.41Å; G422-I472 PolarHBondContact O-N 2.88Å
423	T	92.1	Very high	88.2	Confident	13 Å²	13	50.5 Å²	50.5	8%	0.08	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-119.4	162.7	-173.1	63.5	0	0	0	0	110	K425 M426 Y427 D468 I470 F471	T423-K425 PolarHBondContact O-N 2.61Å; T423-M426 WeakPolarHBondContact O-CB 3.42Å; T423-M426 PolarHBondContact O-N 2.86Å; T423-M426 PolarHBondContact OG1-N 2.99Å; T423-Y427 PolarHBondContact O-N 2.83Å; T423-D468 WeakPolarHBondContact CG2-O 3.27Å; T423-D468 PolarHBondContact OG1-OD1 2.83Å; T423-I470 CarbonylContact C-O 3.57Å; T423-I470 VanDerWaalsContact CA-O 3.3Å; T423-I470 WeakPolarHBondContact CA-O 3.44Å; T423-F471 HydrophobicContact CG2-CD1 3.71Å; T423-F471 HydrophobicContact CG2-CE1 3.71Å; T423-F471 HydrophobicContact CG2-CG 4.44Å; T423-F471 HydrophobicContact CG2-CZ 4.44Å
424	L	92.9	Very high	88.1	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-56.1	-38.9	175.4	-72	-179.6	0	0	0	111.9	M426 Y427 L428 W442 I446 C467 I470 I472 V479 M530	L424-M426 PolarHBondContact O-N 3.31Å; L424-Y427 WeakPolarHBondContact O-CB 3.44Å; L424-Y427 PolarHBondContact O-N 3.46Å; L424-Y427 VanDerWaalsContact O-N 3.16Å; L424-L428 WeakPolarHBondContact O-CG 3.31Å; L424-L428 PolarHBondContact O-N 2.82Å; L424-W442 HydrophobicContact CD2-CD2 3.93Å; L424-W442 HydrophobicContact CD2-CE3 3.32Å; L424-W442 HydrophobicContact CD2-CH2 4.12Å; L424-W442 HydrophobicContact CD2-CZ3 3.43Å; L424-W442 VanDerWaalsContact CD2-CZ3 3.43Å; L424-I446 HydrophobicContact CD1-CD1 4.11Å; L424-C467 HydrophobicContact CB-CB 3.9Å; L424-C467 WeakPolarHBondContact CB-O 3.41Å; L424-C467 PolarHBondContact N-O 2.69Å; L424-C467 VanDerWaalsContact N-O 3.13Å; L424-I470 HydrophobicContact CD1-CB 3.79Å; L424-I470 HydrophobicContact CD1-CD1 4.05Å; L424-I470 HydrophobicContact CD1-CG2 3.5Å; L424-I470 VanDerWaalsContact CD1-CG2 3.5Å; L424-I470 HydrophobicContact CG-CB 4.12Å; L424-I470 HydrophobicContact CG-CG2 3.87Å; L424-I470 PolarHBondContact N-O 2.75Å; L424-I472 HydrophobicContact CD2-CD1 4.08Å; L424-I472 HydrophobicContact CD2-CG1 4.11Å; L424-V479 HydrophobicContact CD2-CG1 4.1Å; L424-M530 HydrophobicContact CD1-CE 4.5Å; L424-M530 HydrophobicContact CD1-SD 3.8Å; L424-M530 HydrophobicContact CD2-SD 4.41Å
425	K	91.2	Very high	87.9	Confident	82 Å²	82	54.4 Å²	54.4	36%	0.357	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-41.5	174.2	-172.4	-174.8	-174.8	174.5	0	112.4	T423 Y427 K429 C467 D468	T423-K425 PolarHBondContact O-N 2.61Å; K425-Y427 VanDerWaalsContact C-N 3.35Å; K425-K429 VanDerWaalsContact O-CB 3.31Å; K425-K429 WeakPolarHBondContact O-CB 3.49Å; K425-K429 PolarHBondContact O-N 3.12Å; K425-C467 HydrophobicContact CB-CB 4.08Å; K425-C467 PolarHBondContact N-O 2.69Å; K425-D468 HydrophobicContact CD-CB 3.83Å; K425-D468 WeakPolarHBondContact CD-OD1 3.36Å; K425-D468 WeakPolarHBondContact CD-OD2 3.29Å; K425-D468 WeakPolarHBondContact CE-OD2 3.45Å; K425-D468 IonicContact NZ-OD2 3.89Å; K425-D468 PolarHBondContact NZ-OD2 2.78Å
426	M	90	Very high	87.7	Confident	49 Å²	49	56.3 Å²	56.3	24%	0.241	26%	0.255	C	S	.	.	H	α-helix	trans	-65.1	-38.8	174.4	-163.6	72.8	83.5	0	0	111.6	V70 T423 L424 R430	V70-M426 HydrophobicContact CG1-CG 4.47Å; T423-M426 WeakPolarHBondContact O-CB 3.42Å; T423-M426 PolarHBondContact O-N 2.86Å; T423-M426 PolarHBondContact OG1-N 2.99Å; L424-M426 PolarHBondContact O-N 3.31Å; M426-R430 PolarHBondContact O-N 2.87Å
427	Y	90.9	Very high	87.3	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-66.1	-47.4	176	-173.2	-82.8	0	0	0	112	R66 L67 V70 T423 L424 K425 R430 F431 I434 W442 I472	R66-Y427 HydrophobicContact CB-CE2 4.29Å; L67-Y427 HydrophobicContact CD2-CD2 3.96Å; L67-Y427 HydrophobicContact CD2-CE2 3.77Å; L67-Y427 HydrophobicContact CG-CE2 4.24Å; V70-Y427 HydrophobicContact CG2-CD2 3.98Å; V70-Y427 HydrophobicContact CG2-CG 4.48Å; T423-Y427 PolarHBondContact O-N 2.83Å; L424-Y427 WeakPolarHBondContact O-CB 3.44Å; L424-Y427 PolarHBondContact O-N 3.46Å; L424-Y427 VanDerWaalsContact O-N 3.16Å; K425-Y427 VanDerWaalsContact C-N 3.35Å; Y427-R430 PolarHBondContact O-N 2.91Å; Y427-R430 VanDerWaalsContact O-N 3.15Å; Y427-F431 HydrophobicContact CD1-CB 4.38Å; Y427-F431 HydrophobicContact CD1-CD2 4.08Å; Y427-F431 AromaticContact CD2-CD2 3.85Å; Y427-F431 HydrophobicContact CD2-CD2 3.85Å; Y427-F431 HydrophobicContact CD2-CE2 4.17Å; Y427-F431 HydrophobicContact CE1-CB 4.03Å; Y427-F431 AromaticContact CE1-CD2 3.86Å; Y427-F431 HydrophobicContact CE1-CD2 3.86Å; Y427-F431 HydrophobicContact CE1-CG 4.4Å; Y427-F431 AromaticContact CE2-CD2 3.62Å; Y427-F431 HydrophobicContact CE2-CD2 3.62Å; Y427-F431 AromaticContact CE2-CE2 3.92Å; Y427-F431 HydrophobicContact CE2-CE2 3.92Å; Y427-F431 HydrophobicContact CG-CD2 4.07Å; Y427-F431 AromaticContact CZ-CD2 3.63Å; Y427-F431 PolarHBondContact O-N 2.79Å; Y427-I434 HydrophobicContact CD1-CG1 4.41Å; Y427-I434 HydrophobicContact CE1-CG1 4.1Å; Y427-W442 AromaticContact CD1-CH2 3.85Å; Y427-W442 HydrophobicContact CD1-CH2 3.85Å; Y427-W442 AromaticContact CD1-CZ3 3.97Å; Y427-W442 HydrophobicContact CD1-CZ3 3.97Å; Y427-W442 AromaticContact CD2-CH2 3.96Å; Y427-W442 HydrophobicContact CD2-CH2 3.96Å; Y427-W442 AromaticContact CE1-CH2 3.82Å; Y427-W442 HydrophobicContact CE1-CH2 3.82Å; Y427-W442 HydrophobicContact CE1-CZ3 4.09Å; Y427-W442 AromaticContact CE2-CH2 3.95Å; Y427-W442 HydrophobicContact CE2-CH2 3.95Å; Y427-W442 AromaticContact CG-CH2 3.92Å; Y427-W442 HydrophobicContact CG-CH2 3.92Å; Y427-W442 HydrophobicContact CG-CZ3 4.35Å; Y427-W442 AromaticContact CZ-CH2 3.87Å; Y427-I472 HydrophobicContact CD2-CD1 3.98Å; Y427-I472 HydrophobicContact CG-CD1 4.04Å
428	L	90.5	Very high	87.1	Confident	12 Å²	12	58.2 Å²	58.2	6%	0.063	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-44	178.2	-76.8	167.4	0	0	0	112.5	L424 R430 F431 I434 E529 M530	L424-L428 WeakPolarHBondContact O-CG 3.31Å; L424-L428 PolarHBondContact O-N 2.82Å; L428-R430 PolarHBondContact O-N 2.71Å; L428-R430 VanDerWaalsContact O-N 3.14Å; L428-F431 CarbonylContact O-C 3.46Å; L428-F431 VanDerWaalsContact O-C 3.32Å; L428-F431 PolarHBondContact O-N 2.8Å; L428-I434 HydrophobicContact CD2-CD1 3.72Å; L428-I434 HydrophobicContact CD2-CG1 3.95Å; L428-I434 HydrophobicContact CG-CD1 4.35Å; L428-E529 HydrophobicContact CD1-CG 4.03Å; L428-M530 HydrophobicContact CD1-CG 4.08Å
429	K	88.1	Confident	87.1	Confident	181 Å²	181	57.3 Å²	57.3	79%	0.787	26%	0.256	S	S	*	.	H	α-helix	trans	-54.7	-32.2	175.2	-174.9	-177.5	177.3	-171	0	112.6	K425	K425-K429 VanDerWaalsContact O-CB 3.31Å; K425-K429 WeakPolarHBondContact O-CB 3.49Å; K425-K429 PolarHBondContact O-N 3.12Å
430	R	82.2	Confident	87	Confident	110 Å²	110	57.4 Å²	57.4	42%	0.415	26%	0.256	S	S	.	.	H	α-helix	trans	-91	-36.8	176.5	-167.4	174.8	-177	140.1	0	113.6	A69 V70 M426 Y427 L428	A69-R430 PolarHBondContact O-NH1 2.98Å; V70-R430 HydrophobicContact CG2-CB 4.18Å; M426-R430 PolarHBondContact O-N 2.87Å; Y427-R430 PolarHBondContact O-N 2.91Å; Y427-R430 VanDerWaalsContact O-N 3.15Å; L428-R430 PolarHBondContact O-N 2.71Å; L428-R430 VanDerWaalsContact O-N 3.14Å
431	F	80.2	Confident	87.2	Confident	32 Å²	32	55.4 Å²	55.4	14%	0.14	25%	0.245	C	C	.	.			trans	-125.1	90.7	-174.9	-52.2	-58.9	0	0	0	111	R66 A69 V70 Y427 L428 R433	R66-F431 VanDerWaalsContact CA-CZ 3.5Å; R66-F431 HydrophobicContact CB-CD2 4.03Å; R66-F431 HydrophobicContact CB-CE1 4.15Å; R66-F431 HydrophobicContact CB-CE2 3.48Å; R66-F431 VanDerWaalsContact CB-CE2 3.48Å; R66-F431 HydrophobicContact CB-CZ 3.57Å; R66-F431 HydrophobicContact CG-CD1 3.98Å; R66-F431 HydrophobicContact CG-CD2 4.23Å; R66-F431 HydrophobicContact CG-CE1 3.68Å; R66-F431 HydrophobicContact CG-CE2 3.92Å; R66-F431 HydrophobicContact CG-CG 4.25Å; R66-F431 HydrophobicContact CG-CZ 3.65Å; R66-F431 WeakPolarHBondContact O-CE2 3.43Å; R66-F431 VanDerWaalsContact O-CZ 3.31Å; R66-F431 WeakPolarHBondContact O-CZ 3.39Å; A69-F431 HydrophobicContact CB-CZ 4.18Å; V70-F431 HydrophobicContact CG2-CD2 4.11Å; V70-F431 HydrophobicContact CG2-CE2 3.5Å; V70-F431 HydrophobicContact CG2-CZ 4.36Å; Y427-F431 HydrophobicContact CD1-CB 4.38Å; Y427-F431 HydrophobicContact CD1-CD2 4.08Å; Y427-F431 AromaticContact CD2-CD2 3.85Å; Y427-F431 HydrophobicContact CD2-CD2 3.85Å; Y427-F431 HydrophobicContact CD2-CE2 4.17Å; Y427-F431 HydrophobicContact CE1-CB 4.03Å; Y427-F431 AromaticContact CE1-CD2 3.86Å; Y427-F431 HydrophobicContact CE1-CD2 3.86Å; Y427-F431 HydrophobicContact CE1-CG 4.4Å; Y427-F431 AromaticContact CE2-CD2 3.62Å; Y427-F431 HydrophobicContact CE2-CD2 3.62Å; Y427-F431 AromaticContact CE2-CE2 3.92Å; Y427-F431 HydrophobicContact CE2-CE2 3.92Å; Y427-F431 HydrophobicContact CG-CD2 4.07Å; Y427-F431 AromaticContact CZ-CD2 3.63Å; Y427-F431 PolarHBondContact O-N 2.79Å; L428-F431 CarbonylContact O-C 3.46Å; L428-F431 VanDerWaalsContact O-C 3.32Å; L428-F431 PolarHBondContact O-N 2.8Å; F431-R433 PolarHBondContact O-N 2.66Å
432	K	73.8	Confident	87.5	Confident	175 Å²	175	55.4 Å²	55.4	76%	0.761	24%	0.244	S	C	*	.	S	Bend	trans	-57.1	-0.5	179.1	-57.7	-171.3	175.9	-168.7	0	116.3
433	R	79.7	Confident	87.9	Confident	212 Å²	212	55.3 Å²	55.3	80%	0.8	24%	0.244	S	C	*	.			trans	-147.2	114.8	178	-67.4	-171.1	178.1	-179.1	-1.3	110.3	R66 F431	R66-R433 PolarHBondContact NH1-O 2.66Å; F431-R433 PolarHBondContact O-N 2.66Å
434	I	85.7	Confident	88	Confident	27 Å²	27	56.8 Å²	56.8	14%	0.138	25%	0.248	C	C	.	.			trans	-83.1	147.4	169.3	-52.3	-178.7	0	0	0	108.6	Y427 L428 V438 L439 W442 M530	Y427-I434 HydrophobicContact CD1-CG1 4.41Å; Y427-I434 HydrophobicContact CE1-CG1 4.1Å; L428-I434 HydrophobicContact CD2-CD1 3.72Å; L428-I434 HydrophobicContact CD2-CG1 3.95Å; L428-I434 HydrophobicContact CG-CD1 4.35Å; I434-V438 HydrophobicContact CG2-CB 4.03Å; I434-V438 HydrophobicContact CG2-CG1 3.95Å; I434-L439 HydrophobicContact CG2-CB 4.15Å; I434-W442 HydrophobicContact CD1-CE3 4.19Å; I434-W442 HydrophobicContact CD1-CZ3 3.86Å; I434-W442 HydrophobicContact CG2-CE3 4.46Å; I434-W442 HydrophobicContact CG2-CZ3 4.28Å; I434-M530 HydrophobicContact CD1-CB 3.91Å; I434-M530 HydrophobicContact CD1-CG 3.83Å; I434-M530 HydrophobicContact CD1-SD 4.22Å
435	N	85.9	Confident	88.1	Confident	62 Å²	62	57.9 Å²	57.9	33%	0.332	25%	0.253	S	S	.	.			trans	-72.8	137.6	169.1	178.7	-6.7	0	0	0	110.1	E63 K437 V438 L439	E63-N435 WeakPolarHBondContact OE1-CB 3.47Å; E63-N435 VanDerWaalsContact OE1-CG 3.26Å; E63-N435 PolarHBondContact OE1-ND2 2.94Å; N435-K437 PolarHBondContact O-N 3.21Å; N435-K437 VanDerWaalsContact O-N 3.15Å; N435-K437 PolarHBondContact OD1-N 2.85Å; N435-K437 VanDerWaalsContact OD1-N 3.12Å; N435-V438 HydrophobicContact CB-CB 4.44Å; N435-V438 HydrophobicContact CB-CG2 4.31Å; N435-V438 PolarHBondContact O-N 3.22Å; N435-L439 PolarHBondContact O-N 3.33Å
436	I	87.4	Confident	88.3	Confident	40 Å²	40	54 Å²	54	21%	0.205	24%	0.236	C	C	.	.	H	α-helix	trans	-51.1	-37.9	177.5	-170.8	57.8	0	0	0	113.5	L439 K440 Y566 I569 F595	I436-L439 HydrophobicContact CD1-CD2 4.15Å; I436-L439 PolarHBondContact O-N 3.01Å; I436-K440 HydrophobicContact CD1-CG 4.45Å; I436-K440 WeakPolarHBondContact O-CB 3.3Å; I436-K440 WeakPolarHBondContact O-CG 3.28Å; I436-K440 PolarHBondContact O-N 2.76Å; I436-Y566 HydrophobicContact CD1-CD1 4.45Å; I436-Y566 HydrophobicContact CD1-CE1 4.36Å; I436-Y566 HydrophobicContact CG1-CE1 4.16Å; I436-I569 HydrophobicContact CD1-CD1 3.8Å; I436-F595 HydrophobicContact CD1-CE2 3.79Å; I436-F595 HydrophobicContact CD1-CZ 3.68Å
437	K	85.3	Confident	88.7	Confident	105 Å²	105	51.7 Å²	51.7	46%	0.457	23%	0.225	S	C	.	.	H	α-helix	trans	-67.1	-40.1	177.5	-66.8	-154.2	170.5	-151.7	0	112.7	N435 S441 E599	N435-K437 PolarHBondContact O-N 3.21Å; N435-K437 VanDerWaalsContact O-N 3.15Å; N435-K437 PolarHBondContact OD1-N 2.85Å; N435-K437 VanDerWaalsContact OD1-N 3.12Å; K437-S441 WeakPolarHBondContact O-CB 3.24Å; K437-S441 PolarHBondContact O-N 3.09Å; K437-S441 VanDerWaalsContact O-N 3.16Å; K437-E599 IonicContact NZ-OE2 2.91Å
438	V	88.4	Confident	88.9	Confident	6 Å²	6	56.7 Å²	56.7	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-43.4	174.8	175.2	0	0	0	0	110.6	L59 E63 I434 N435 S441 W442	L59-V438 HydrophobicContact CD2-CG2 4.22Å; E63-V438 HydrophobicContact CG-CG2 4.29Å; E63-V438 VanDerWaalsContact OE1-CG2 3.29Å; E63-V438 WeakPolarHBondContact OE1-CG2 3.34Å; I434-V438 HydrophobicContact CG2-CB 4.03Å; I434-V438 HydrophobicContact CG2-CG1 3.95Å; N435-V438 HydrophobicContact CB-CB 4.44Å; N435-V438 HydrophobicContact CB-CG2 4.31Å; N435-V438 PolarHBondContact O-N 3.22Å; V438-S441 WeakPolarHBondContact O-CB 3.49Å; V438-S441 PolarHBondContact O-N 2.7Å; V438-S441 VanDerWaalsContact O-N 3.16Å; V438-W442 HydrophobicContact CG1-CD2 3.63Å; V438-W442 HydrophobicContact CG1-CE3 3.94Å; V438-W442 HydrophobicContact CG1-CG 4.24Å; V438-W442 HydrophobicContact CG1-CH2 3.92Å; V438-W442 HydrophobicContact CG1-CZ2 3.57Å; V438-W442 HydrophobicContact CG1-CZ3 4.08Å; V438-W442 PolarHBondContact O-N 3.11Å
439	L	91.4	Very high	89.2	Confident	9 Å²	9	56.1 Å²	56.1	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-56.5	-54	176.6	-177.6	70	0	0	0	111.5	I434 N435 I436 S441 W442 C443 L527 M530 V531 I569	I434-L439 HydrophobicContact CG2-CB 4.15Å; N435-L439 PolarHBondContact O-N 3.33Å; I436-L439 HydrophobicContact CD1-CD2 4.15Å; I436-L439 PolarHBondContact O-N 3.01Å; L439-S441 VanDerWaalsContact C-N 3.25Å; L439-S441 PolarHBondContact O-N 3.38Å; L439-W442 PolarHBondContact O-N 3.31Å; L439-C443 WeakPolarHBondContact O-CB 3.45Å; L439-C443 PolarHBondContact O-N 3.29Å; L439-C443 PolarHBondContact O-SG 3.17Å; L439-L527 HydrophobicContact CD1-CD1 4.11Å; L439-L527 HydrophobicContact CD2-CD1 4.29Å; L439-L527 HydrophobicContact CG-CD1 4.34Å; L439-M530 HydrophobicContact CD1-CB 3.6Å; L439-M530 HydrophobicContact CD1-CE 4.17Å; L439-M530 HydrophobicContact CD1-CG 4.35Å; L439-M530 HydrophobicContact CD1-SD 3.94Å; L439-V531 HydrophobicContact CD1-CG2 4.46Å; L439-V531 HydrophobicContact CD2-CG2 3.65Å; L439-I569 HydrophobicContact CD2-CD1 4.04Å
440	K	90.4	Very high	89.6	Confident	19 Å²	19	47.5 Å²	47.5	8%	0.083	21%	0.206	C	C	.	.	H	α-helix	trans	-53.8	-42.9	175.1	-76.2	-176.9	170.1	-160.3	0	111.8	I436 R444 F595 E599	I436-K440 HydrophobicContact CD1-CG 4.45Å; I436-K440 WeakPolarHBondContact O-CB 3.3Å; I436-K440 WeakPolarHBondContact O-CG 3.28Å; I436-K440 PolarHBondContact O-N 2.76Å; K440-R444 VanDerWaalsContact O-CB 3.25Å; K440-R444 WeakPolarHBondContact O-CB 3.21Å; K440-R444 PolarHBondContact O-N 2.81Å; K440-R444 VanDerWaalsContact O-N 3.1Å; K440-F595 HydrophobicContact CD-CD2 4.49Å; K440-F595 HydrophobicContact CD-CE2 4.28Å; K440-F595 HydrophobicContact CD-CZ 4.37Å; K440-F595 WeakPolarHBondContact CD-O 3.46Å; K440-F595 WeakPolarHBondContact CE-O 3.27Å; K440-F595 HydrophobicContact CG-CD1 4.28Å; K440-F595 HydrophobicContact CG-CD2 4.48Å; K440-F595 HydrophobicContact CG-CE1 3.77Å; K440-F595 HydrophobicContact CG-CE2 4.03Å; K440-F595 HydrophobicContact CG-CZ 3.62Å; K440-F595 WeakPolarHBondContact CG-O 3.38Å; K440-F595 PolarHBondContact NZ-O 2.94Å; K440-E599 IonicContact NZ-OE1 3.85Å; K440-E599 PolarHBondContact NZ-OE1 2.77Å
441	S	90	Very high	90.2	Very high	22 Å²	22	43.6 Å²	43.6	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-67	-45.9	179.9	-164.8	0	0	0	0	113.1	K437 V438 L439 Q445	K437-S441 WeakPolarHBondContact O-CB 3.24Å; K437-S441 PolarHBondContact O-N 3.09Å; K437-S441 VanDerWaalsContact O-N 3.16Å; V438-S441 WeakPolarHBondContact O-CB 3.49Å; V438-S441 PolarHBondContact O-N 2.7Å; V438-S441 VanDerWaalsContact O-N 3.16Å; L439-S441 VanDerWaalsContact C-N 3.25Å; L439-S441 PolarHBondContact O-N 3.38Å; S441-Q445 WeakPolarHBondContact O-CB 3.41Å; S441-Q445 WeakPolarHBondContact O-CG 3.46Å; S441-Q445 PolarHBondContact O-N 2.88Å; S441-Q445 VanDerWaalsContact O-N 3.11Å; S441-Q445 PolarHBondContact O-NE2 2.9Å; S441-Q445 VanDerWaalsContact O-NE2 3.09Å; S441-Q445 PolarHBondContact OG-NE2 2.91Å; S441-Q445 VanDerWaalsContact OG-NE2 3.11Å
442	W	94.1	Very high	90.9	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.011	20%	0.195	C	C	.	.	H	α-helix	trans	-66.5	-43.3	178.3	-70.8	-10.1	0	0	0	112.1	L67 L424 Y427 I434 V438 L439 Q445 I446 I472 G477 V479 M530	L67-W442 HydrophobicContact CD2-CZ2 4.4Å; L424-W442 HydrophobicContact CD2-CD2 3.93Å; L424-W442 HydrophobicContact CD2-CE3 3.32Å; L424-W442 HydrophobicContact CD2-CH2 4.12Å; L424-W442 HydrophobicContact CD2-CZ3 3.43Å; L424-W442 VanDerWaalsContact CD2-CZ3 3.43Å; Y427-W442 AromaticContact CD1-CH2 3.85Å; Y427-W442 HydrophobicContact CD1-CH2 3.85Å; Y427-W442 AromaticContact CD1-CZ3 3.97Å; Y427-W442 HydrophobicContact CD1-CZ3 3.97Å; Y427-W442 AromaticContact CD2-CH2 3.96Å; Y427-W442 HydrophobicContact CD2-CH2 3.96Å; Y427-W442 AromaticContact CE1-CH2 3.82Å; Y427-W442 HydrophobicContact CE1-CH2 3.82Å; Y427-W442 HydrophobicContact CE1-CZ3 4.09Å; Y427-W442 AromaticContact CE2-CH2 3.95Å; Y427-W442 HydrophobicContact CE2-CH2 3.95Å; Y427-W442 AromaticContact CG-CH2 3.92Å; Y427-W442 HydrophobicContact CG-CH2 3.92Å; Y427-W442 HydrophobicContact CG-CZ3 4.35Å; Y427-W442 AromaticContact CZ-CH2 3.87Å; I434-W442 HydrophobicContact CD1-CE3 4.19Å; I434-W442 HydrophobicContact CD1-CZ3 3.86Å; I434-W442 HydrophobicContact CG2-CE3 4.46Å; I434-W442 HydrophobicContact CG2-CZ3 4.28Å; V438-W442 HydrophobicContact CG1-CD2 3.63Å; V438-W442 HydrophobicContact CG1-CE3 3.94Å; V438-W442 HydrophobicContact CG1-CG 4.24Å; V438-W442 HydrophobicContact CG1-CH2 3.92Å; V438-W442 HydrophobicContact CG1-CZ2 3.57Å; V438-W442 HydrophobicContact CG1-CZ3 4.08Å; V438-W442 PolarHBondContact O-N 3.11Å; L439-W442 PolarHBondContact O-N 3.31Å; W442-Q445 WeakPolarHBondContact O-CB 3.19Å; W442-Q445 PolarHBondContact O-N 3.04Å; W442-Q445 VanDerWaalsContact O-N 3.14Å; W442-I446 WeakPolarHBondContact O-CD1 3.38Å; W442-I446 VanDerWaalsContact O-CG1 3.31Å; W442-I446 WeakPolarHBondContact O-CG1 3.14Å; W442-I446 PolarHBondContact O-N 3.34Å; W442-I472 HydrophobicContact CH2-CD1 3.96Å; W442-I472 HydrophobicContact CZ2-CD1 4.23Å; W442-I472 HydrophobicContact CZ2-CG2 4.34Å; W442-G477 PolarHBondContact NE1-O 2.94Å; W442-V479 HydrophobicContact CB-CG1 4.29Å; W442-V479 HydrophobicContact CB-CG2 4.17Å; W442-V479 HydrophobicContact CD2-CG1 4.03Å; W442-V479 HydrophobicContact CG-CG1 3.76Å; W442-V479 HydrophobicContact CG-CG2 4.35Å; W442-M530 HydrophobicContact CE3-SD 4.34Å
443	C	95.6	Very high	91.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.7	-46.5	178.3	-64.1	0	0	0	0	112	L439 Q445 I446 L447 F523 M530 F596	L439-C443 WeakPolarHBondContact O-CB 3.45Å; L439-C443 PolarHBondContact O-N 3.29Å; L439-C443 PolarHBondContact O-SG 3.17Å; C443-Q445 PolarHBondContact O-N 3.18Å; C443-I446 PolarHBondContact O-N 2.7Å; C443-L447 WeakPolarHBondContact O-CB 3.45Å; C443-L447 WeakPolarHBondContact O-CG 3.27Å; C443-L447 PolarHBondContact O-N 2.92Å; C443-F523 HydrophobicContact CB-CE2 4.04Å; C443-F523 HydrophobicContact CB-CZ 4.05Å; C443-M530 VanDerWaalsContact SG-CE 3.52Å; C443-F596 HydrophobicContact CB-CD1 3.93Å; C443-F596 HydrophobicContact CB-CE1 3.27Å; C443-F596 HydrophobicContact CB-CZ 4.08Å
444	R	93.7	Very high	92.4	Very high	43 Å²	43	26.3 Å²	26.3	16%	0.162	13%	0.127	C	C	.	.	H	α-helix	trans	-57.8	-34.8	173.1	175.1	171.7	55.9	-123.6	0.3	112.8	K440 K448 F596	K440-R444 VanDerWaalsContact O-CB 3.25Å; K440-R444 WeakPolarHBondContact O-CB 3.21Å; K440-R444 PolarHBondContact O-N 2.81Å; K440-R444 VanDerWaalsContact O-N 3.1Å; R444-K448 WeakPolarHBondContact O-CG 3.16Å; R444-K448 PolarHBondContact O-N 3.12Å; R444-F596 HydrophobicContact CB-CB 4.49Å; R444-F596 WeakPolarHBondContact CD-O 3.43Å; R444-F596 PolarHBondContact NH1-O 2.86Å
445	Q	95	Very high	92.7	Very high	25 Å²	25	27.8 Å²	27.8	12%	0.117	14%	0.137	C	C	.	.	H	α-helix	trans	-73.2	-40.5	176.6	-76.7	172.9	62.8	0	0	112.8	N392 S441 W442 C443 K448 G449 V479	N392-Q445 VanDerWaalsContact CB-O 3.29Å; N392-Q445 WeakPolarHBondContact CB-O 3.47Å; N392-Q445 WeakPolarHBondContact ND2-CB 3.37Å; N392-Q445 PolarHBondContact ND2-OE1 3.29Å; S441-Q445 WeakPolarHBondContact O-CB 3.41Å; S441-Q445 WeakPolarHBondContact O-CG 3.46Å; S441-Q445 PolarHBondContact O-N 2.88Å; S441-Q445 VanDerWaalsContact O-N 3.11Å; S441-Q445 PolarHBondContact O-NE2 2.9Å; S441-Q445 VanDerWaalsContact O-NE2 3.09Å; S441-Q445 PolarHBondContact OG-NE2 2.91Å; S441-Q445 VanDerWaalsContact OG-NE2 3.11Å; W442-Q445 WeakPolarHBondContact O-CB 3.19Å; W442-Q445 PolarHBondContact O-N 3.04Å; W442-Q445 VanDerWaalsContact O-N 3.14Å; C443-Q445 PolarHBondContact O-N 3.18Å; Q445-K448 PolarHBondContact O-N 2.55Å; Q445-G449 PolarHBondContact O-N 3.5Å; Q445-V479 HydrophobicContact CB-CG2 3.55Å
446	I	97.1	Very high	92.8	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-62.4	-47.9	173	-63.3	155.3	0	0	0	109.8	L424 W442 C443 K448 G449 L450 I470 V479 I481 F523 M530	L424-I446 HydrophobicContact CD1-CD1 4.11Å; W442-I446 WeakPolarHBondContact O-CD1 3.38Å; W442-I446 VanDerWaalsContact O-CG1 3.31Å; W442-I446 WeakPolarHBondContact O-CG1 3.14Å; W442-I446 PolarHBondContact O-N 3.34Å; C443-I446 PolarHBondContact O-N 2.7Å; I446-K448 VanDerWaalsContact C-N 3.31Å; I446-K448 PolarHBondContact O-N 2.79Å; I446-G449 CarbonylContact O-C 3.57Å; I446-G449 WeakPolarHBondContact O-CA 3.35Å; I446-G449 PolarHBondContact O-N 3.1Å; I446-L450 HydrophobicContact CG2-CD1 4.36Å; I446-L450 HydrophobicContact CG2-CG 4.45Å; I446-L450 PolarHBondContact O-N 2.96Å; I446-I470 HydrophobicContact CD1-CD1 3.93Å; I446-I470 HydrophobicContact CD1-CG2 4.29Å; I446-I470 HydrophobicContact CG1-CD1 4.21Å; I446-I470 HydrophobicContact CG1-CG2 4.12Å; I446-I470 HydrophobicContact CG2-CD1 4.45Å; I446-V479 HydrophobicContact CG1-CG2 4.09Å; I446-I481 HydrophobicContact CG2-CD1 4.02Å; I446-F523 HydrophobicContact CB-CD2 4.34Å; I446-F523 HydrophobicContact CB-CE2 4.37Å; I446-F523 HydrophobicContact CG2-CD2 3.8Å; I446-F523 HydrophobicContact CG2-CE2 4.33Å; I446-M530 HydrophobicContact CD1-CE 4.25Å
447	L	97	Very high	92.5	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-37.3	177	-70.2	169.8	0	0	0	112.6	C443 S451 F523 V587 L590 L591 F596	C443-L447 WeakPolarHBondContact O-CB 3.45Å; C443-L447 WeakPolarHBondContact O-CG 3.27Å; C443-L447 PolarHBondContact O-N 2.92Å; L447-S451 WeakPolarHBondContact O-CB 3.28Å; L447-S451 PolarHBondContact O-N 2.87Å; L447-F523 HydrophobicContact CD1-CE1 4.21Å; L447-F523 HydrophobicContact CD1-CE2 4.26Å; L447-F523 HydrophobicContact CD1-CZ 3.71Å; L447-F523 HydrophobicContact CD2-CD1 3.97Å; L447-F523 HydrophobicContact CD2-CD2 4.17Å; L447-F523 HydrophobicContact CD2-CE1 3.81Å; L447-F523 HydrophobicContact CD2-CE2 4Å; L447-F523 HydrophobicContact CD2-CG 4.15Å; L447-F523 HydrophobicContact CD2-CZ 3.82Å; L447-F523 HydrophobicContact CG-CD2 4.32Å; L447-F523 HydrophobicContact CG-CE1 4.17Å; L447-F523 HydrophobicContact CG-CE2 3.75Å; L447-F523 HydrophobicContact CG-CZ 3.66Å; L447-V587 HydrophobicContact CB-CG1 4.33Å; L447-V587 HydrophobicContact CD2-CG1 4.05Å; L447-V587 VanDerWaalsContact O-CG1 3.22Å; L447-V587 WeakPolarHBondContact O-CG1 3.41Å; L447-L590 HydrophobicContact CD1-CB 3.89Å; L447-L590 HydrophobicContact CD2-CB 3.84Å; L447-L590 HydrophobicContact CD2-CD1 3.81Å; L447-L590 HydrophobicContact CD2-CG 4.49Å; L447-L591 HydrophobicContact CB-CD2 3.57Å; L447-L591 HydrophobicContact CB-CG 3.9Å; L447-F596 HydrophobicContact CD1-CD2 4.01Å; L447-F596 HydrophobicContact CD1-CE2 3.93Å; L447-F596 HydrophobicContact CD1-CG 4.3Å; L447-F596 HydrophobicContact CD1-CZ 4.21Å
448	K	96.2	Very high	92.2	Very high	106 Å²	106	31.9 Å²	31.9	46%	0.461	16%	0.161	S	C	.	.	H	α-helix	trans	-64.3	-41.4	170.7	-78.1	-177.9	177.5	-166.7	0	112.3	R444 Q445 I446 S451 F452 L591	R444-K448 WeakPolarHBondContact O-CG 3.16Å; R444-K448 PolarHBondContact O-N 3.12Å; Q445-K448 PolarHBondContact O-N 2.55Å; I446-K448 VanDerWaalsContact C-N 3.31Å; I446-K448 PolarHBondContact O-N 2.79Å; K448-S451 PolarHBondContact O-N 2.93Å; K448-F452 WeakPolarHBondContact O-CB 3.35Å; K448-F452 PolarHBondContact O-N 2.99Å; K448-L591 HydrophobicContact CG-CD2 4.02Å
449	G	96.1	Very high	92.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.3	-49.7	173.6	0	0	0	0	0	112.7	Q445 I446 F452 L453	Q445-G449 PolarHBondContact O-N 3.5Å; I446-G449 CarbonylContact O-C 3.57Å; I446-G449 WeakPolarHBondContact O-CA 3.35Å; I446-G449 PolarHBondContact O-N 3.1Å; G449-F452 WeakPolarHBondContact O-CB 3.37Å; G449-F452 PolarHBondContact O-N 3.11Å; G449-L453 WeakPolarHBondContact O-CG 3.39Å; G449-L453 PolarHBondContact O-N 2.73Å; G449-L453 VanDerWaalsContact O-N 3.14Å
450	L	96.3	Very high	91.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-45.8	176.2	-65.5	-179.2	0	0	0	111.8	I446 F452 L453 H454 L465 I481 D519 F523 V587	I446-L450 HydrophobicContact CG2-CD1 4.36Å; I446-L450 HydrophobicContact CG2-CG 4.45Å; I446-L450 PolarHBondContact O-N 2.96Å; L450-F452 VanDerWaalsContact C-N 3.26Å; L450-F452 PolarHBondContact O-N 3.32Å; L450-L453 PolarHBondContact O-N 3.5Å; L450-H454 WeakPolarHBondContact O-CB 3.2Å; L450-H454 PolarHBondContact O-N 2.68Å; L450-L465 HydrophobicContact CD1-CD2 3.89Å; L450-L465 HydrophobicContact CD2-CD1 4.49Å; L450-L465 HydrophobicContact CD2-CD2 4.13Å; L450-L465 HydrophobicContact CG-CD2 4.49Å; L450-I481 HydrophobicContact CD2-CD1 3.98Å; L450-I481 HydrophobicContact CG-CD1 4.09Å; L450-D519 HydrophobicContact CD1-CB 4.21Å; L450-D519 HydrophobicContact CD2-CB 3.96Å; L450-F523 HydrophobicContact CD1-CB 4.21Å; L450-V587 HydrophobicContact CB-CG1 4.17Å; L450-V587 HydrophobicContact CB-CG2 4.17Å
451	S	95.5	Very high	91.4	Very high	29 Å²	29	32.3 Å²	32.3	20%	0.203	17%	0.166	C	C	.	.	H	α-helix	trans	-57.5	-39.1	176.6	-172.3	0	0	0	0	112.1	L447 K448 T455	L447-S451 WeakPolarHBondContact O-CB 3.28Å; L447-S451 PolarHBondContact O-N 2.87Å; K448-S451 PolarHBondContact O-N 2.93Å; S451-T455 VanDerWaalsContact O-CB 3.32Å; S451-T455 WeakPolarHBondContact O-CB 3.32Å; S451-T455 WeakPolarHBondContact O-CG2 3.43Å; S451-T455 PolarHBondContact O-N 2.87Å; S451-T455 VanDerWaalsContact O-N 3.07Å; S451-T455 PolarHBondContact O-OG1 2.75Å
452	F	95.2	Very high	91.3	Very high	28 Å²	28	31.4 Å²	31.4	12%	0.123	16%	0.159	C	C	.	.	H	α-helix	trans	-62.4	-45.6	172.9	171.8	-95.3	0	0	0	112.4	L388 H390 I393 K448 G449 L450 T455 R456	L388-F452 HydrophobicContact CB-CE1 4.12Å; L388-F452 HydrophobicContact CD2-CE1 3.95Å; L388-F452 HydrophobicContact CD2-CZ 4.32Å; H390-F452 HydrophobicContact CB-CB 4.32Å; H390-F452 HydrophobicContact CB-CD1 3.59Å; H390-F452 HydrophobicContact CB-CD2 3.85Å; H390-F452 HydrophobicContact CB-CE1 3.75Å; H390-F452 HydrophobicContact CB-CE2 3.99Å; H390-F452 HydrophobicContact CB-CG 3.64Å; H390-F452 HydrophobicContact CB-CZ 3.95Å; H390-F452 AromaticContact CD2-CD2 3.84Å; H390-F452 AromaticContact CD2-CG 3.82Å; H390-F452 AromaticContact CG-CG 3.7Å; I393-F452 HydrophobicContact CG1-CD1 4.04Å; I393-F452 HydrophobicContact CG1-CE1 4.46Å; K448-F452 WeakPolarHBondContact O-CB 3.35Å; K448-F452 PolarHBondContact O-N 2.99Å; G449-F452 WeakPolarHBondContact O-CB 3.37Å; G449-F452 PolarHBondContact O-N 3.11Å; L450-F452 VanDerWaalsContact C-N 3.26Å; L450-F452 PolarHBondContact O-N 3.32Å; F452-T455 PolarHBondContact O-N 3.05Å; F452-T455 PolarHBondContact O-OG1 3.12Å; F452-R456 PolarHBondContact O-N 3.49Å; F452-R456 PolarHBondContact O-NE 2.94Å; F452-R456 PolarHBondContact O-NH2 2.98Å
453	L	92.3	Very high	90.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.3	-45.7	178.8	-63.5	173.5	0	0	0	112.4	L388 I393 G449 L450 T455 R456 V460 L484	L388-L453 HydrophobicContact CD1-CD2 3.81Å; I393-L453 HydrophobicContact CD1-CD1 3.86Å; I393-L453 HydrophobicContact CD1-CD2 4.15Å; I393-L453 HydrophobicContact CD1-CG 3.94Å; G449-L453 WeakPolarHBondContact O-CG 3.39Å; G449-L453 PolarHBondContact O-N 2.73Å; G449-L453 VanDerWaalsContact O-N 3.14Å; L450-L453 PolarHBondContact O-N 3.5Å; L453-T455 PolarHBondContact O-N 3.16Å; L453-R456 WeakPolarHBondContact O-CB 3.46Å; L453-R456 WeakPolarHBondContact O-CG 3.32Å; L453-R456 PolarHBondContact O-N 3.28Å; L453-R456 VanDerWaalsContact O-N 3.16Å; L453-V460 CarbonylContact C-O 3.57Å; L453-V460 HydrophobicContact CB-CB 4.21Å; L453-V460 WeakPolarHBondContact CB-O 3.36Å; L453-V460 HydrophobicContact CD2-CB 4.32Å; L453-V460 HydrophobicContact CD2-CG1 4.11Å; L453-V460 PolarHBondContact O-N 3.44Å; L453-L484 HydrophobicContact CD1-CD2 3.88Å; L453-L484 HydrophobicContact CD2-CD1 4.02Å; L453-L484 HydrophobicContact CD2-CD2 4.46Å
454	H	92.3	Very high	90	Very high	27 Å²	27	36.1 Å²	36.1	13%	0.125	18%	0.181	C	C	.	.	H	α-helix	trans	-68.7	-16.8	178.9	-61.8	167	0	0	0	113.5	L450 V460 E516 D519	L450-H454 WeakPolarHBondContact O-CB 3.2Å; L450-H454 PolarHBondContact O-N 2.68Å; H454-V460 PolarHBondContact CD2-O 3.07Å; H454-E516 HydrophobicContact CB-CG 3.91Å; H454-E516 PolarHBondContact CE1-O 3.41Å; H454-D519 IonicContact CD2-OD2 2.75Å; H454-D519 IonicContact CE1-OD2 3.07Å; H454-D519 IonicContact NE2-OD2 3.12Å; H454-D519 PolarHBondContact NE2-OD2 2.98Å
455	T	91.2	Very high	89.9	Confident	59 Å²	59	34.1 Å²	34.1	36%	0.362	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	17.1	173.8	58.2	0	0	0	0	113.5	S451 F452 L453	S451-T455 VanDerWaalsContact O-CB 3.32Å; S451-T455 WeakPolarHBondContact O-CB 3.32Å; S451-T455 WeakPolarHBondContact O-CG2 3.43Å; S451-T455 PolarHBondContact O-N 2.87Å; S451-T455 VanDerWaalsContact O-N 3.07Å; S451-T455 PolarHBondContact O-OG1 2.75Å; F452-T455 PolarHBondContact O-N 3.05Å; F452-T455 PolarHBondContact O-OG1 3.12Å; L453-T455 PolarHBondContact O-N 3.16Å
456	R	88.3	Confident	89.8	Confident	84 Å²	84	34.2 Å²	34.2	32%	0.317	17%	0.173	S	C	.	.	S	Bend	trans	-76.3	163	164.9	-61.5	-51.7	85.8	-158.1	-6.9	110.3	L388 F452 L453 P458 P459 V460	L388-R456 HydrophobicContact CD2-CG 3.74Å; F452-R456 PolarHBondContact O-N 3.49Å; F452-R456 PolarHBondContact O-NE 2.94Å; F452-R456 PolarHBondContact O-NH2 2.98Å; L453-R456 WeakPolarHBondContact O-CB 3.46Å; L453-R456 WeakPolarHBondContact O-CG 3.32Å; L453-R456 PolarHBondContact O-N 3.28Å; L453-R456 VanDerWaalsContact O-N 3.16Å; R456-P458 CarbonylContact C-O 3.6Å; R456-P458 VanDerWaalsContact CB-O 3.28Å; R456-P458 WeakPolarHBondContact CB-O 3.22Å; R456-P458 CarbonylContact O-C 3.59Å; R456-P459 WeakPolarHBondContact O-CA 3.22Å; R456-P459 VanDerWaalsContact O-N 3.07Å; R456-V460 HydrophobicContact CB-CG2 4.08Å; R456-V460 HydrophobicContact CG-CG2 4.08Å
457	N	80.6	Confident	89.6	Confident	161 Å²	161	34.1 Å²	34.1	86%	0.861	17%	0.173	S	C	*	.	S	Bend	trans	-123.4	104.9	175.2	-64.4	86.5	0	0	0	108.6
458	P	79.9	Confident	89.3	Confident	47 Å²	47	37 Å²	37	31%	0.305	19%	0.188	S	C	.	.	S	Bend	cis	-66.6	161.3	-6.5	31.6	-39.3	0	0	0	113.6	M384 R456 L489	M384-P458 HydrophobicContact SD-CG 4.47Å; R456-P458 CarbonylContact C-O 3.6Å; R456-P458 VanDerWaalsContact CB-O 3.28Å; R456-P458 WeakPolarHBondContact CB-O 3.22Å; R456-P458 CarbonylContact O-C 3.59Å; P458-L489 HydrophobicContact CB-CD2 4.33Å; P458-L489 HydrophobicContact CG-CD1 4.14Å; P458-L489 HydrophobicContact CG-CD2 3.4Å; P458-L489 VanDerWaalsContact CG-CD2 3.4Å; P458-L489 HydrophobicContact CG-CG 4.34Å
459	P	85.3	Confident	89.1	Confident	31 Å²	31	32.5 Å²	32.5	20%	0.201	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-60.2	138.9	175.2	-26.1	35.9	0	0	0	112.7	R456 E516	R456-P459 WeakPolarHBondContact O-CA 3.22Å; R456-P459 VanDerWaalsContact O-N 3.07Å; P459-E516 WeakPolarHBondContact CB-OE1 3.3Å
460	V	83.5	Confident	89.1	Confident	12 Å²	12	32.5 Å²	32.5	7%	0.073	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-101.4	122.5	176.1	177.8	0	0	0	0	108.8	L453 H454 R456 A487	L453-V460 CarbonylContact C-O 3.57Å; L453-V460 HydrophobicContact CB-CB 4.21Å; L453-V460 WeakPolarHBondContact CB-O 3.36Å; L453-V460 HydrophobicContact CD2-CB 4.32Å; L453-V460 HydrophobicContact CD2-CG1 4.11Å; L453-V460 PolarHBondContact O-N 3.44Å; H454-V460 PolarHBondContact CD2-O 3.07Å; R456-V460 HydrophobicContact CB-CG2 4.08Å; R456-V460 HydrophobicContact CG-CG2 4.08Å; V460-A487 HydrophobicContact CG1-CB 4.24Å
461	I	85.1	Confident	89	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.			trans	-105.8	130.6	178.5	-55.1	165.5	0	0	0	108.2	R463 A487 K490 Y514 V518	I461-R463 HydrophobicContact CB-CG 4.35Å; I461-R463 HydrophobicContact CG2-CG 3.86Å; I461-A487 WeakPolarHBondContact O-CB 3.47Å; I461-K490 HydrophobicContact CD1-CB 3.94Å; I461-K490 HydrophobicContact CD1-CD 4.19Å; I461-K490 HydrophobicContact CD1-CG 3.91Å; I461-Y514 HydrophobicContact CD1-CD2 4.15Å; I461-Y514 HydrophobicContact CD1-CE2 4.43Å; I461-V518 HydrophobicContact CG2-CG2 3.62Å
462	H	86.8	Confident	88.8	Confident	4 Å²	4	33 Å²	33	2%	0.019	17%	0.168	C	C	.	.			trans	-74.6	-42	-173.4	-170.9	-61.1	0	0	0	112.9	D464 L465 I481 G482 L484 D519	H462-D464 PolarHBondContact CE1-O 3Å; H462-D464 VanDerWaalsContact CE1-O 3.27Å; H462-D464 VanDerWaalsContact ND1-C 3.28Å; H462-D464 PolarHBondContact ND1-N 2.66Å; H462-D464 PolarHBondContact O-N 2.77Å; H462-L465 PolarHBondContact ND1-N 2.92Å; H462-I481 WeakPolarHBondContact CD2-CG2 3.11Å; H462-I481 WeakPolarHBondContact NE2-CG2 3.34Å; H462-G482 PolarHBondContact NE2-O 3.5Å; H462-L484 HydrophobicContact CB-CD2 4.47Å; H462-L484 WeakPolarHBondContact CD2-CD2 3.34Å; H462-D519 WeakPolarHBondContact CB-OD1 3.35Å; H462-D519 PolarHBondContact N-OD1 3.38Å; H462-D519 PolarHBondContact N-OD2 2.83Å
463	R	81.2	Confident	88.6	Confident	51 Å²	51	32.6 Å²	32.6	19%	0.192	17%	0.168	C	C	.	.	S	Bend	trans	66.4	-42.2	177.9	-46.1	-174	-58.6	161.7	1.9	116.4	I461 L486 T488 M509 Y514 D519	I461-R463 HydrophobicContact CB-CG 4.35Å; I461-R463 HydrophobicContact CG2-CG 3.86Å; R463-L486 PolarHBondContact NH2-O 2.91Å; R463-T488 WeakPolarHBondContact CD-OG1 3.22Å; R463-T488 VanDerWaalsContact CZ-CG2 3.47Å; R463-T488 VanDerWaalsContact CZ-OG1 3.26Å; R463-T488 PolarHBondContact NE-OG1 3.38Å; R463-T488 PolarHBondContact NH1-OG1 3.16Å; R463-M509 HydrophobicContact CB-SD 4.08Å; R463-M509 WeakPolarHBondContact O-CE 3.45Å; R463-Y514 VanDerWaalsContact CD-CE2 3.42Å; R463-Y514 HydrophobicContact CG-CE2 4.14Å; R463-Y514 PolarHBondContact NH1-OH 3.32Å; R463-D519 PolarHBondContact N-OD1 3.06Å
464	D	82.1	Confident	87.6	Confident	50 Å²	50	33.9 Å²	33.9	27%	0.267	18%	0.181	S	C	.	.	S	Bend	trans	-105.5	42.6	177.6	-166	45.5	0	0	0	112.3	H462 K466 N469	H462-D464 PolarHBondContact CE1-O 3Å; H462-D464 VanDerWaalsContact CE1-O 3.27Å; H462-D464 VanDerWaalsContact ND1-C 3.28Å; H462-D464 PolarHBondContact ND1-N 2.66Å; H462-D464 PolarHBondContact O-N 2.77Å; D464-K466 PolarHBondContact O-N 3.37Å; D464-K466 IonicContact OD1-NZ 2.73Å; D464-K466 PolarHBondContact OD1-NZ 3.23Å; D464-K466 VanDerWaalsContact OD2-CE 3.31Å; D464-K466 WeakPolarHBondContact OD2-CE 3.37Å; D464-K466 IonicContact OD2-NZ 3.78Å; D464-K466 PolarHBondContact OD2-NZ 2.98Å; D464-N469 PolarHBondContact O-ND2 3.15Å; D464-N469 PolarHBondContact OD2-ND2 3.42Å
465	L	92	Very high	86.2	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.215	C	C	.	.			trans	-75.4	125.1	179.8	-175.1	74.8	0	0	0	110	L450 H462 I470 I481 D519 A522 F523	L450-L465 HydrophobicContact CD1-CD2 3.89Å; L450-L465 HydrophobicContact CD2-CD1 4.49Å; L450-L465 HydrophobicContact CD2-CD2 4.13Å; L450-L465 HydrophobicContact CG-CD2 4.49Å; H462-L465 PolarHBondContact ND1-N 2.92Å; L465-I470 HydrophobicContact CD1-CD1 4.08Å; L465-I470 HydrophobicContact CD1-CG1 4.08Å; L465-I481 HydrophobicContact CD1-CD1 4.38Å; L465-I481 HydrophobicContact CD1-CG2 3.68Å; L465-D519 WeakPolarHBondContact CD2-O 3.42Å; L465-A522 HydrophobicContact CB-CB 3.83Å; L465-A522 HydrophobicContact CD2-CB 4.21Å; L465-A522 HydrophobicContact CG-CB 4.42Å; L465-F523 HydrophobicContact CD2-CB 4.13Å
466	K	91.7	Very high	85	Confident	27 Å²	27	40.4 Å²	40.4	12%	0.117	22%	0.223	C	C	.	.	S	Bend	trans	-161.8	162.4	179.3	59	-159	176.4	-154.2	0	111.2	D464 D468 N469 I470 T501 F504 C526	D464-K466 PolarHBondContact O-N 3.37Å; D464-K466 IonicContact OD1-NZ 2.73Å; D464-K466 PolarHBondContact OD1-NZ 3.23Å; D464-K466 VanDerWaalsContact OD2-CE 3.31Å; D464-K466 WeakPolarHBondContact OD2-CE 3.37Å; D464-K466 IonicContact OD2-NZ 3.78Å; D464-K466 PolarHBondContact OD2-NZ 2.98Å; K466-D468 HydrophobicContact CG-CB 4.15Å; K466-D468 PolarHBondContact O-N 3.01Å; K466-N469 WeakPolarHBondContact CE-OD1 3.49Å; K466-N469 HydrophobicContact CG-CB 4.23Å; K466-N469 PolarHBondContact O-N 3.24Å; K466-I470 WeakPolarHBondContact O-CG1 3.36Å; K466-I470 PolarHBondContact O-N 2.92Å; K466-T501 PolarHBondContact NZ-OG1 3.32Å; K466-F504 HydrophobicContact CB-CD1 4.17Å; K466-F504 HydrophobicContact CB-CD2 3.72Å; K466-F504 HydrophobicContact CB-CE1 4.13Å; K466-F504 HydrophobicContact CB-CE2 3.63Å; K466-F504 HydrophobicContact CB-CG 3.99Å; K466-F504 HydrophobicContact CB-CZ 3.87Å; K466-F504 HydrophobicContact CD-CD2 4.26Å; K466-F504 HydrophobicContact CD-CE2 4.38Å; K466-C526 WeakPolarHBondContact CA-SG 3.17Å
467	C	93.6	Very high	84.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-14.3	178.2	-66.9	0	0	0	0	114.9	L424 K425 E529	L424-C467 HydrophobicContact CB-CB 3.9Å; L424-C467 WeakPolarHBondContact CB-O 3.41Å; L424-C467 PolarHBondContact N-O 2.69Å; L424-C467 VanDerWaalsContact N-O 3.13Å; K425-C467 HydrophobicContact CB-CB 4.08Å; K425-C467 PolarHBondContact N-O 2.69Å; C467-E529 VanDerWaalsContact CB-OE2 3.22Å; C467-E529 WeakPolarHBondContact CB-OE2 3.09Å; C467-E529 PolarHBondContact SG-OE2 2.81Å
468	D	90.3	Very high	85.2	Confident	59 Å²	59	30.5 Å²	30.5	32%	0.316	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-29.1	171.9	-129.7	-7.4	0	0	0	113.2	T423 K425 K466	T423-D468 WeakPolarHBondContact CG2-O 3.27Å; T423-D468 PolarHBondContact OG1-OD1 2.83Å; K425-D468 HydrophobicContact CD-CB 3.83Å; K425-D468 WeakPolarHBondContact CD-OD1 3.36Å; K425-D468 WeakPolarHBondContact CD-OD2 3.29Å; K425-D468 WeakPolarHBondContact CE-OD2 3.45Å; K425-D468 IonicContact NZ-OD2 3.89Å; K425-D468 PolarHBondContact NZ-OD2 2.78Å; K466-D468 HydrophobicContact CG-CB 4.15Å; K466-D468 PolarHBondContact O-N 3.01Å
469	N	92.3	Very high	85.9	Confident	13 Å²	13	28.3 Å²	28.3	7%	0.07	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-0.8	-179	-66	1	0	0	0	112.2	D464 K466 F471 G482	D464-N469 PolarHBondContact O-ND2 3.15Å; D464-N469 PolarHBondContact OD2-ND2 3.42Å; K466-N469 WeakPolarHBondContact CE-OD1 3.49Å; K466-N469 HydrophobicContact CG-CB 4.23Å; K466-N469 PolarHBondContact O-N 3.24Å; N469-F471 WeakPolarHBondContact O-CD2 3.33Å; N469-F471 WeakPolarHBondContact O-CE2 3.48Å; N469-G482 PolarHBondContact O-N 3.12Å
470	I	95	Very high	86.5	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	110.4	174.4	-56.7	161.9	0	0	0	108.5	T423 L424 I446 L465 K466 V479	T423-I470 CarbonylContact C-O 3.57Å; T423-I470 VanDerWaalsContact CA-O 3.3Å; T423-I470 WeakPolarHBondContact CA-O 3.44Å; L424-I470 HydrophobicContact CD1-CB 3.79Å; L424-I470 HydrophobicContact CD1-CD1 4.05Å; L424-I470 HydrophobicContact CD1-CG2 3.5Å; L424-I470 VanDerWaalsContact CD1-CG2 3.5Å; L424-I470 HydrophobicContact CG-CB 4.12Å; L424-I470 HydrophobicContact CG-CG2 3.87Å; L424-I470 PolarHBondContact N-O 2.75Å; I446-I470 HydrophobicContact CD1-CD1 3.93Å; I446-I470 HydrophobicContact CD1-CG2 4.29Å; I446-I470 HydrophobicContact CG1-CD1 4.21Å; I446-I470 HydrophobicContact CG1-CG2 4.12Å; I446-I470 HydrophobicContact CG2-CD1 4.45Å; L465-I470 HydrophobicContact CD1-CD1 4.08Å; L465-I470 HydrophobicContact CD1-CG1 4.08Å; K466-I470 WeakPolarHBondContact O-CG1 3.36Å; K466-I470 PolarHBondContact O-N 2.92Å; I470-V479 HydrophobicContact CG2-CB 4.01Å; I470-V479 HydrophobicContact CG2-CG1 4.44Å
471	F	94.5	Very high	87	Confident	39 Å²	39	27.4 Å²	27.4	17%	0.171	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	148.8	-174	-63.2	-91.1	0	0	0	111.8	V394 M419 G422 T423 N469 V479 K480	V394-F471 HydrophobicContact CG2-CD2 3.83Å; V394-F471 HydrophobicContact CG2-CE2 4.47Å; V394-F471 HydrophobicContact CG2-CG 4.48Å; M419-F471 HydrophobicContact CB-CB 3.8Å; M419-F471 HydrophobicContact CB-CD1 3.44Å; M419-F471 VanDerWaalsContact CB-CD1 3.44Å; M419-F471 HydrophobicContact CB-CE1 4.17Å; M419-F471 HydrophobicContact CB-CG 3.72Å; M419-F471 HydrophobicContact CE-CB 3.55Å; M419-F471 HydrophobicContact CG-CB 3.63Å; M419-F471 HydrophobicContact CG-CD1 3.86Å; M419-F471 HydrophobicContact CG-CD2 4.17Å; M419-F471 HydrophobicContact CG-CG 3.62Å; M419-F471 HydrophobicContact SD-CB 4.32Å; G422-F471 WeakPolarHBondContact O-CA 3.41Å; T423-F471 HydrophobicContact CG2-CD1 3.71Å; T423-F471 HydrophobicContact CG2-CE1 3.71Å; T423-F471 HydrophobicContact CG2-CG 4.44Å; T423-F471 HydrophobicContact CG2-CZ 4.44Å; N469-F471 WeakPolarHBondContact O-CD2 3.33Å; N469-F471 WeakPolarHBondContact O-CE2 3.48Å; F471-V479 CarbonylContact O-C 3.54Å; F471-V479 VanDerWaalsContact O-CA 3.28Å; F471-V479 WeakPolarHBondContact O-CA 3.48Å; F471-K480 PolarHBondContact N-O 2.96Å; F471-K480 PolarHBondContact O-N 3.15Å
472	I	92.8	Very high	87.3	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	142.8	178.1	-46	175.1	0	0	0	109.9	L67 S421 G422 L424 Y427 W442 V479	L67-I472 HydrophobicContact CD2-CD1 4.42Å; L67-I472 HydrophobicContact CD2-CG2 3.73Å; S421-I472 WeakPolarHBondContact CB-O 3.46Å; G422-I472 PolarHBondContact O-N 2.88Å; L424-I472 HydrophobicContact CD2-CD1 4.08Å; L424-I472 HydrophobicContact CD2-CG1 4.11Å; Y427-I472 HydrophobicContact CD2-CD1 3.98Å; Y427-I472 HydrophobicContact CG-CD1 4.04Å; W442-I472 HydrophobicContact CH2-CD1 3.96Å; W442-I472 HydrophobicContact CZ2-CD1 4.23Å; W442-I472 HydrophobicContact CZ2-CG2 4.34Å; I472-V479 HydrophobicContact CG1-CG1 4.33Å
473	T	89.1	Confident	87	Confident	20 Å²	20	30.5 Å²	30.5	12%	0.123	18%	0.175	C	C	.	.			trans	-96.9	116	168.4	62.5	0	0	0	0	110.5	M419 T475 T476 G477 S478 K480	M419-T473 HydrophobicContact CE-CG2 3.82Å; T473-T475 VanDerWaalsContact C-N 3.26Å; T473-T475 PolarHBondContact O-N 2.72Å; T473-T476 PolarHBondContact O-N 3.21Å; T473-T476 PolarHBondContact OG1-OG1 2.78Å; T473-G477 WeakPolarHBondContact O-CA 3.44Å; T473-G477 PolarHBondContact O-N 3.3Å; T473-S478 PolarHBondContact N-O 2.98Å; T473-S478 PolarHBondContact OG1-N 3.49Å; T473-S478 PolarHBondContact OG1-O 3.02Å; T473-S478 PolarHBondContact OG1-OG 3.21Å; T473-K480 HydrophobicContact CG2-CD 3.94Å
474	G	72	Confident	86.6	Confident	27 Å²	27	28.7 Å²	28.7	28%	0.278	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-25.2	-177.4	0	0	0	0	0	114.4	S421	S421-G474 WeakPolarHBondContact OG-CA 3.38Å; S421-G474 PolarHBondContact OG-N 3.18Å
475	T	63.7	Low	85.3	Confident	135 Å²	135	27.3 Å²	27.3	83%	0.828	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-19.7	-177.1	48.7	0	0	0	0	114.6	T473	T473-T475 VanDerWaalsContact C-N 3.26Å; T473-T475 PolarHBondContact O-N 2.72Å
476	T	65.6	Low	83.5	Confident	88 Å²	88	32.3 Å²	32.3	54%	0.54	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.1	-12.5	-176.7	65.8	0	0	0	0	114.2	T473 S478	T473-T476 PolarHBondContact O-N 3.21Å; T473-T476 PolarHBondContact OG1-OG1 2.78Å; T476-S478 PolarHBondContact O-N 3.24Å; T476-S478 WeakPolarHBondContact OG1-CB 3.5Å; T476-S478 PolarHBondContact OG1-N 3.01Å; T476-S478 PolarHBondContact OG1-OG 2.92Å
477	G	80.7	Confident	81.7	Confident	6 Å²	6	31.4 Å²	31.4	6%	0.062	19%	0.19	C	C	.	.			trans	68	12.5	-169.7	0	0	0	0	0	113.8	W442 T473	W442-G477 PolarHBondContact NE1-O 2.94Å; T473-G477 WeakPolarHBondContact O-CA 3.44Å; T473-G477 PolarHBondContact O-N 3.3Å
478	S	92.2	Very high	79.5	Confident	30 Å²	30	31.7 Å²	31.7	21%	0.21	19%	0.192	C	C	.	.			trans	-81.5	152.9	174.2	65.7	0	0	0	0	111.9	T473 T476	T473-S478 PolarHBondContact N-O 2.98Å; T473-S478 PolarHBondContact OG1-N 3.49Å; T473-S478 PolarHBondContact OG1-O 3.02Å; T473-S478 PolarHBondContact OG1-OG 3.21Å; T476-S478 PolarHBondContact O-N 3.24Å; T476-S478 WeakPolarHBondContact OG1-CB 3.5Å; T476-S478 PolarHBondContact OG1-N 3.01Å; T476-S478 PolarHBondContact OG1-OG 2.92Å
479	V	95.4	Very high	77.2	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	147	-178.8	-69.3	0	0	0	0	112.2	N392 L424 W442 Q445 I446 I470 F471 I472	N392-V479 WeakPolarHBondContact CA-O 3.48Å; N392-V479 WeakPolarHBondContact CB-O 3.25Å; N392-V479 PolarHBondContact ND2-O 3.5Å; L424-V479 HydrophobicContact CD2-CG1 4.1Å; W442-V479 HydrophobicContact CB-CG1 4.29Å; W442-V479 HydrophobicContact CB-CG2 4.17Å; W442-V479 HydrophobicContact CD2-CG1 4.03Å; W442-V479 HydrophobicContact CG-CG1 3.76Å; W442-V479 HydrophobicContact CG-CG2 4.35Å; Q445-V479 HydrophobicContact CB-CG2 3.55Å; I446-V479 HydrophobicContact CG1-CG2 4.09Å; I470-V479 HydrophobicContact CG2-CB 4.01Å; I470-V479 HydrophobicContact CG2-CG1 4.44Å; F471-V479 CarbonylContact O-C 3.54Å; F471-V479 VanDerWaalsContact O-CA 3.28Å; F471-V479 WeakPolarHBondContact O-CA 3.48Å; I472-V479 HydrophobicContact CG1-CG1 4.33Å
480	K	96.1	Very high	74.9	Confident	24 Å²	24	33.1 Å²	33.1	10%	0.104	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.8	-179.5	-80	167.6	164.5	-88.9	0	110.6	P391 N392 I393 V394 E417 M419 F471 T473	P391-K480 VanDerWaalsContact O-CE 3.27Å; P391-K480 WeakPolarHBondContact O-CE 3.47Å; P391-K480 VanDerWaalsContact O-CG 3.27Å; P391-K480 WeakPolarHBondContact O-CG 3.26Å; N392-K480 WeakPolarHBondContact O-CA 3.29Å; I393-K480 PolarHBondContact O-NZ 3.34Å; V394-K480 HydrophobicContact CG2-CB 3.75Å; E417-K480 VanDerWaalsContact CD-NZ 3.27Å; E417-K480 WeakPolarHBondContact OE1-CE 3.46Å; E417-K480 IonicContact OE1-NZ 3.82Å; E417-K480 PolarHBondContact OE1-NZ 3.02Å; E417-K480 IonicContact OE2-NZ 3.86Å; E417-K480 PolarHBondContact OE2-NZ 2.88Å; M419-K480 HydrophobicContact CE-CB 4.13Å; M419-K480 HydrophobicContact CE-CD 3.77Å; M419-K480 HydrophobicContact CE-CG 4.5Å; M419-K480 HydrophobicContact SD-CD 3.84Å; F471-K480 PolarHBondContact N-O 2.96Å; F471-K480 PolarHBondContact O-N 3.15Å; T473-K480 HydrophobicContact CG2-CD 3.94Å
481	I	95.4	Very high	72.2	Confident	1 Å²	1	39 Å²	39	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	129.6	173.8	-48	175.2	0	0	0	108.8	N392 I393 V394 I446 L450 H462 L465	N392-I481 PolarHBondContact O-N 3.26Å; I393-I481 WeakPolarHBondContact CA-O 3.33Å; I393-I481 HydrophobicContact CD1-CB 4Å; I393-I481 HydrophobicContact CD1-CD1 4.27Å; I393-I481 HydrophobicContact CD1-CG1 4.44Å; V394-I481 PolarHBondContact N-O 3.27Å; I446-I481 HydrophobicContact CG2-CD1 4.02Å; L450-I481 HydrophobicContact CD2-CD1 3.98Å; L450-I481 HydrophobicContact CG-CD1 4.09Å; H462-I481 WeakPolarHBondContact CD2-CG2 3.11Å; H462-I481 WeakPolarHBondContact NE2-CG2 3.34Å; L465-I481 HydrophobicContact CD1-CD1 4.38Å; L465-I481 HydrophobicContact CD1-CG2 3.68Å
482	G	90.4	Very high	69.6	Low	2 Å²	2	43.6 Å²	43.6	2%	0.021	25%	0.247	C	C	.	.			trans	-132.8	-173.2	-177.3	0	0	0	0	0	113.7	H462 N469 L484	H462-G482 PolarHBondContact NE2-O 3.5Å; N469-G482 PolarHBondContact O-N 3.12Å; G482-L484 PolarHBondContact O-N 2.75Å
483	D	80.4	Confident	67	Low	66 Å²	66	44.4 Å²	44.4	35%	0.353	25%	0.252	S	S	.	.			trans	61	24	-175.6	-82.9	27.9	0	0	0	116.2	K346 G485	K346-D483 IonicContact NZ-OD1 3.91Å; K346-D483 PolarHBondContact NZ-OD1 2.92Å; K346-D483 IonicContact NZ-OD2 3.24Å; K346-D483 PolarHBondContact NZ-OD2 3.37Å; D483-G485 PolarHBondContact O-N 2.84Å
484	L	73.2	Confident	64.3	Low	14 Å²	14	50.9 Å²	50.9	7%	0.073	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-54.3	-8.7	165.5	-64.7	176.3	0	0	0	115.2	L385 L388 I393 L453 H462 G482 L486 A487	L385-L484 HydrophobicContact CD2-CB 3.95Å; L385-L484 HydrophobicContact CD2-CD1 4.48Å; L388-L484 HydrophobicContact CD1-CD1 4.04Å; I393-L484 HydrophobicContact CG2-CD1 3.7Å; L453-L484 HydrophobicContact CD1-CD2 3.88Å; L453-L484 HydrophobicContact CD2-CD1 4.02Å; L453-L484 HydrophobicContact CD2-CD2 4.46Å; H462-L484 HydrophobicContact CB-CD2 4.47Å; H462-L484 WeakPolarHBondContact CD2-CD2 3.34Å; G482-L484 PolarHBondContact O-N 2.75Å; L484-L486 PolarHBondContact O-N 2.83Å; L484-A487 HydrophobicContact CD2-CB 4.38Å; L484-A487 VanDerWaalsContact O-CB 3.28Å; L484-A487 WeakPolarHBondContact O-CB 3.48Å; L484-A487 PolarHBondContact O-N 3.12Å
485	G	55.7	Low	62.7	Low	20 Å²	20	50.9 Å²	50.9	21%	0.206	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-65.5	2.6	177.8	0	0	0	0	0	115.3	F378 D483	F378-G485 WeakPolarHBondContact CE2-O 3.39Å; D483-G485 PolarHBondContact O-N 2.84Å
486	L	53.2	Low	61.6	Low	106 Å²	106	53.3 Å²	53.3	56%	0.555	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-131.7	30.3	166.5	-64.5	174.7	0	0	0	111.7	R463 L484	R463-L486 PolarHBondContact NH2-O 2.91Å; L484-L486 PolarHBondContact O-N 2.83Å
487	A	54.7	Low	60.3	Low	9 Å²	9	51.6 Å²	51.6	7%	0.074	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-86.6	130.2	170.5	0	0	0	0	0	110.5	V460 I461 L484	V460-A487 HydrophobicContact CG1-CB 4.24Å; I461-A487 WeakPolarHBondContact O-CB 3.47Å; L484-A487 HydrophobicContact CD2-CB 4.38Å; L484-A487 VanDerWaalsContact O-CB 3.28Å; L484-A487 WeakPolarHBondContact O-CB 3.48Å; L484-A487 PolarHBondContact O-N 3.12Å
488	T	47.1	Very low	58.4	Low	6 Å²	6	56.7 Å²	56.7	4%	0.037	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-95.8	154.3	177.3	48.6	0	0	0	0	113.1	E381 R463 A495 Y514	E381-T488 WeakPolarHBondContact OE1-CA 3.38Å; E381-T488 WeakPolarHBondContact OE1-CB 3.47Å; R463-T488 WeakPolarHBondContact CD-OG1 3.22Å; R463-T488 VanDerWaalsContact CZ-CG2 3.47Å; R463-T488 VanDerWaalsContact CZ-OG1 3.26Å; R463-T488 PolarHBondContact NE-OG1 3.38Å; R463-T488 PolarHBondContact NH1-OG1 3.16Å; T488-A495 HydrophobicContact CG2-CB 4.17Å; T488-Y514 PolarHBondContact OG1-OH 3.21Å
489	L	41.8	Very low	56.4	Low	19 Å²	19	60.2 Å²	60.2	10%	0.099	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-65.4	133.3	162	-72.9	-170.6	0	0	0	113.1	E381 M384 P458 N491 S493	E381-L489 HydrophobicContact CG-CG 4.09Å; E381-L489 PolarHBondContact OE1-N 2.83Å; M384-L489 HydrophobicContact CE-CD1 3.78Å; M384-L489 HydrophobicContact CE-CD2 3.34Å; M384-L489 HydrophobicContact CE-CG 3.64Å; M384-L489 HydrophobicContact SD-CD1 4.19Å; M384-L489 HydrophobicContact SD-CD2 3.92Å; M384-L489 HydrophobicContact SD-CG 4.48Å; P458-L489 HydrophobicContact CB-CD2 4.33Å; P458-L489 HydrophobicContact CG-CD1 4.14Å; P458-L489 HydrophobicContact CG-CD2 3.4Å; P458-L489 VanDerWaalsContact CG-CD2 3.4Å; P458-L489 HydrophobicContact CG-CG 4.34Å; L489-N491 PolarHBondContact O-N 3.31Å; L489-N491 VanDerWaalsContact O-N 3.1Å; L489-S493 PolarHBondContact O-OG 3.15Å
490	K	43.5	Very low	54.1	Low	82 Å²	82	61.7 Å²	61.7	36%	0.357	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-28	176.3	-170.9	176.6	-173.1	176.5	0	114.4	I461 E516	I461-K490 HydrophobicContact CD1-CB 3.94Å; I461-K490 HydrophobicContact CD1-CD 4.19Å; I461-K490 HydrophobicContact CD1-CG 3.91Å; K490-E516 WeakPolarHBondContact CD-OE1 3.39Å; K490-E516 IonicContact NZ-OE1 3.84Å; K490-E516 PolarHBondContact NZ-OE1 3.12Å; K490-E516 IonicContact NZ-OE2 3.72Å; K490-E516 PolarHBondContact NZ-OE2 3.36Å
491	N	39.7	Very low	51.7	Low	125 Å²	125	62.5 Å²	62.5	67%	0.668	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	0.5	-164.6	-68.7	35.7	0	0	0	116.1	L489	L489-N491 PolarHBondContact O-N 3.31Å; L489-N491 VanDerWaalsContact O-N 3.1Å
492	K	39.9	Very low	49.6	Very low	135 Å²	135	63.7 Å²	63.7	59%	0.587	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.8	-5.6	-172.5	-71.7	-170.5	176.8	-179.1	0	117.1	R377	R377-K492 VanDerWaalsContact CZ-O 3.28Å; R377-K492 PolarHBondContact NE-O 3.27Å; R377-K492 PolarHBondContact NH2-O 2.84Å
493	S	36.7	Very low	47.8	Very low	16 Å²	16	65.2 Å²	65.2	11%	0.112	35%	0.349	C	S	.	.			trans	-122.2	73.2	-164.1	-19.4	0	0	0	0	114.6	E381 L489 A495	E381-S493 PolarHBondContact OE1-OG 3.16Å; L489-S493 PolarHBondContact O-OG 3.15Å; S493-A495 VanDerWaalsContact C-N 3.26Å; S493-A495 WeakPolarHBondContact O-CB 3.38Å; S493-A495 PolarHBondContact O-N 2.78Å
494	F	33.2	Very low	46.7	Very low	156 Å²	156	62.8 Å²	62.8	68%	0.684	34%	0.335	S	S	*	.			trans	-56.6	92.7	152.8	-103	-82.2	0	0	0	108.2	R377 E512	R377-F494 PolarHBondContact NH1-O 2.8Å; F494-E512 VanDerWaalsContact CD1-OE2 3.29Å; F494-E512 WeakPolarHBondContact CD1-OE2 3.24Å; F494-E512 HydrophobicContact CE1-CB 4.49Å; F494-E512 WeakPolarHBondContact CE1-OE2 3.47Å
495	A	38.9	Very low	46.1	Very low	27 Å²	27	62.2 Å²	62.2	22%	0.223	33%	0.333	C	S	.	.			trans	-121.1	99.6	-166.8	0	0	0	0	0	110.1	T488 S493 S497	T488-A495 HydrophobicContact CG2-CB 4.17Å; S493-A495 VanDerWaalsContact C-N 3.26Å; S493-A495 WeakPolarHBondContact O-CB 3.38Å; S493-A495 PolarHBondContact O-N 2.78Å; A495-S497 PolarHBondContact O-N 3.39Å
496	K	40.4	Very low	45.9	Very low	186 Å²	186	61.3 Å²	61.3	81%	0.809	32%	0.323	S	S	*	.			trans	-76.5	32.8	-175	-153.5	167.8	-171.6	164.9	0	112.9
497	S	38.8	Very low	46.2	Very low	53 Å²	53	57 Å²	57	37%	0.371	30%	0.301	S	S	.	.			trans	-84.7	146.3	-166.7	-58.2	0	0	0	0	111.3	A495 I499	A495-S497 PolarHBondContact O-N 3.39Å; S497-I499 WeakPolarHBondContact O-CG1 3.35Å; S497-I499 PolarHBondContact O-N 2.82Å
498	V	39.4	Very low	46.5	Very low	112 Å²	112	57.2 Å²	57.2	68%	0.679	30%	0.301	S	S	*	.			trans	-52.3	113.2	-173	177.7	0	0	0	0	111.4	F345	F345-V498 HydrophobicContact CE2-CB 3.93Å; F345-V498 HydrophobicContact CE2-CG1 4.08Å; F345-V498 HydrophobicContact CE2-CG2 4.41Å; F345-V498 HydrophobicContact CZ-CB 3.86Å; F345-V498 HydrophobicContact CZ-CG1 4.07Å; F345-V498 HydrophobicContact CZ-CG2 3.83Å
499	I	50.1	Low	46.7	Very low	105 Å²	105	58 Å²	58	54%	0.538	30%	0.304	S	S	.	.			trans	-67.7	152.7	-165.2	-68.3	175.3	0	0	0	111.9	S497 M505	S497-I499 WeakPolarHBondContact O-CG1 3.35Å; S497-I499 PolarHBondContact O-N 2.82Å; I499-M505 HydrophobicContact CG2-CE 3.28Å; I499-M505 HydrophobicContact CG2-SD 3.4Å; I499-M505 WeakPolarHBondContact CG2-SD 3.42Å
500	G	47.2	Very low	47	Very low	32 Å²	32	60.7 Å²	60.7	33%	0.33	31%	0.314	S	S	.	.			trans	-69	-170.7	-167.5	0	0	0	0	0	116.6	P502	G500-P502 VanDerWaalsContact O-CD 3.3Å; G500-P502 WeakPolarHBondContact O-CD 3.35Å
501	T	45.5	Very low	47.5	Very low	40 Å²	40	63.4 Å²	63.4	25%	0.245	33%	0.327	C	S	.	.			trans	-67.4	108.3	-179.4	-62.1	0	0	0	0	110.1	K466 E503 F504 Y535	K466-T501 PolarHBondContact NZ-OG1 3.32Å; T501-E503 WeakPolarHBondContact CG2-OE2 3.44Å; T501-E503 PolarHBondContact O-N 2.84Å; T501-F504 HydrophobicContact CG2-CD2 3.78Å; T501-F504 HydrophobicContact CG2-CE2 4.19Å; T501-F504 PolarHBondContact O-N 2.73Å; T501-F504 VanDerWaalsContact O-N 3.08Å; T501-Y535 VanDerWaalsContact CG2-OH 3.29Å; T501-Y535 WeakPolarHBondContact CG2-OH 3.49Å
502	P	51.3	Low	48	Very low	27 Å²	27	62.4 Å²	62.4	18%	0.175	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.6	-159.8	23.8	-33.3	0	0	0	114.8	G500 M505 P543	G500-P502 VanDerWaalsContact O-CD 3.3Å; G500-P502 WeakPolarHBondContact O-CD 3.35Å; P502-M505 HydrophobicContact CB-SD 4.44Å; P502-P543 HydrophobicContact CB-CB 3.95Å; P502-P543 HydrophobicContact CG-CB 3.67Å; P502-P543 HydrophobicContact CG-CG 3.68Å
503	E	54	Low	48.7	Very low	34 Å²	34	62.4 Å²	62.4	16%	0.159	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-25.2	178.9	-56.5	84.4	-176.4	0	0	113.4	T501 Y535 I546	T501-E503 WeakPolarHBondContact CG2-OE2 3.44Å; T501-E503 PolarHBondContact O-N 2.84Å; E503-Y535 HydrophobicContact CB-CE1 3.97Å; E503-Y535 HydrophobicContact CG-CE1 3.76Å; E503-Y535 PolarHBondContact OE2-OH 3.03Å; E503-I546 HydrophobicContact CG-CD1 3.55Å
504	F	57.3	Low	49.9	Very low	14 Å²	14	63.3 Å²	63.3	6%	0.061	32%	0.324	C	S	.	.	S	Bend	trans	-97.2	-1.3	176.2	-65.1	-79.4	0	0	0	113.2	K466 T501 M525 E529 Y535	K466-F504 HydrophobicContact CB-CD1 4.17Å; K466-F504 HydrophobicContact CB-CD2 3.72Å; K466-F504 HydrophobicContact CB-CE1 4.13Å; K466-F504 HydrophobicContact CB-CE2 3.63Å; K466-F504 HydrophobicContact CB-CG 3.99Å; K466-F504 HydrophobicContact CB-CZ 3.87Å; K466-F504 HydrophobicContact CD-CD2 4.26Å; K466-F504 HydrophobicContact CD-CE2 4.38Å; T501-F504 HydrophobicContact CG2-CD2 3.78Å; T501-F504 HydrophobicContact CG2-CE2 4.19Å; T501-F504 PolarHBondContact O-N 2.73Å; T501-F504 VanDerWaalsContact O-N 3.08Å; F504-M525 HydrophobicContact CD1-CB 3.69Å; F504-M525 HydrophobicContact CE1-CB 4.08Å; F504-E529 WeakPolarHBondContact CZ-OE2 3.45Å; F504-Y535 AromaticContact CE2-CE2 3.53Å; F504-Y535 HydrophobicContact CE2-CE2 3.53Å; F504-Y535 AromaticContact CE2-CZ 3.81Å; F504-Y535 WeakPolarHBondContact CE2-OH 3.32Å; F504-Y535 HydrophobicContact CZ-CD2 4.38Å; F504-Y535 AromaticContact CZ-CE2 3.66Å; F504-Y535 HydrophobicContact CZ-CE2 3.66Å
505	M	59.2	Low	52.1	Low	3 Å²	3	57.5 Å²	57.5	2%	0.015	30%	0.3	C	S	.	.			trans	-79.3	130.6	-174.8	-66.7	-171.5	59.3	0	0	112.8	I499 P502 M509 Y510 Y521	I499-M505 HydrophobicContact CG2-CE 3.28Å; I499-M505 HydrophobicContact CG2-SD 3.4Å; I499-M505 WeakPolarHBondContact CG2-SD 3.42Å; P502-M505 HydrophobicContact CB-SD 4.44Å; M505-M509 HydrophobicContact CB-CE 4.01Å; M505-M509 HydrophobicContact CE-CB 3.88Å; M505-M509 HydrophobicContact CE-CE 3.79Å; M505-M509 HydrophobicContact CE-CG 3.97Å; M505-M509 HydrophobicContact CG-CE 3.53Å; M505-M509 HydrophobicContact SD-CE 4.25Å; M505-Y510 HydrophobicContact CB-CE2 3.95Å; M505-Y510 HydrophobicContact CE-CD1 4.17Å; M505-Y510 HydrophobicContact CE-CD2 3.74Å; M505-Y510 HydrophobicContact CE-CE1 3.88Å; M505-Y510 HydrophobicContact CE-CE2 3.41Å; M505-Y510 VanDerWaalsContact CE-CE2 3.41Å; M505-Y510 HydrophobicContact CE-CG 4.12Å; M505-Y510 VanDerWaalsContact CE-CZ 3.49Å; M505-Y510 HydrophobicContact SD-CE1 4.23Å; M505-Y510 HydrophobicContact SD-CE2 3.96Å; M505-Y510 PolarHBondContact SD-OH 2.69Å; M505-Y521 WeakPolarHBondContact O-CE1 3.19Å
506	A	52.9	Low	54.4	Low	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.299	C	S	.	.			trans	-67.8	149	163.4	0	0	0	0	0	110.8	E508 M509 V518 Y521	A506-E508 VanDerWaalsContact C-N 3.32Å; A506-E508 VanDerWaalsContact CB-OE1 3.26Å; A506-E508 WeakPolarHBondContact CB-OE1 3.28Å; A506-E508 WeakPolarHBondContact CB-OE2 3.27Å; A506-E508 PolarHBondContact O-N 3.1Å; A506-M509 WeakPolarHBondContact O-CB 3.41Å; A506-M509 PolarHBondContact O-N 3.31Å; A506-M509 VanDerWaalsContact O-N 3.12Å; A506-V518 HydrophobicContact CB-CB 4.32Å; A506-V518 HydrophobicContact CB-CG1 4.07Å; A506-Y521 HydrophobicContact CB-CD1 3.92Å; A506-Y521 HydrophobicContact CB-CD2 4.3Å; A506-Y521 HydrophobicContact CB-CG 3.79Å
507	P	58.1	Low	56.8	Low	15 Å²	15	50.1 Å²	50.1	10%	0.097	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-59.3	-37.4	-175.3	20.6	-30.7	0	0	0	113.7	M509 Y510 V550 I551 V579	P507-M509 VanDerWaalsContact C-N 3.27Å; P507-M509 PolarHBondContact O-N 2.85Å; P507-Y510 WeakPolarHBondContact O-CD2 3.36Å; P507-Y510 PolarHBondContact O-N 3.2Å; P507-V550 HydrophobicContact CB-CG1 4.04Å; P507-V550 HydrophobicContact CG-CG1 4.17Å; P507-I551 HydrophobicContact CB-CG1 3.82Å; P507-V579 HydrophobicContact CG-CG1 4.18Å; P507-V579 WeakPolarHBondContact CG-O 3.43Å
508	E	62.2	Low	59.2	Low	15 Å²	15	47.7 Å²	47.7	7%	0.07	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-73.8	-12.6	179.7	73.6	-73.5	176.1	0	0	114	A506 Y510 E511 V518 R584	A506-E508 VanDerWaalsContact C-N 3.32Å; A506-E508 VanDerWaalsContact CB-OE1 3.26Å; A506-E508 WeakPolarHBondContact CB-OE1 3.28Å; A506-E508 WeakPolarHBondContact CB-OE2 3.27Å; A506-E508 PolarHBondContact O-N 3.1Å; E508-Y510 PolarHBondContact O-N 2.63Å; E508-Y510 VanDerWaalsContact O-N 3.12Å; E508-E511 PolarHBondContact O-N 3.32Å; E508-V518 WeakPolarHBondContact OE1-CG1 3.27Å; E508-R584 IonicContact OE1-CZ 3.55Å; E508-R584 IonicContact OE1-NH1 3.83Å; E508-R584 PolarHBondContact OE1-NH1 2.93Å; E508-R584 IonicContact OE1-NH2 3.76Å; E508-R584 PolarHBondContact OE1-NH2 2.87Å; E508-R584 IonicContact OE2-CZ 3.66Å; E508-R584 IonicContact OE2-NH1 2.7Å; E508-R584 IonicContact OE2-NH2 3.96Å; E508-R584 PolarHBondContact OE2-NH2 3.17Å
509	M	50.9	Low	61.7	Low	23 Å²	23	42.4 Å²	42.4	11%	0.113	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-70.4	-5.4	174.2	-163.7	157.6	67.1	0	0	112.5	R463 M505 A506 P507 Y514 V518	R463-M509 HydrophobicContact CB-SD 4.08Å; R463-M509 WeakPolarHBondContact O-CE 3.45Å; M505-M509 HydrophobicContact CB-CE 4.01Å; M505-M509 HydrophobicContact CE-CB 3.88Å; M505-M509 HydrophobicContact CE-CE 3.79Å; M505-M509 HydrophobicContact CE-CG 3.97Å; M505-M509 HydrophobicContact CG-CE 3.53Å; M505-M509 HydrophobicContact SD-CE 4.25Å; A506-M509 WeakPolarHBondContact O-CB 3.41Å; A506-M509 PolarHBondContact O-N 3.31Å; A506-M509 VanDerWaalsContact O-N 3.12Å; P507-M509 VanDerWaalsContact C-N 3.27Å; P507-M509 PolarHBondContact O-N 2.85Å; M509-Y514 HydrophobicContact CG-CD1 4.17Å; M509-V518 HydrophobicContact CB-CG1 4.38Å; M509-V518 HydrophobicContact SD-CB 4.47Å; M509-V518 HydrophobicContact SD-CG2 4.45Å
510	Y	48.6	Very low	63.9	Low	75 Å²	75	37.6 Å²	37.6	29%	0.294	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-90.9	-7.4	167.8	-63.7	-93.9	0	0	0	113.5	M505 P507 E508 Y547	M505-Y510 HydrophobicContact CB-CE2 3.95Å; M505-Y510 HydrophobicContact CE-CD1 4.17Å; M505-Y510 HydrophobicContact CE-CD2 3.74Å; M505-Y510 HydrophobicContact CE-CE1 3.88Å; M505-Y510 HydrophobicContact CE-CE2 3.41Å; M505-Y510 VanDerWaalsContact CE-CE2 3.41Å; M505-Y510 HydrophobicContact CE-CG 4.12Å; M505-Y510 VanDerWaalsContact CE-CZ 3.49Å; M505-Y510 HydrophobicContact SD-CE1 4.23Å; M505-Y510 HydrophobicContact SD-CE2 3.96Å; M505-Y510 PolarHBondContact SD-OH 2.69Å; P507-Y510 WeakPolarHBondContact O-CD2 3.36Å; P507-Y510 PolarHBondContact O-N 3.2Å; E508-Y510 PolarHBondContact O-N 2.63Å; E508-Y510 VanDerWaalsContact O-N 3.12Å; Y510-Y547 AromaticContact CD1-CD2 3.96Å; Y510-Y547 HydrophobicContact CD1-CD2 3.96Å; Y510-Y547 AromaticContact CD1-CE2 3.72Å; Y510-Y547 HydrophobicContact CD1-CE2 3.72Å; Y510-Y547 AromaticContact CD2-CD2 3.84Å; Y510-Y547 HydrophobicContact CD2-CD2 3.84Å; Y510-Y547 AromaticContact CD2-CE2 3.72Å; Y510-Y547 HydrophobicContact CD2-CE2 3.72Å; Y510-Y547 AromaticContact CE1-CD2 3.77Å; Y510-Y547 HydrophobicContact CE1-CD2 3.77Å; Y510-Y547 HydrophobicContact CE1-CE2 4.03Å; Y510-Y547 AromaticContact CE2-CD2 3.65Å; Y510-Y547 HydrophobicContact CE2-CD2 3.65Å; Y510-Y547 HydrophobicContact CE2-CE2 4.04Å; Y510-Y547 AromaticContact CG-CD2 3.99Å; Y510-Y547 HydrophobicContact CG-CD2 3.99Å; Y510-Y547 AromaticContact CG-CE2 3.54Å; Y510-Y547 HydrophobicContact CG-CE2 3.54Å; Y510-Y547 AromaticContact CZ-CD2 3.6Å
511	E	52.4	Low	66.1	Low	138 Å²	138	36.3 Å²	36.3	65%	0.645	18%	0.177	S	C	*	.	S	Bend	trans	-102.1	10.3	-176.8	-57.4	-168.5	148.9	0	0	113.5	E508 M513	E508-E511 PolarHBondContact O-N 3.32Å; E511-M513 PolarHBondContact O-N 2.77Å
512	E	51.1	Low	68.4	Low	104 Å²	104	34.5 Å²	34.5	49%	0.486	17%	0.166	S	C	.	.	S	Bend	trans	59.2	-6.4	-178.2	-58.5	-172.3	175.8	0	0	116	F494	F494-E512 VanDerWaalsContact CD1-OE2 3.29Å; F494-E512 WeakPolarHBondContact CD1-OE2 3.24Å; F494-E512 HydrophobicContact CE1-CB 4.49Å; F494-E512 WeakPolarHBondContact CE1-OE2 3.47Å
513	M	53.7	Low	70.6	Confident	135 Å²	135	33.2 Å²	33.2	67%	0.665	16%	0.158	S	C	*	.			trans	-111.8	65.5	-179.1	-63.4	-168.1	-63.1	0	0	114	E511 R581	E511-M513 PolarHBondContact O-N 2.77Å; M513-R581 PolarHBondContact O-NH1 3.07Å
514	Y	62.2	Low	72.7	Confident	35 Å²	35	31.6 Å²	31.6	14%	0.137	15%	0.15	C	C	.	.			trans	-93.5	158.7	178.1	52	-96.1	0	0	0	113.9	I461 R463 T488 M509	I461-Y514 HydrophobicContact CD1-CD2 4.15Å; I461-Y514 HydrophobicContact CD1-CE2 4.43Å; R463-Y514 VanDerWaalsContact CD-CE2 3.42Å; R463-Y514 HydrophobicContact CG-CE2 4.14Å; R463-Y514 PolarHBondContact NH1-OH 3.32Å; T488-Y514 PolarHBondContact OG1-OH 3.21Å; M509-Y514 HydrophobicContact CG-CD1 4.17Å
515	D	79.8	Confident	74.5	Confident	35 Å²	35	31 Å²	31	19%	0.187	15%	0.148	C	C	.	.			trans	-130.5	-163.1	176	61.5	24.8	0	0	0	111.1	S517 V518 R581	D515-S517 PolarHBondContact O-N 3.12Å; D515-S517 VanDerWaalsContact O-N 3.12Å; D515-S517 WeakPolarHBondContact OD1-CB 3.47Å; D515-S517 PolarHBondContact OD1-N 3Å; D515-S517 PolarHBondContact OD1-OG 3.11Å; D515-V518 PolarHBondContact O-N 2.84Å; D515-R581 WeakPolarHBondContact OD2-CD 3.47Å; D515-R581 IonicContact OD2-CZ 2.66Å; D515-R581 IonicContact OD2-NE 3.13Å; D515-R581 IonicContact OD2-NH1 3.07Å
516	E	87.3	Confident	76.3	Confident	43 Å²	43	30.8 Å²	30.8	20%	0.201	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.8	-179.6	-62.8	78.7	-168.5	0	0	113.9	H454 P459 K490 V518 D519	H454-E516 HydrophobicContact CB-CG 3.91Å; H454-E516 PolarHBondContact CE1-O 3.41Å; P459-E516 WeakPolarHBondContact CB-OE1 3.3Å; K490-E516 WeakPolarHBondContact CD-OE1 3.39Å; K490-E516 IonicContact NZ-OE1 3.84Å; K490-E516 PolarHBondContact NZ-OE1 3.12Å; K490-E516 IonicContact NZ-OE2 3.72Å; K490-E516 PolarHBondContact NZ-OE2 3.36Å; E516-V518 VanDerWaalsContact C-N 3.3Å; E516-V518 PolarHBondContact O-N 2.84Å; E516-D519 PolarHBondContact O-N 3.37Å
517	S	90.2	Very high	78.3	Confident	14 Å²	14	30.8 Å²	30.8	10%	0.098	15%	0.147	C	C	.	.	H	α-helix	trans	-73.7	-14.8	-175.5	73.5	0	0	0	0	114.6	D515 D519 V520 Y521 R581 R584	D515-S517 PolarHBondContact O-N 3.12Å; D515-S517 VanDerWaalsContact O-N 3.12Å; D515-S517 WeakPolarHBondContact OD1-CB 3.47Å; D515-S517 PolarHBondContact OD1-N 3Å; D515-S517 PolarHBondContact OD1-OG 3.11Å; S517-D519 VanDerWaalsContact C-N 3.31Å; S517-V520 WeakPolarHBondContact O-CB 3.48Å; S517-V520 PolarHBondContact O-N 3.3Å; S517-Y521 PolarHBondContact O-N 3.03Å; S517-R581 WeakPolarHBondContact OG-CB 3.39Å; S517-R584 PolarHBondContact O-NH1 3.38Å; S517-R584 VanDerWaalsContact O-NH1 3.1Å; S517-R584 PolarHBondContact OG-NH1 2.95Å
518	V	89	Confident	80.1	Confident	3 Å²	3	30.1 Å²	30.1	2%	0.018	14%	0.142	C	C	.	.	H	α-helix	trans	-67.9	-36	172.8	-57.3	0	0	0	0	110.9	I461 A506 E508 M509 D515 E516 V520 Y521 A522	I461-V518 HydrophobicContact CG2-CG2 3.62Å; A506-V518 HydrophobicContact CB-CB 4.32Å; A506-V518 HydrophobicContact CB-CG1 4.07Å; E508-V518 WeakPolarHBondContact OE1-CG1 3.27Å; M509-V518 HydrophobicContact CB-CG1 4.38Å; M509-V518 HydrophobicContact SD-CB 4.47Å; M509-V518 HydrophobicContact SD-CG2 4.45Å; D515-V518 PolarHBondContact O-N 2.84Å; E516-V518 VanDerWaalsContact C-N 3.3Å; E516-V518 PolarHBondContact O-N 2.84Å; V518-V520 VanDerWaalsContact C-N 3.31Å; V518-V520 PolarHBondContact O-N 3.2Å; V518-Y521 PolarHBondContact O-N 2.96Å; V518-A522 WeakPolarHBondContact O-CB 3.46Å; V518-A522 PolarHBondContact O-N 3.34Å
519	D	93	Very high	81.7	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-72.1	-28.6	177.1	-62.5	-21.7	0	0	0	111.1	L450 H454 H462 R463 L465 E516 S517 F523	L450-D519 HydrophobicContact CD1-CB 4.21Å; L450-D519 HydrophobicContact CD2-CB 3.96Å; H454-D519 IonicContact CD2-OD2 2.75Å; H454-D519 IonicContact CE1-OD2 3.07Å; H454-D519 IonicContact NE2-OD2 3.12Å; H454-D519 PolarHBondContact NE2-OD2 2.98Å; H462-D519 WeakPolarHBondContact CB-OD1 3.35Å; H462-D519 PolarHBondContact N-OD1 3.38Å; H462-D519 PolarHBondContact N-OD2 2.83Å; R463-D519 PolarHBondContact N-OD1 3.06Å; L465-D519 WeakPolarHBondContact CD2-O 3.42Å; E516-D519 PolarHBondContact O-N 3.37Å; S517-D519 VanDerWaalsContact C-N 3.31Å; D519-F523 VanDerWaalsContact O-CB 3.24Å; D519-F523 WeakPolarHBondContact O-CB 3.46Å; D519-F523 PolarHBondContact O-N 3.44Å
520	V	95.2	Very high	83.7	Confident	5 Å²	5	29.2 Å²	29.2	3%	0.03	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-48.6	170.9	170.5	0	0	0	0	111	S517 V518 A522 F523 G524 C576 R584 S585 V587 L590	S517-V520 WeakPolarHBondContact O-CB 3.48Å; S517-V520 PolarHBondContact O-N 3.3Å; V518-V520 VanDerWaalsContact C-N 3.31Å; V518-V520 PolarHBondContact O-N 3.2Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 3.01Å; V520-F523 WeakPolarHBondContact O-CB 3.49Å; V520-F523 PolarHBondContact O-N 3.5Å; V520-G524 PolarHBondContact O-N 3.35Å; V520-C576 HydrophobicContact CG1-CB 4.15Å; V520-R584 HydrophobicContact CG1-CB 4.2Å; V520-S585 WeakPolarHBondContact CG1-O 3.29Å; V520-V587 HydrophobicContact CG2-CG2 3.73Å; V520-L590 HydrophobicContact CG1-CD1 4.24Å
521	Y	94.6	Very high	85.8	Confident	4 Å²	4	26.9 Å²	26.9	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-59	-47.2	176.8	179.8	-84.6	0	0	0	111.1	M505 A506 S517 V518 F523 G524 M525 V550 C576 I577	M505-Y521 WeakPolarHBondContact O-CE1 3.19Å; A506-Y521 HydrophobicContact CB-CD1 3.92Å; A506-Y521 HydrophobicContact CB-CD2 4.3Å; A506-Y521 HydrophobicContact CB-CG 3.79Å; S517-Y521 PolarHBondContact O-N 3.03Å; V518-Y521 PolarHBondContact O-N 2.96Å; Y521-F523 PolarHBondContact O-N 3.19Å; Y521-G524 PolarHBondContact O-N 3.14Å; Y521-G524 VanDerWaalsContact O-N 3.13Å; Y521-M525 HydrophobicContact CD1-CG 4.39Å; Y521-M525 HydrophobicContact CE1-CE 3.92Å; Y521-M525 HydrophobicContact CE1-CG 4.05Å; Y521-M525 HydrophobicContact CE2-CE 4.21Å; Y521-M525 PolarHBondContact O-N 2.84Å; Y521-M525 VanDerWaalsContact OH-CE 3.26Å; Y521-M525 WeakPolarHBondContact OH-CE 3.49Å; Y521-V550 WeakPolarHBondContact OH-CG1 3.38Å; Y521-C576 WeakPolarHBondContact CA-O 3.33Å; Y521-I577 HydrophobicContact CD2-CB 4.21Å; Y521-I577 HydrophobicContact CD2-CG2 4.46Å; Y521-I577 HydrophobicContact CE2-CB 4.03Å; Y521-I577 HydrophobicContact CE2-CG2 4.48Å
522	A	94.3	Very high	87.7	Confident	3 Å²	3	21.6 Å²	21.6	3%	0.025	11%	0.109	C	C	.	.	H	α-helix	trans	-63.6	-36.3	176.6	0	0	0	0	0	113	L465 V518 V520 M525 C526	L465-A522 HydrophobicContact CB-CB 3.83Å; L465-A522 HydrophobicContact CD2-CB 4.21Å; L465-A522 HydrophobicContact CG-CB 4.42Å; V518-A522 WeakPolarHBondContact O-CB 3.46Å; V518-A522 PolarHBondContact O-N 3.34Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 3.01Å; A522-M525 PolarHBondContact O-N 3.42Å; A522-C526 PolarHBondContact O-N 3.42Å; A522-C526 PolarHBondContact O-SG 3.01Å
523	F	97.2	Very high	89.6	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.4	-43.4	170.8	166.6	-96.9	0	0	0	111.6	C443 I446 L447 L450 L465 D519 V520 Y521 M525 C526 L527 L590 F596	C443-F523 HydrophobicContact CB-CE2 4.04Å; C443-F523 HydrophobicContact CB-CZ 4.05Å; I446-F523 HydrophobicContact CB-CD2 4.34Å; I446-F523 HydrophobicContact CB-CE2 4.37Å; I446-F523 HydrophobicContact CG2-CD2 3.8Å; I446-F523 HydrophobicContact CG2-CE2 4.33Å; L447-F523 HydrophobicContact CD1-CE1 4.21Å; L447-F523 HydrophobicContact CD1-CE2 4.26Å; L447-F523 HydrophobicContact CD1-CZ 3.71Å; L447-F523 HydrophobicContact CD2-CD1 3.97Å; L447-F523 HydrophobicContact CD2-CD2 4.17Å; L447-F523 HydrophobicContact CD2-CE1 3.81Å; L447-F523 HydrophobicContact CD2-CE2 4Å; L447-F523 HydrophobicContact CD2-CG 4.15Å; L447-F523 HydrophobicContact CD2-CZ 3.82Å; L447-F523 HydrophobicContact CG-CD2 4.32Å; L447-F523 HydrophobicContact CG-CE1 4.17Å; L447-F523 HydrophobicContact CG-CE2 3.75Å; L447-F523 HydrophobicContact CG-CZ 3.66Å; L450-F523 HydrophobicContact CD1-CB 4.21Å; L465-F523 HydrophobicContact CD2-CB 4.13Å; D519-F523 VanDerWaalsContact O-CB 3.24Å; D519-F523 WeakPolarHBondContact O-CB 3.46Å; D519-F523 PolarHBondContact O-N 3.44Å; V520-F523 WeakPolarHBondContact O-CB 3.49Å; V520-F523 PolarHBondContact O-N 3.5Å; Y521-F523 PolarHBondContact O-N 3.19Å; F523-M525 VanDerWaalsContact C-N 3.32Å; F523-M525 PolarHBondContact O-N 2.81Å; F523-C526 WeakPolarHBondContact O-CB 3.3Å; F523-C526 PolarHBondContact O-N 3.33Å; F523-C526 VanDerWaalsContact O-N 3.17Å; F523-L527 HydrophobicContact CE1-CD2 4.48Å; F523-L527 PolarHBondContact O-N 2.91Å; F523-L590 HydrophobicContact CD1-CD1 4.15Å; F523-L590 HydrophobicContact CE1-CD1 4.17Å; F523-F596 HydrophobicContact CZ-CZ 4.06Å
524	G	96.6	Very high	91.3	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.6	-43	174.6	0	0	0	0	0	112.6	V520 Y521 L527 L528	V520-G524 PolarHBondContact O-N 3.35Å; Y521-G524 PolarHBondContact O-N 3.14Å; Y521-G524 VanDerWaalsContact O-N 3.13Å; G524-L527 PolarHBondContact O-N 3.48Å; G524-L528 WeakPolarHBondContact O-CB 3.12Å; G524-L528 PolarHBondContact O-N 3.5Å
525	M	95.4	Very high	92.6	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-68.7	-35.3	175	-68.6	-59.1	-177.5	0	0	113.2	F504 Y521 A522 F523 L528 E529 P536 Y537 P556 I577	F504-M525 HydrophobicContact CD1-CB 3.69Å; F504-M525 HydrophobicContact CE1-CB 4.08Å; Y521-M525 HydrophobicContact CD1-CG 4.39Å; Y521-M525 HydrophobicContact CE1-CE 3.92Å; Y521-M525 HydrophobicContact CE1-CG 4.05Å; Y521-M525 HydrophobicContact CE2-CE 4.21Å; Y521-M525 PolarHBondContact O-N 2.84Å; Y521-M525 VanDerWaalsContact OH-CE 3.26Å; Y521-M525 WeakPolarHBondContact OH-CE 3.49Å; A522-M525 PolarHBondContact O-N 3.42Å; F523-M525 VanDerWaalsContact C-N 3.32Å; F523-M525 PolarHBondContact O-N 2.81Å; M525-L528 PolarHBondContact O-N 3.23Å; M525-L528 HydrophobicContact SD-CD2 4.13Å; M525-E529 PolarHBondContact O-N 3.1Å; M525-P536 HydrophobicContact CB-CG 4.33Å; M525-P536 HydrophobicContact SD-CB 3.91Å; M525-P536 HydrophobicContact SD-CG 4.22Å; M525-Y537 HydrophobicContact CE-CE2 3.82Å; M525-P556 HydrophobicContact CE-CG 3.97Å; M525-P556 HydrophobicContact SD-CG 4.04Å; M525-I577 HydrophobicContact CE-CB 4.22Å; M525-I577 HydrophobicContact CE-CD1 4.38Å; M525-I577 HydrophobicContact CE-CG2 3.91Å; M525-I577 HydrophobicContact CG-CG2 4.3Å; M525-I577 HydrophobicContact SD-CG2 4.15Å
526	C	96.7	Very high	93.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-66	-40	172.4	-67.3	0	0	0	0	112	K466 A522 F523 E529 M530	K466-C526 WeakPolarHBondContact CA-SG 3.17Å; A522-C526 PolarHBondContact O-N 3.42Å; A522-C526 PolarHBondContact O-SG 3.01Å; F523-C526 WeakPolarHBondContact O-CB 3.3Å; F523-C526 PolarHBondContact O-N 3.33Å; F523-C526 VanDerWaalsContact O-N 3.17Å; C526-E529 PolarHBondContact O-N 2.93Å; C526-M530 WeakPolarHBondContact O-CB 3.33Å; C526-M530 WeakPolarHBondContact O-CG 3.25Å; C526-M530 PolarHBondContact O-N 3.45Å
527	L	96.3	Very high	93.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-64.1	-41.8	174.3	176.4	56.7	0	0	0	110.9	L439 F523 G524 M530 V531 I569 I572 I573	L439-L527 HydrophobicContact CD1-CD1 4.11Å; L439-L527 HydrophobicContact CD2-CD1 4.29Å; L439-L527 HydrophobicContact CG-CD1 4.34Å; F523-L527 HydrophobicContact CE1-CD2 4.48Å; F523-L527 PolarHBondContact O-N 2.91Å; G524-L527 PolarHBondContact O-N 3.48Å; L527-M530 PolarHBondContact O-N 3.33Å; L527-V531 HydrophobicContact CD1-CG2 3.8Å; L527-V531 HydrophobicContact CG-CG2 4.43Å; L527-V531 WeakPolarHBondContact O-CB 3.36Å; L527-V531 WeakPolarHBondContact O-CG2 3.41Å; L527-V531 PolarHBondContact O-N 3.03Å; L527-I569 HydrophobicContact CD1-CG2 4.41Å; L527-I569 HydrophobicContact CG-CG2 4.47Å; L527-I572 HydrophobicContact CD2-CB 4.46Å; L527-I572 HydrophobicContact CD2-CG2 3.71Å; L527-I573 HydrophobicContact CB-CG1 4.17Å; L527-I573 HydrophobicContact CD2-CD1 4.45Å; L527-I573 HydrophobicContact CD2-CG1 3.68Å; L527-I573 HydrophobicContact CG-CD1 4Å; L527-I573 HydrophobicContact CG-CG1 3.67Å
528	L	95.5	Very high	93.5	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.8	-47.5	174.2	-178.3	61.2	0	0	0	112.5	G524 M525 M530 V531 T532 P536 P556 I562 I573	G524-L528 WeakPolarHBondContact O-CB 3.12Å; G524-L528 PolarHBondContact O-N 3.5Å; M525-L528 PolarHBondContact O-N 3.23Å; M525-L528 HydrophobicContact SD-CD2 4.13Å; L528-M530 VanDerWaalsContact C-N 3.33Å; L528-M530 PolarHBondContact O-N 3.01Å; L528-V531 PolarHBondContact O-N 3.01Å; L528-T532 HydrophobicContact CD1-CG2 3.8Å; L528-T532 WeakPolarHBondContact O-CB 3.35Å; L528-T532 WeakPolarHBondContact O-CG2 3.44Å; L528-T532 PolarHBondContact O-N 2.94Å; L528-T532 PolarHBondContact O-OG1 2.88Å; L528-P536 HydrophobicContact CD2-CB 4.49Å; L528-P536 HydrophobicContact CD2-CG 4.4Å; L528-P556 HydrophobicContact CD2-CB 4.04Å; L528-P556 HydrophobicContact CD2-CG 3.79Å; L528-I562 HydrophobicContact CD1-CD1 3.97Å; L528-I562 HydrophobicContact CD1-CG1 3.93Å; L528-I573 HydrophobicContact CB-CD1 4.12Å; L528-I573 HydrophobicContact CB-CG2 4.29Å; L528-I573 HydrophobicContact CD1-CD1 4.18Å
529	E	94.9	Very high	93.6	Very high	14 Å²	14	19.2 Å²	19.2	7%	0.065	11%	0.11	C	C	.	.	H	α-helix	trans	-60.5	-41.4	175	-164.6	-171.8	169	0	0	111.3	L428 C467 F504 M525 C526 V531 G533 P536	L428-E529 HydrophobicContact CD1-CG 4.03Å; C467-E529 VanDerWaalsContact CB-OE2 3.22Å; C467-E529 WeakPolarHBondContact CB-OE2 3.09Å; C467-E529 PolarHBondContact SG-OE2 2.81Å; F504-E529 WeakPolarHBondContact CZ-OE2 3.45Å; M525-E529 PolarHBondContact O-N 3.1Å; C526-E529 PolarHBondContact O-N 2.93Å; E529-V531 PolarHBondContact O-N 3.28Å; E529-G533 VanDerWaalsContact O-CA 3.31Å; E529-G533 WeakPolarHBondContact O-CA 3.46Å; E529-G533 PolarHBondContact O-N 3.07Å; E529-P536 HydrophobicContact CB-CG 4.43Å
530	M	93.7	Very high	93.4	Very high	5 Å²	5	20 Å²	20	3%	0.025	12%	0.115	C	C	.	.	H	α-helix	trans	-67.6	-31.2	178.8	-82	-168.5	-69.2	0	0	114.6	L424 L428 I434 L439 W442 C443 I446 C526 L527 L528	L424-M530 HydrophobicContact CD1-CE 4.5Å; L424-M530 HydrophobicContact CD1-SD 3.8Å; L424-M530 HydrophobicContact CD2-SD 4.41Å; L428-M530 HydrophobicContact CD1-CG 4.08Å; I434-M530 HydrophobicContact CD1-CB 3.91Å; I434-M530 HydrophobicContact CD1-CG 3.83Å; I434-M530 HydrophobicContact CD1-SD 4.22Å; L439-M530 HydrophobicContact CD1-CB 3.6Å; L439-M530 HydrophobicContact CD1-CE 4.17Å; L439-M530 HydrophobicContact CD1-CG 4.35Å; L439-M530 HydrophobicContact CD1-SD 3.94Å; W442-M530 HydrophobicContact CE3-SD 4.34Å; C443-M530 VanDerWaalsContact SG-CE 3.52Å; I446-M530 HydrophobicContact CD1-CE 4.25Å; C526-M530 WeakPolarHBondContact O-CB 3.33Å; C526-M530 WeakPolarHBondContact O-CG 3.25Å; C526-M530 PolarHBondContact O-N 3.45Å; L527-M530 PolarHBondContact O-N 3.33Å; L528-M530 VanDerWaalsContact C-N 3.33Å; L528-M530 PolarHBondContact O-N 3.01Å
531	V	93.5	Very high	92.9	Very high	27 Å²	27	29 Å²	29	16%	0.164	16%	0.159	C	C	.	.	H	α-helix	trans	-86	-40.7	-176.8	169	0	0	0	0	111.7	L439 L527 L528 E529 I562 I569	L439-V531 HydrophobicContact CD1-CG2 4.46Å; L439-V531 HydrophobicContact CD2-CG2 3.65Å; L527-V531 HydrophobicContact CD1-CG2 3.8Å; L527-V531 HydrophobicContact CG-CG2 4.43Å; L527-V531 WeakPolarHBondContact O-CB 3.36Å; L527-V531 WeakPolarHBondContact O-CG2 3.41Å; L527-V531 PolarHBondContact O-N 3.03Å; L528-V531 PolarHBondContact O-N 3.01Å; E529-V531 PolarHBondContact O-N 3.28Å; V531-I562 HydrophobicContact CG1-CG2 4.21Å; V531-I569 HydrophobicContact CB-CG2 4.49Å; V531-I569 HydrophobicContact CG1-CG2 4.23Å; V531-I569 HydrophobicContact CG2-CD1 4.35Å; V531-I569 HydrophobicContact CG2-CG2 3.65Å
532	T	91.4	Very high	92.1	Very high	27 Å²	27	32.1 Å²	32.1	17%	0.166	18%	0.176	C	C	.	.	H	α-helix	trans	-86.5	-30.6	-178.1	59.6	0	0	0	0	112.5	L528 E534 C558	L528-T532 HydrophobicContact CD1-CG2 3.8Å; L528-T532 WeakPolarHBondContact O-CB 3.35Å; L528-T532 WeakPolarHBondContact O-CG2 3.44Å; L528-T532 PolarHBondContact O-N 2.94Å; L528-T532 PolarHBondContact O-OG1 2.88Å; T532-E534 PolarHBondContact O-N 3.25Å; T532-E534 PolarHBondContact OG1-N 3.24Å; T532-E534 VanDerWaalsContact OG1-N 3.1Å; T532-E534 PolarHBondContact OG1-O 3.18Å; T532-C558 HydrophobicContact CG2-CB 4.08Å; T532-C558 WeakPolarHBondContact CG2-O 3.48Å
533	G	90.2	Very high	91.2	Very high	36 Å²	36	35.1 Å²	35.1	37%	0.371	20%	0.195	S	C	.	.	S	Bend	trans	71.8	9.8	-165.8	0	0	0	0	0	113.4	E529	E529-G533 VanDerWaalsContact O-CA 3.31Å; E529-G533 WeakPolarHBondContact O-CA 3.46Å; E529-G533 PolarHBondContact O-N 3.07Å
534	E	90.6	Very high	90.2	Very high	67 Å²	67	37.6 Å²	37.6	31%	0.313	22%	0.215	S	C	.	.	S	Bend	trans	-116.2	142.8	-177.8	-60.9	-172.9	145.1	0	0	110.4	T532 C558 R561	T532-E534 PolarHBondContact O-N 3.25Å; T532-E534 PolarHBondContact OG1-N 3.24Å; T532-E534 VanDerWaalsContact OG1-N 3.1Å; T532-E534 PolarHBondContact OG1-O 3.18Å; E534-C558 HydrophobicContact CB-CB 4.24Å; E534-R561 IonicContact OE1-NH1 2.74Å; E534-R561 PolarHBondContact OE1-NH1 3.5Å; E534-R561 VanDerWaalsContact OE2-CD 3.23Å; E534-R561 WeakPolarHBondContact OE2-CD 3.44Å; E534-R561 IonicContact OE2-CZ 2.72Å; E534-R561 IonicContact OE2-NE 2.79Å; E534-R561 IonicContact OE2-NH1 3.9Å; E534-R561 PolarHBondContact OE2-NH1 2.88Å
535	Y	89.7	Confident	89.7	Confident	72 Å²	72	39.3 Å²	39.3	28%	0.282	23%	0.226	S	C	.	.			trans	-73.4	129.5	-179.5	-168.5	-110.3	0	0	0	110.4	T501 E503 F504 S538	T501-Y535 VanDerWaalsContact CG2-OH 3.29Å; T501-Y535 WeakPolarHBondContact CG2-OH 3.49Å; E503-Y535 HydrophobicContact CB-CE1 3.97Å; E503-Y535 HydrophobicContact CG-CE1 3.76Å; E503-Y535 PolarHBondContact OE2-OH 3.03Å; F504-Y535 AromaticContact CE2-CE2 3.53Å; F504-Y535 HydrophobicContact CE2-CE2 3.53Å; F504-Y535 AromaticContact CE2-CZ 3.81Å; F504-Y535 WeakPolarHBondContact CE2-OH 3.32Å; F504-Y535 HydrophobicContact CZ-CD2 4.38Å; F504-Y535 AromaticContact CZ-CE2 3.66Å; F504-Y535 HydrophobicContact CZ-CE2 3.66Å; Y535-S538 WeakPolarHBondContact O-CB 3.32Å; Y535-S538 PolarHBondContact O-N 3.28Å; Y535-S538 PolarHBondContact O-OG 2.86Å
536	P	92.5	Very high	89.3	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	140.7	178.2	-27.1	35.6	0	0	0	112.5	M525 L528 E529 S538 P556	M525-P536 HydrophobicContact CB-CG 4.33Å; M525-P536 HydrophobicContact SD-CB 3.91Å; M525-P536 HydrophobicContact SD-CG 4.22Å; L528-P536 HydrophobicContact CD2-CB 4.49Å; L528-P536 HydrophobicContact CD2-CG 4.4Å; E529-P536 HydrophobicContact CB-CG 4.43Å; P536-S538 PolarHBondContact O-N 3.14Å; P536-S538 VanDerWaalsContact O-N 3.16Å; P536-P556 HydrophobicContact CB-CG 4.24Å
537	Y	92.7	Very high	88.4	Confident	7 Å²	7	44 Å²	44	3%	0.027	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	22.5	-177.1	-63.8	-66.2	0	0	0	115.5	M525 E539 C540 I546 K549 V550 V554 P556	M525-Y537 HydrophobicContact CE-CE2 3.82Å; Y537-E539 VanDerWaalsContact CA-OE2 3.23Å; Y537-E539 WeakPolarHBondContact CA-OE2 3.22Å; Y537-E539 PolarHBondContact O-N 3.48Å; Y537-E539 VanDerWaalsContact O-N 3.1Å; Y537-C540 VanDerWaalsContact O-CB 3.27Å; Y537-C540 WeakPolarHBondContact O-CB 3.29Å; Y537-C540 PolarHBondContact O-N 2.88Å; Y537-I546 HydrophobicContact CD2-CG2 3.63Å; Y537-I546 HydrophobicContact CE2-CG2 4.21Å; Y537-I546 HydrophobicContact CG-CG2 3.8Å; Y537-K549 HydrophobicContact CD1-CD 3.89Å; Y537-K549 HydrophobicContact CE1-CB 3.96Å; Y537-K549 HydrophobicContact CE1-CD 3.81Å; Y537-V550 HydrophobicContact CD2-CG2 4.41Å; Y537-V550 HydrophobicContact CE2-CG2 3.51Å; Y537-V554 VanDerWaalsContact CE1-O 3.32Å; Y537-V554 WeakPolarHBondContact CE1-O 3.41Å; Y537-V554 PolarHBondContact OH-O 3.17Å; Y537-P556 HydrophobicContact CD1-CB 4.14Å; Y537-P556 HydrophobicContact CD1-CG 4.12Å; Y537-P556 HydrophobicContact CD2-CG 3.96Å; Y537-P556 HydrophobicContact CE1-CB 4.2Å; Y537-P556 HydrophobicContact CE1-CG 3.86Å; Y537-P556 HydrophobicContact CE2-CG 3.7Å; Y537-P556 HydrophobicContact CG-CB 4.36Å; Y537-P556 HydrophobicContact CG-CG 4.17Å
538	S	91	Very high	87.9	Confident	77 Å²	77	50.9 Å²	50.9	54%	0.538	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.8	178	46.1	0	0	0	0	114.8	Y535 P536 C540	Y535-S538 WeakPolarHBondContact O-CB 3.32Å; Y535-S538 PolarHBondContact O-N 3.28Å; Y535-S538 PolarHBondContact O-OG 2.86Å; P536-S538 PolarHBondContact O-N 3.14Å; P536-S538 VanDerWaalsContact O-N 3.16Å; S538-C540 PolarHBondContact O-N 2.88Å
539	E	91	Very high	87.6	Confident	60 Å²	60	53.3 Å²	53.3	28%	0.28	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-6.9	168.5	76.4	-73.4	174.5	0	0	113.9	Y537 K549 E557	Y537-E539 VanDerWaalsContact CA-OE2 3.23Å; Y537-E539 WeakPolarHBondContact CA-OE2 3.22Å; Y537-E539 PolarHBondContact O-N 3.48Å; Y537-E539 VanDerWaalsContact O-N 3.1Å; E539-K549 IonicContact OE1-NZ 2.81Å; E539-K549 PolarHBondContact OE1-NZ 2.97Å; E539-E557 HydrophobicContact CG-CB 4.19Å; E539-E557 PolarHBondContact OE1-N 3.3Å
540	C	88.3	Confident	87.2	Confident	17 Å²	17	53 Å²	53	12%	0.115	28%	0.281	C	S	.	.			trans	-104.9	114.7	-175.7	-61.8	0	0	0	0	112.7	Y537 S538 N542 T545 I546	Y537-C540 VanDerWaalsContact O-CB 3.27Å; Y537-C540 WeakPolarHBondContact O-CB 3.29Å; Y537-C540 PolarHBondContact O-N 2.88Å; S538-C540 PolarHBondContact O-N 2.88Å; C540-N542 VanDerWaalsContact C-N 3.25Å; C540-N542 PolarHBondContact O-N 3.15Å; C540-N542 VanDerWaalsContact O-N 3.15Å; C540-T545 HydrophobicContact CB-CG2 4.14Å; C540-I546 HydrophobicContact CB-CD1 3.76Å; C540-I546 HydrophobicContact CB-CG1 3.29Å
541	M	84.3	Confident	86.7	Confident	192 Å²	192	56.7 Å²	56.7	95%	0.946	30%	0.299	S	S	*	.	S	Bend	trans	-68.3	-11.1	-177.4	-59.9	179.9	74.4	0	0	116.1
542	N	77.8	Confident	86.3	Confident	70 Å²	70	59.2 Å²	59.2	37%	0.374	32%	0.318	S	S	.	.	S	Bend	trans	-155.7	151.4	-178.5	67.8	81.8	0	0	0	113.3	C540 A544 T545 I546	C540-N542 VanDerWaalsContact C-N 3.25Å; C540-N542 PolarHBondContact O-N 3.15Å; C540-N542 VanDerWaalsContact O-N 3.15Å; N542-A544 VanDerWaalsContact C-N 3.27Å; N542-A544 PolarHBondContact O-N 2.97Å; N542-A544 WeakPolarHBondContact OD1-CB 3.49Å; N542-A544 PolarHBondContact OD1-N 3.04Å; N542-T545 PolarHBondContact ND2-OG1 3.37Å; N542-T545 PolarHBondContact O-N 3.37Å; N542-T545 VanDerWaalsContact O-N 3.11Å; N542-T545 PolarHBondContact OD1-N 3.2Å; N542-T545 PolarHBondContact OD1-OG1 3.25Å; N542-I546 PolarHBondContact O-N 3.03Å
543	P	76.4	Confident	86	Confident	67 Å²	67	59.5 Å²	59.5	44%	0.435	33%	0.327	S	S	.	.	H	α-helix	trans	-55.3	-33.6	-180	-31.6	38.2	0	0	0	115.5	P502 T545 I546 Y547	P502-P543 HydrophobicContact CB-CB 3.95Å; P502-P543 HydrophobicContact CG-CB 3.67Å; P502-P543 HydrophobicContact CG-CG 3.68Å; P543-T545 VanDerWaalsContact C-N 3.31Å; P543-T545 PolarHBondContact O-N 2.99Å; P543-I546 WeakPolarHBondContact O-CB 3.48Å; P543-I546 PolarHBondContact O-N 3.23Å; P543-I546 VanDerWaalsContact O-N 3.15Å; P543-Y547 WeakPolarHBondContact O-CB 3.38Å; P543-Y547 PolarHBondContact O-N 2.98Å
544	A	75.3	Confident	86.1	Confident	51 Å²	51	61 Å²	61	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-69.3	-30.3	-178.7	0	0	0	0	0	112.2	N542 R548	N542-A544 VanDerWaalsContact C-N 3.27Å; N542-A544 PolarHBondContact O-N 2.97Å; N542-A544 WeakPolarHBondContact OD1-CB 3.49Å; N542-A544 PolarHBondContact OD1-N 3.04Å; A544-R548 WeakPolarHBondContact O-CG 3.37Å; A544-R548 PolarHBondContact O-N 2.68Å; A544-R548 PolarHBondContact O-NH1 3.01Å
545	T	87.4	Confident	86.2	Confident	36 Å²	36	61.3 Å²	61.3	22%	0.221	33%	0.329	C	S	.	.	H	α-helix	trans	-67.8	-38.1	170.6	-62	0	0	0	0	111.6	C540 N542 P543 R548 K549	C540-T545 HydrophobicContact CB-CG2 4.14Å; N542-T545 PolarHBondContact ND2-OG1 3.37Å; N542-T545 PolarHBondContact O-N 3.37Å; N542-T545 VanDerWaalsContact O-N 3.11Å; N542-T545 PolarHBondContact OD1-N 3.2Å; N542-T545 PolarHBondContact OD1-OG1 3.25Å; P543-T545 VanDerWaalsContact C-N 3.31Å; P543-T545 PolarHBondContact O-N 2.99Å; T545-R548 PolarHBondContact O-N 2.74Å; T545-R548 PolarHBondContact OG1-NH2 3.22Å; T545-K549 PolarHBondContact O-N 3.14Å
546	I	85.1	Confident	86.4	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-68.1	-49	179.4	-57.5	180	0	0	0	109.9	E503 Y537 C540 N542 P543 R548 K549 V550	E503-I546 HydrophobicContact CG-CD1 3.55Å; Y537-I546 HydrophobicContact CD2-CG2 3.63Å; Y537-I546 HydrophobicContact CE2-CG2 4.21Å; Y537-I546 HydrophobicContact CG-CG2 3.8Å; C540-I546 HydrophobicContact CB-CD1 3.76Å; C540-I546 HydrophobicContact CB-CG1 3.29Å; N542-I546 PolarHBondContact O-N 3.03Å; P543-I546 WeakPolarHBondContact O-CB 3.48Å; P543-I546 PolarHBondContact O-N 3.23Å; P543-I546 VanDerWaalsContact O-N 3.15Å; I546-R548 VanDerWaalsContact C-N 3.3Å; I546-R548 PolarHBondContact O-N 3.35Å; I546-K549 PolarHBondContact O-N 3.19Å; I546-V550 HydrophobicContact CG2-CG2 4.19Å; I546-V550 WeakPolarHBondContact O-CG2 3.43Å; I546-V550 PolarHBondContact O-N 3.17Å
547	Y	78.7	Confident	86.4	Confident	96 Å²	96	62.4 Å²	62.4	38%	0.376	34%	0.337	S	S	.	.	H	α-helix	trans	-49.8	-46.7	171.3	177.5	-102.3	0	0	0	112.9	Y510 P543 I551	Y510-Y547 AromaticContact CD1-CD2 3.96Å; Y510-Y547 HydrophobicContact CD1-CD2 3.96Å; Y510-Y547 AromaticContact CD1-CE2 3.72Å; Y510-Y547 HydrophobicContact CD1-CE2 3.72Å; Y510-Y547 AromaticContact CD2-CD2 3.84Å; Y510-Y547 HydrophobicContact CD2-CD2 3.84Å; Y510-Y547 AromaticContact CD2-CE2 3.72Å; Y510-Y547 HydrophobicContact CD2-CE2 3.72Å; Y510-Y547 AromaticContact CE1-CD2 3.77Å; Y510-Y547 HydrophobicContact CE1-CD2 3.77Å; Y510-Y547 HydrophobicContact CE1-CE2 4.03Å; Y510-Y547 AromaticContact CE2-CD2 3.65Å; Y510-Y547 HydrophobicContact CE2-CD2 3.65Å; Y510-Y547 HydrophobicContact CE2-CE2 4.04Å; Y510-Y547 AromaticContact CG-CD2 3.99Å; Y510-Y547 HydrophobicContact CG-CD2 3.99Å; Y510-Y547 AromaticContact CG-CE2 3.54Å; Y510-Y547 HydrophobicContact CG-CE2 3.54Å; Y510-Y547 AromaticContact CZ-CD2 3.6Å; P543-Y547 WeakPolarHBondContact O-CB 3.38Å; P543-Y547 PolarHBondContact O-N 2.98Å; Y547-I551 HydrophobicContact CD1-CD1 4.3Å; Y547-I551 HydrophobicContact CD2-CD1 3.99Å; Y547-I551 HydrophobicContact CE1-CD1 3.76Å; Y547-I551 HydrophobicContact CE2-CD1 3.41Å; Y547-I551 VanDerWaalsContact CE2-CD1 3.41Å; Y547-I551 HydrophobicContact CE2-CG1 4.48Å; Y547-I551 HydrophobicContact CG-CD1 4.41Å; Y547-I551 PolarHBondContact O-N 2.71Å; Y547-I551 VanDerWaalsContact O-N 3.12Å; Y547-I551 WeakPolarHBondContact OH-CD1 3.47Å
548	R	84.8	Confident	86.4	Confident	144 Å²	144	62.2 Å²	62.2	54%	0.543	34%	0.336	S	S	.	.	H	α-helix	trans	-62.4	-46.4	176	-73.2	-170.7	-52.1	-79.4	1.2	112.2	A544 T545 I546 S552	A544-R548 WeakPolarHBondContact O-CG 3.37Å; A544-R548 PolarHBondContact O-N 2.68Å; A544-R548 PolarHBondContact O-NH1 3.01Å; T545-R548 PolarHBondContact O-N 2.74Å; T545-R548 PolarHBondContact OG1-NH2 3.22Å; I546-R548 VanDerWaalsContact C-N 3.3Å; I546-R548 PolarHBondContact O-N 3.35Å; R548-S552 WeakPolarHBondContact O-CB 3.42Å; R548-S552 PolarHBondContact O-N 3.42Å; R548-S552 PolarHBondContact O-OG 3.41Å; R548-S552 VanDerWaalsContact O-OG 3.13Å
549	K	89.6	Confident	86.6	Confident	51 Å²	51	59.5 Å²	59.5	22%	0.222	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-48.4	177.4	-80	-164.8	176.8	-162.3	0	112.2	Y537 E539 T545 I546 I551 S552 G553 V554	Y537-K549 HydrophobicContact CD1-CD 3.89Å; Y537-K549 HydrophobicContact CE1-CB 3.96Å; Y537-K549 HydrophobicContact CE1-CD 3.81Å; E539-K549 IonicContact OE1-NZ 2.81Å; E539-K549 PolarHBondContact OE1-NZ 2.97Å; T545-K549 PolarHBondContact O-N 3.14Å; I546-K549 PolarHBondContact O-N 3.19Å; K549-I551 PolarHBondContact O-N 2.74Å; K549-S552 CarbonylContact O-C 3.47Å; K549-S552 PolarHBondContact O-N 2.89Å; K549-S552 PolarHBondContact O-OG 3.26Å; K549-G553 PolarHBondContact O-N 3.1Å; K549-G553 VanDerWaalsContact O-N 3.15Å; K549-V554 HydrophobicContact CB-CB 4.02Å; K549-V554 HydrophobicContact CB-CG1 4.33Å; K549-V554 HydrophobicContact CD-CB 4.47Å; K549-V554 HydrophobicContact CD-CG1 3.86Å; K549-V554 HydrophobicContact CG-CB 4.1Å; K549-V554 HydrophobicContact CG-CG1 3.97Å; K549-V554 PolarHBondContact O-N 3.11Å
550	V	86.3	Confident	86.6	Confident	9 Å²	9	61 Å²	61	6%	0.055	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-46	-177.1	171.8	0	0	0	0	111.1	P507 Y521 Y537 I546 G553	P507-V550 HydrophobicContact CB-CG1 4.04Å; P507-V550 HydrophobicContact CG-CG1 4.17Å; Y521-V550 WeakPolarHBondContact OH-CG1 3.38Å; Y537-V550 HydrophobicContact CD2-CG2 4.41Å; Y537-V550 HydrophobicContact CE2-CG2 3.51Å; I546-V550 HydrophobicContact CG2-CG2 4.19Å; I546-V550 WeakPolarHBondContact O-CG2 3.43Å; I546-V550 PolarHBondContact O-N 3.17Å; V550-G553 PolarHBondContact O-N 2.72Å
551	I	83.8	Confident	86.8	Confident	82 Å²	82	65.8 Å²	65.8	42%	0.421	35%	0.348	S	S	.	.	H	α-helix	trans	-68.6	-36.4	177.5	-71.4	177.8	0	0	0	111.8	P507 Y547 K549 G553	P507-I551 HydrophobicContact CB-CG1 3.82Å; Y547-I551 HydrophobicContact CD1-CD1 4.3Å; Y547-I551 HydrophobicContact CD2-CD1 3.99Å; Y547-I551 HydrophobicContact CE1-CD1 3.76Å; Y547-I551 HydrophobicContact CE2-CD1 3.41Å; Y547-I551 VanDerWaalsContact CE2-CD1 3.41Å; Y547-I551 HydrophobicContact CE2-CG1 4.48Å; Y547-I551 HydrophobicContact CG-CD1 4.41Å; Y547-I551 PolarHBondContact O-N 2.71Å; Y547-I551 VanDerWaalsContact O-N 3.12Å; Y547-I551 WeakPolarHBondContact OH-CD1 3.47Å; K549-I551 PolarHBondContact O-N 2.74Å; I551-G553 PolarHBondContact O-N 3.49Å
552	S	84.7	Confident	87.1	Confident	79 Å²	79	57.4 Å²	57.4	55%	0.552	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	13.4	175.8	78.5	0	0	0	0	114.1	R548 K549 V554	R548-S552 WeakPolarHBondContact O-CB 3.42Å; R548-S552 PolarHBondContact O-N 3.42Å; R548-S552 PolarHBondContact O-OG 3.41Å; R548-S552 VanDerWaalsContact O-OG 3.13Å; K549-S552 CarbonylContact O-C 3.47Å; K549-S552 PolarHBondContact O-N 2.89Å; K549-S552 PolarHBondContact O-OG 3.26Å; S552-V554 PolarHBondContact O-N 3.34Å; S552-V554 VanDerWaalsContact O-N 3.12Å; S552-V554 WeakPolarHBondContact OG-CG2 3.33Å
553	G	85.9	Confident	87.7	Confident	34 Å²	34	56 Å²	56	35%	0.351	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	11.1	179.2	0	0	0	0	0	116.2	K549 V550 I551 K555 V579	K549-G553 PolarHBondContact O-N 3.1Å; K549-G553 VanDerWaalsContact O-N 3.15Å; V550-G553 PolarHBondContact O-N 2.72Å; I551-G553 PolarHBondContact O-N 3.49Å; G553-K555 PolarHBondContact O-N 3.44Å; G553-K555 VanDerWaalsContact O-N 3.16Å; G553-V579 VanDerWaalsContact CA-CG2 3.42Å
554	V	91.2	Very high	88.1	Confident	67 Å²	67	57.4 Å²	57.4	41%	0.406	32%	0.318	S	S	.	.			trans	-77.9	103.6	178.6	176.1	0	0	0	0	108.7	Y537 K549 S552	Y537-V554 VanDerWaalsContact CE1-O 3.32Å; Y537-V554 WeakPolarHBondContact CE1-O 3.41Å; Y537-V554 PolarHBondContact OH-O 3.17Å; K549-V554 HydrophobicContact CB-CB 4.02Å; K549-V554 HydrophobicContact CB-CG1 4.33Å; K549-V554 HydrophobicContact CD-CB 4.47Å; K549-V554 HydrophobicContact CD-CG1 3.86Å; K549-V554 HydrophobicContact CG-CB 4.1Å; K549-V554 HydrophobicContact CG-CG1 3.97Å; K549-V554 PolarHBondContact O-N 3.11Å; S552-V554 PolarHBondContact O-N 3.34Å; S552-V554 VanDerWaalsContact O-N 3.12Å; S552-V554 WeakPolarHBondContact OG-CG2 3.33Å
555	K	93.9	Very high	88.5	Confident	74 Å²	74	60.9 Å²	60.9	32%	0.322	33%	0.326	S	S	.	.			trans	-63.1	157	177.9	-66.3	166.4	-176.7	168.3	0	111.2	G553 F559 D574 I577	G553-K555 PolarHBondContact O-N 3.44Å; G553-K555 VanDerWaalsContact O-N 3.16Å; K555-F559 HydrophobicContact CB-CB 4.3Å; K555-F559 HydrophobicContact CB-CD1 4.24Å; K555-F559 HydrophobicContact CB-CG 4.27Å; K555-F559 HydrophobicContact CD-CD1 4.03Å; K555-F559 HydrophobicContact CD-CE1 3.85Å; K555-F559 HydrophobicContact CD-CZ 4.18Å; K555-D574 VanDerWaalsContact NZ-CG 3.31Å; K555-D574 IonicContact NZ-OD1 2.93Å; K555-D574 PolarHBondContact NZ-OD1 2.88Å; K555-D574 IonicContact NZ-OD2 3.83Å; K555-D574 PolarHBondContact NZ-OD2 3.04Å; K555-I577 HydrophobicContact CB-CD1 4.37Å; K555-I577 HydrophobicContact CD-CD1 4.32Å; K555-I577 HydrophobicContact CG-CD1 3.94Å
556	P	93.5	Very high	88.3	Confident	4 Å²	4	62.8 Å²	62.8	3%	0.026	33%	0.329	C	S	.	.			trans	-56.7	149.1	177.1	-24.6	33.9	0	0	0	112.4	M525 L528 P536 Y537 C558 F559	M525-P556 HydrophobicContact CE-CG 3.97Å; M525-P556 HydrophobicContact SD-CG 4.04Å; L528-P556 HydrophobicContact CD2-CB 4.04Å; L528-P556 HydrophobicContact CD2-CG 3.79Å; P536-P556 HydrophobicContact CB-CG 4.24Å; Y537-P556 HydrophobicContact CD1-CB 4.14Å; Y537-P556 HydrophobicContact CD1-CG 4.12Å; Y537-P556 HydrophobicContact CD2-CG 3.96Å; Y537-P556 HydrophobicContact CE1-CB 4.2Å; Y537-P556 HydrophobicContact CE1-CG 3.86Å; Y537-P556 HydrophobicContact CE2-CG 3.7Å; Y537-P556 HydrophobicContact CG-CB 4.36Å; Y537-P556 HydrophobicContact CG-CG 4.17Å; P556-C558 PolarHBondContact O-N 3.28Å; P556-F559 WeakPolarHBondContact O-CB 3.32Å; P556-F559 PolarHBondContact O-N 3.06Å
557	E	93.2	Very high	88.3	Confident	91 Å²	91	65.9 Å²	65.9	43%	0.425	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59.1	-38.5	178.1	-164.1	-167.2	130.2	0	0	111.8	E539 F559 S560 R561	E539-E557 HydrophobicContact CG-CB 4.19Å; E539-E557 PolarHBondContact OE1-N 3.3Å; E557-F559 PolarHBondContact O-N 3.13Å; E557-F559 VanDerWaalsContact O-N 3.12Å; E557-S560 WeakPolarHBondContact O-CB 3.34Å; E557-S560 PolarHBondContact O-N 3.4Å; E557-S560 PolarHBondContact O-OG 3.19Å; E557-R561 IonicContact OE1-CZ 3.17Å; E557-R561 IonicContact OE1-NE 3.42Å; E557-R561 IonicContact OE1-NH2 3.66Å; E557-R561 PolarHBondContact OE1-NH2 2.78Å
558	C	92.9	Very high	88.6	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.014	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-64.9	-13.3	178	63	0	0	0	0	114.3	T532 E534 P556 S560 R561	T532-C558 HydrophobicContact CG2-CB 4.08Å; T532-C558 WeakPolarHBondContact CG2-O 3.48Å; E534-C558 HydrophobicContact CB-CB 4.24Å; P556-C558 PolarHBondContact O-N 3.28Å; C558-S560 PolarHBondContact O-N 3.22Å; C558-R561 WeakPolarHBondContact O-CA 3.47Å; C558-R561 WeakPolarHBondContact O-CB 3.15Å; C558-R561 PolarHBondContact O-N 2.85Å
559	F	94	Very high	88.9	Confident	20 Å²	20	56.5 Å²	56.5	9%	0.088	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-62.8	-30.5	169.7	-177.7	-98.5	0	0	0	112.3	K555 P556 E557 R561 I562 R570 I573 D574 I577	K555-F559 HydrophobicContact CB-CB 4.3Å; K555-F559 HydrophobicContact CB-CD1 4.24Å; K555-F559 HydrophobicContact CB-CG 4.27Å; K555-F559 HydrophobicContact CD-CD1 4.03Å; K555-F559 HydrophobicContact CD-CE1 3.85Å; K555-F559 HydrophobicContact CD-CZ 4.18Å; P556-F559 WeakPolarHBondContact O-CB 3.32Å; P556-F559 PolarHBondContact O-N 3.06Å; E557-F559 PolarHBondContact O-N 3.13Å; E557-F559 VanDerWaalsContact O-N 3.12Å; F559-R561 PolarHBondContact O-N 3.12Å; F559-I562 HydrophobicContact CD2-CD1 3.63Å; F559-I562 HydrophobicContact CE2-CD1 3.91Å; F559-I562 HydrophobicContact CG-CD1 4.23Å; F559-I562 WeakPolarHBondContact O-CD1 3.45Å; F559-I562 WeakPolarHBondContact O-CG1 3.26Å; F559-R570 HydrophobicContact CE1-CG 4.47Å; F559-R570 HydrophobicContact CE2-CG 4.31Å; F559-R570 HydrophobicContact CZ-CG 3.94Å; F559-I573 HydrophobicContact CD2-CG2 3.85Å; F559-I573 HydrophobicContact CE2-CB 4.21Å; F559-I573 HydrophobicContact CE2-CG2 3.81Å; F559-D574 HydrophobicContact CE2-CB 4.35Å; F559-D574 HydrophobicContact CZ-CB 4.04Å; F559-D574 VanDerWaalsContact CZ-OD1 3.28Å; F559-D574 WeakPolarHBondContact CZ-OD1 3.32Å; F559-I577 HydrophobicContact CD2-CD1 4.05Å; F559-I577 HydrophobicContact CE2-CD1 4.27Å
560	S	92.4	Very high	89	Confident	91 Å²	91	60.7 Å²	60.7	64%	0.636	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-72.7	-17.9	172.5	69.9	0	0	0	0	113.4	E557 C558	E557-S560 WeakPolarHBondContact O-CB 3.34Å; E557-S560 PolarHBondContact O-N 3.4Å; E557-S560 PolarHBondContact O-OG 3.19Å; C558-S560 PolarHBondContact O-N 3.22Å
561	R	91.2	Very high	89.2	Confident	119 Å²	119	62.4 Å²	62.4	45%	0.449	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-95.8	5.4	-175.9	-53.4	178.2	-176.3	-171.6	-3.4	113	E534 E557 C558 F559	E534-R561 IonicContact OE1-NH1 2.74Å; E534-R561 PolarHBondContact OE1-NH1 3.5Å; E534-R561 VanDerWaalsContact OE2-CD 3.23Å; E534-R561 WeakPolarHBondContact OE2-CD 3.44Å; E534-R561 IonicContact OE2-CZ 2.72Å; E534-R561 IonicContact OE2-NE 2.79Å; E534-R561 IonicContact OE2-NH1 3.9Å; E534-R561 PolarHBondContact OE2-NH1 2.88Å; E557-R561 IonicContact OE1-CZ 3.17Å; E557-R561 IonicContact OE1-NE 3.42Å; E557-R561 IonicContact OE1-NH2 3.66Å; E557-R561 PolarHBondContact OE1-NH2 2.78Å; C558-R561 WeakPolarHBondContact O-CA 3.47Å; C558-R561 WeakPolarHBondContact O-CB 3.15Å; C558-R561 PolarHBondContact O-N 2.85Å; F559-R561 PolarHBondContact O-N 3.12Å
562	I	91.6	Very high	89.7	Confident	15 Å²	15	58.6 Å²	58.6	8%	0.077	32%	0.318	C	S	.	.	S	Bend	trans	-60.8	127.2	173.2	-65	166.1	0	0	0	108.4	L528 V531 F559 A564 I569 R570 I573	L528-I562 HydrophobicContact CD1-CD1 3.97Å; L528-I562 HydrophobicContact CD1-CG1 3.93Å; V531-I562 HydrophobicContact CG1-CG2 4.21Å; F559-I562 HydrophobicContact CD2-CD1 3.63Å; F559-I562 HydrophobicContact CE2-CD1 3.91Å; F559-I562 HydrophobicContact CG-CD1 4.23Å; F559-I562 WeakPolarHBondContact O-CD1 3.45Å; F559-I562 WeakPolarHBondContact O-CG1 3.26Å; I562-A564 PolarHBondContact O-N 2.84Å; I562-I569 HydrophobicContact CG2-CG2 4.45Å; I562-R570 HydrophobicContact CD1-CB 4.18Å; I562-R570 HydrophobicContact CD1-CG 4.06Å; I562-R570 HydrophobicContact CG2-CB 4.06Å; I562-I573 HydrophobicContact CD1-CD1 3.68Å; I562-I573 HydrophobicContact CG1-CD1 4.34Å
563	P	88.9	Confident	90.2	Very high	42 Å²	42	54.8 Å²	54.8	27%	0.273	29%	0.291	S	S	.	.			trans	-62.6	126.4	-173.5	-23.7	33.8	0	0	0	112.9	Q565 Y566	P563-Q565 VanDerWaalsContact CB-CD 3.48Å; P563-Q565 VanDerWaalsContact CB-NE2 3.31Å; P563-Q565 PolarHBondContact O-N 2.72Å; P563-Y566 HydrophobicContact CB-CD2 4.37Å; P563-Y566 PolarHBondContact O-N 2.87Å
564	A	86.1	Confident	90.6	Very high	95 Å²	95	55 Å²	55	79%	0.785	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-17.9	-172.1	0	0	0	0	0	114.9	I562 Y566	I562-A564 PolarHBondContact O-N 2.84Å; A564-Y566 PolarHBondContact O-N 3.12Å
565	Q	83.3	Confident	90.7	Very high	125 Å²	125	52.4 Å²	52.4	58%	0.584	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-2.3	173.4	75.3	-81.8	8.9	0	0	114.7	P563	P563-Q565 VanDerWaalsContact CB-CD 3.48Å; P563-Q565 VanDerWaalsContact CB-NE2 3.31Å; P563-Q565 PolarHBondContact O-N 2.72Å
566	Y	83.6	Confident	90.8	Very high	76 Å²	76	48.9 Å²	48.9	30%	0.298	25%	0.252	S	S	.	.			trans	-129.6	61.4	176.5	-55.3	-55.5	0	0	0	111.8	I436 P563 A564 E568 I569	I436-Y566 HydrophobicContact CD1-CD1 4.45Å; I436-Y566 HydrophobicContact CD1-CE1 4.36Å; I436-Y566 HydrophobicContact CG1-CE1 4.16Å; P563-Y566 HydrophobicContact CB-CD2 4.37Å; P563-Y566 PolarHBondContact O-N 2.87Å; A564-Y566 PolarHBondContact O-N 3.12Å; Y566-E568 VanDerWaalsContact CA-OE2 3.3Å; Y566-E568 WeakPolarHBondContact CA-OE2 3.48Å; Y566-E568 PolarHBondContact O-N 2.93Å; Y566-I569 HydrophobicContact CD2-CD1 4.21Å; Y566-I569 HydrophobicContact CG-CD1 3.92Å; Y566-I569 WeakPolarHBondContact O-CB 3.16Å; Y566-I569 PolarHBondContact O-N 2.87Å; Y566-I569 VanDerWaalsContact O-N 3.15Å
567	P	84.5	Confident	90.8	Very high	68 Å²	68	49.1 Å²	49.1	44%	0.442	25%	0.253	S	S	.	.	H	α-helix	trans	-58.7	-32.8	-179.1	26.6	-35	0	0	0	112.5	I569 R570 E571	P567-I569 VanDerWaalsContact C-N 3.26Å; P567-I569 PolarHBondContact O-N 3.49Å; P567-R570 WeakPolarHBondContact O-CA 3.36Å; P567-R570 VanDerWaalsContact O-CB 3.3Å; P567-R570 WeakPolarHBondContact O-CB 3.42Å; P567-R570 PolarHBondContact O-N 3.38Å; P567-E571 PolarHBondContact O-N 3.44Å
568	E	85.4	Confident	90.7	Very high	41 Å²	41	46.1 Å²	46.1	19%	0.192	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-29.3	-179.9	78	-77.4	-163	0	0	112.6	Y566 I572 F595	Y566-E568 VanDerWaalsContact CA-OE2 3.3Å; Y566-E568 WeakPolarHBondContact CA-OE2 3.48Å; Y566-E568 PolarHBondContact O-N 2.93Å; E568-I572 WeakPolarHBondContact O-CB 3.44Å; E568-I572 WeakPolarHBondContact O-CD1 3.39Å; E568-I572 WeakPolarHBondContact O-CG1 3.28Å; E568-I572 PolarHBondContact O-N 3.08Å; E568-F595 HydrophobicContact CG-CB 4.19Å; E568-F595 HydrophobicContact CG-CD2 3.32Å; E568-F595 HydrophobicContact CG-CE2 3.98Å; E568-F595 HydrophobicContact CG-CG 4.02Å; E568-F595 WeakPolarHBondContact OE1-CD2 3.43Å; E568-F595 WeakPolarHBondContact OE1-CE2 3.19Å
569	I	91.9	Very high	90.4	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-67.5	-40.8	172.5	-64.3	-178.5	0	0	0	110.4	I436 L439 L527 V531 I562 Y566 P567 I572 I573 F595	I436-I569 HydrophobicContact CD1-CD1 3.8Å; L439-I569 HydrophobicContact CD2-CD1 4.04Å; L527-I569 HydrophobicContact CD1-CG2 4.41Å; L527-I569 HydrophobicContact CG-CG2 4.47Å; V531-I569 HydrophobicContact CB-CG2 4.49Å; V531-I569 HydrophobicContact CG1-CG2 4.23Å; V531-I569 HydrophobicContact CG2-CD1 4.35Å; V531-I569 HydrophobicContact CG2-CG2 3.65Å; I562-I569 HydrophobicContact CG2-CG2 4.45Å; Y566-I569 HydrophobicContact CD2-CD1 4.21Å; Y566-I569 HydrophobicContact CG-CD1 3.92Å; Y566-I569 WeakPolarHBondContact O-CB 3.16Å; Y566-I569 PolarHBondContact O-N 2.87Å; Y566-I569 VanDerWaalsContact O-N 3.15Å; P567-I569 VanDerWaalsContact C-N 3.26Å; P567-I569 PolarHBondContact O-N 3.49Å; I569-I572 PolarHBondContact O-N 3.04Å; I569-I573 HydrophobicContact CG2-CD1 3.79Å; I569-I573 HydrophobicContact CG2-CG1 4.41Å; I569-I573 WeakPolarHBondContact O-CG1 3.24Å; I569-I573 PolarHBondContact O-N 3.27Å; I569-F595 HydrophobicContact CD1-CE2 3.85Å; I569-F595 HydrophobicContact CD1-CZ 3.58Å; I569-F595 HydrophobicContact CG1-CD2 4.3Å; I569-F595 HydrophobicContact CG1-CE1 4.11Å; I569-F595 HydrophobicContact CG1-CE2 3.46Å; I569-F595 VanDerWaalsContact CG1-CE2 3.46Å; I569-F595 HydrophobicContact CG1-CZ 3.37Å
570	R	91.9	Very high	89.9	Confident	139 Å²	139	53 Å²	53	53%	0.525	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-45.2	178.1	-174.1	179.9	176.4	-152.2	-1.1	110.7	F559 I562 P567 I573 D574	F559-R570 HydrophobicContact CE1-CG 4.47Å; F559-R570 HydrophobicContact CE2-CG 4.31Å; F559-R570 HydrophobicContact CZ-CG 3.94Å; I562-R570 HydrophobicContact CD1-CB 4.18Å; I562-R570 HydrophobicContact CD1-CG 4.06Å; I562-R570 HydrophobicContact CG2-CB 4.06Å; P567-R570 WeakPolarHBondContact O-CA 3.36Å; P567-R570 VanDerWaalsContact O-CB 3.3Å; P567-R570 WeakPolarHBondContact O-CB 3.42Å; P567-R570 PolarHBondContact O-N 3.38Å; R570-I573 PolarHBondContact O-N 3.19Å; R570-D574 WeakPolarHBondContact O-CB 3.47Å; R570-D574 PolarHBondContact O-N 2.7Å
571	E	90.5	Very high	89.6	Confident	46 Å²	46	52.9 Å²	52.9	22%	0.215	25%	0.254	C	S	.	.	H	α-helix	trans	-59.4	-45.1	173.2	-65.4	-178.3	-150.4	0	0	112.8	P567 D574 R575 R611	P567-E571 PolarHBondContact O-N 3.44Å; E571-D574 PolarHBondContact O-N 3.06Å; E571-R575 VanDerWaalsContact O-CG 3.32Å; E571-R575 WeakPolarHBondContact O-CG 3.39Å; E571-R575 PolarHBondContact O-N 3.4Å; E571-R575 PolarHBondContact O-NE 2.72Å; E571-R611 VanDerWaalsContact CD-NE 3.26Å; E571-R611 IonicContact OE1-NE 3.68Å; E571-R611 PolarHBondContact OE1-NE 3.21Å; E571-R611 IonicContact OE2-CZ 3.01Å; E571-R611 IonicContact OE2-NE 3.2Å; E571-R611 PolarHBondContact OE2-NE 2.98Å; E571-R611 IonicContact OE2-NH2 2.76Å; E571-R611 PolarHBondContact OE2-NH2 2.89Å
572	I	93.6	Very high	89.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-45.1	-180	-71.2	162.7	0	0	0	110.8	L527 E568 I569 C576 L590 F595 F596	L527-I572 HydrophobicContact CD2-CB 4.46Å; L527-I572 HydrophobicContact CD2-CG2 3.71Å; E568-I572 WeakPolarHBondContact O-CB 3.44Å; E568-I572 WeakPolarHBondContact O-CD1 3.39Å; E568-I572 WeakPolarHBondContact O-CG1 3.28Å; E568-I572 PolarHBondContact O-N 3.08Å; I569-I572 PolarHBondContact O-N 3.04Å; I572-C576 PolarHBondContact O-N 3.45Å; I572-C576 PolarHBondContact O-SG 3.04Å; I572-L590 HydrophobicContact CG2-CD2 4.19Å; I572-F595 HydrophobicContact CD1-CB 3.46Å; I572-F595 VanDerWaalsContact CD1-CB 3.46Å; I572-F595 HydrophobicContact CD1-CD1 3.66Å; I572-F595 HydrophobicContact CD1-CG 3.69Å; I572-F596 HydrophobicContact CD1-CE2 3.92Å; I572-F596 HydrophobicContact CD1-CZ 4.27Å; I572-F596 HydrophobicContact CG2-CE2 3.93Å; I572-F596 HydrophobicContact CG2-CZ 4Å
573	I	95.6	Very high	89.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-47.2	174.9	-66.7	165.5	0	0	0	109.8	L527 L528 F559 I562 I569 R570 R575 C576 I577	L527-I573 HydrophobicContact CB-CG1 4.17Å; L527-I573 HydrophobicContact CD2-CD1 4.45Å; L527-I573 HydrophobicContact CD2-CG1 3.68Å; L527-I573 HydrophobicContact CG-CD1 4Å; L527-I573 HydrophobicContact CG-CG1 3.67Å; L528-I573 HydrophobicContact CB-CD1 4.12Å; L528-I573 HydrophobicContact CB-CG2 4.29Å; L528-I573 HydrophobicContact CD1-CD1 4.18Å; F559-I573 HydrophobicContact CD2-CG2 3.85Å; F559-I573 HydrophobicContact CE2-CB 4.21Å; F559-I573 HydrophobicContact CE2-CG2 3.81Å; I562-I573 HydrophobicContact CD1-CD1 3.68Å; I562-I573 HydrophobicContact CG1-CD1 4.34Å; I569-I573 HydrophobicContact CG2-CD1 3.79Å; I569-I573 HydrophobicContact CG2-CG1 4.41Å; I569-I573 WeakPolarHBondContact O-CG1 3.24Å; I569-I573 PolarHBondContact O-N 3.27Å; R570-I573 PolarHBondContact O-N 3.19Å; I573-R575 PolarHBondContact O-N 2.91Å; I573-C576 WeakPolarHBondContact O-CA 3.13Å; I573-C576 WeakPolarHBondContact O-CB 3.19Å; I573-C576 PolarHBondContact O-N 3.21Å; I573-I577 HydrophobicContact CG2-CD1 4Å; I573-I577 HydrophobicContact CG2-CG1 4.39Å; I573-I577 HydrophobicContact CG2-CG2 4.32Å; I573-I577 WeakPolarHBondContact O-CG1 3.34Å; I573-I577 PolarHBondContact O-N 3.41Å
574	D	93.3	Very high	89.3	Confident	39 Å²	39	52.9 Å²	52.9	21%	0.209	25%	0.254	C	S	.	.	H	α-helix	trans	-53.6	-54.4	-179.4	-158.9	99.1	0	0	0	111.5	K555 F559 R570 E571 C576 I577 R578	K555-D574 VanDerWaalsContact NZ-CG 3.31Å; K555-D574 IonicContact NZ-OD1 2.93Å; K555-D574 PolarHBondContact NZ-OD1 2.88Å; K555-D574 IonicContact NZ-OD2 3.83Å; K555-D574 PolarHBondContact NZ-OD2 3.04Å; F559-D574 HydrophobicContact CE2-CB 4.35Å; F559-D574 HydrophobicContact CZ-CB 4.04Å; F559-D574 VanDerWaalsContact CZ-OD1 3.28Å; F559-D574 WeakPolarHBondContact CZ-OD1 3.32Å; R570-D574 WeakPolarHBondContact O-CB 3.47Å; R570-D574 PolarHBondContact O-N 2.7Å; E571-D574 PolarHBondContact O-N 3.06Å; D574-C576 PolarHBondContact O-N 3.47Å; D574-C576 VanDerWaalsContact O-N 3.14Å; D574-I577 PolarHBondContact O-N 3.37Å; D574-R578 WeakPolarHBondContact O-CG 3.24Å; D574-R578 PolarHBondContact O-N 3.13Å
575	R	93.4	Very high	89.6	Confident	11 Å²	11	48.7 Å²	48.7	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-15.1	178.5	-62.3	-178.7	-57.3	-172.2	7	114	E571 I573 R584 S585 D593 D691	E571-R575 VanDerWaalsContact O-CG 3.32Å; E571-R575 WeakPolarHBondContact O-CG 3.39Å; E571-R575 PolarHBondContact O-N 3.4Å; E571-R575 PolarHBondContact O-NE 2.72Å; I573-R575 PolarHBondContact O-N 2.91Å; R575-R584 CarbonylContact O-C 3.58Å; R575-R584 VanDerWaalsContact O-CA 3.27Å; R575-R584 WeakPolarHBondContact O-CA 3.4Å; R575-S585 PolarHBondContact O-N 2.74Å; R575-D593 IonicContact CZ-OD2 2.66Å; R575-D593 IonicContact NH2-OD2 3.34Å; R575-D593 PolarHBondContact NH2-OD2 2.81Å; R575-D691 WeakPolarHBondContact CD-OD1 3.44Å; R575-D691 WeakPolarHBondContact CD-OD2 3.26Å; R575-D691 IonicContact NH1-OD2 2.85Å; R575-D691 PolarHBondContact NH1-OD2 3.27Å
576	C	95.8	Very high	90	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-87.4	-36.6	170.3	-64.7	0	0	0	0	112.4	V520 Y521 I572 I573 D574 R584	V520-C576 HydrophobicContact CG1-CB 4.15Å; Y521-C576 WeakPolarHBondContact CA-O 3.33Å; I572-C576 PolarHBondContact O-N 3.45Å; I572-C576 PolarHBondContact O-SG 3.04Å; I573-C576 WeakPolarHBondContact O-CA 3.13Å; I573-C576 WeakPolarHBondContact O-CB 3.19Å; I573-C576 PolarHBondContact O-N 3.21Å; D574-C576 PolarHBondContact O-N 3.47Å; D574-C576 VanDerWaalsContact O-N 3.14Å; C576-R584 WeakPolarHBondContact O-CD 3.46Å
577	I	94.1	Very high	90.5	Very high	10 Å²	10	42.8 Å²	42.8	5%	0.051	20%	0.2	C	C	.	.	H	α-helix	trans	-98.5	13.6	-172.5	73.8	174.8	0	0	0	114.7	Y521 M525 K555 F559 I573 D574	Y521-I577 HydrophobicContact CD2-CB 4.21Å; Y521-I577 HydrophobicContact CD2-CG2 4.46Å; Y521-I577 HydrophobicContact CE2-CB 4.03Å; Y521-I577 HydrophobicContact CE2-CG2 4.48Å; M525-I577 HydrophobicContact CE-CB 4.22Å; M525-I577 HydrophobicContact CE-CD1 4.38Å; M525-I577 HydrophobicContact CE-CG2 3.91Å; M525-I577 HydrophobicContact CG-CG2 4.3Å; M525-I577 HydrophobicContact SD-CG2 4.15Å; K555-I577 HydrophobicContact CB-CD1 4.37Å; K555-I577 HydrophobicContact CD-CD1 4.32Å; K555-I577 HydrophobicContact CG-CD1 3.94Å; F559-I577 HydrophobicContact CD2-CD1 4.05Å; F559-I577 HydrophobicContact CE2-CD1 4.27Å; I573-I577 HydrophobicContact CG2-CD1 4Å; I573-I577 HydrophobicContact CG2-CG1 4.39Å; I573-I577 HydrophobicContact CG2-CG2 4.32Å; I573-I577 WeakPolarHBondContact O-CG1 3.34Å; I573-I577 PolarHBondContact O-N 3.41Å; D574-I577 PolarHBondContact O-N 3.37Å
578	R	92	Very high	90.9	Very high	28 Å²	28	46.8 Å²	46.8	11%	0.106	21%	0.21	C	C	.	.			trans	-56.8	140.9	172.4	-73.1	173.4	177.4	166	-5	111.1	D574 E583 R584 D691 H694	D574-R578 WeakPolarHBondContact O-CG 3.24Å; D574-R578 PolarHBondContact O-N 3.13Å; R578-E583 HydrophobicContact CB-CB 4.2Å; R578-E583 WeakPolarHBondContact CD-O 3.31Å; R578-E583 PolarHBondContact NH1-O 3.43Å; R578-R584 HydrophobicContact CB-CG 4.17Å; R578-R584 PolarHBondContact O-NE 3.14Å; R578-D691 IonicContact CZ-OD1 2.71Å; R578-D691 IonicContact NH1-OD1 2.8Å; R578-D691 IonicContact NH2-OD1 2.79Å; R578-D691 PolarHBondContact NH2-OD1 3.45Å; R578-H694 VanDerWaalsContact CZ-CG 3.41Å; R578-H694 VanDerWaalsContact CZ-ND1 3.32Å; R578-H694 PolarHBondContact NE-CE1 3.46Å; R578-H694 VanDerWaalsContact NE-CE1 3.34Å; R578-H694 PolarHBondContact NE-ND1 3.13Å; R578-H694 PolarHBondContact NH2-ND1 3.1Å
579	V	86.1	Confident	91.1	Very high	50 Å²	50	48.1 Å²	48.1	30%	0.303	22%	0.217	S	C	.	.	S	Bend	trans	-62.1	-54	-172.1	-176.5	0	0	0	0	111.3	P507 G553 R584	P507-V579 HydrophobicContact CG-CG1 4.18Å; P507-V579 WeakPolarHBondContact CG-O 3.43Å; G553-V579 VanDerWaalsContact CA-CG2 3.42Å; V579-R584 PolarHBondContact O-NH2 3.45Å
580	R	82.7	Confident	91.2	Very high	116 Å²	116	48.1 Å²	48.1	44%	0.438	22%	0.217	S	C	.	.	S	Bend	trans	-73.9	130.9	175.5	-73.8	173.5	177.4	72.8	1.7	109.9	E582 E583 R701	R580-E582 VanDerWaalsContact C-N 3.28Å; R580-E582 PolarHBondContact O-N 3.39Å; R580-E583 HydrophobicContact CB-CB 4.49Å; R580-E583 HydrophobicContact CB-CG 3.89Å; R580-E583 WeakPolarHBondContact CD-OE1 3.44Å; R580-E583 PolarHBondContact O-N 2.82Å; R580-R701 VanDerWaalsContact CZ-CZ 3.48Å; R580-R701 VanDerWaalsContact NH1-CZ 3.32Å
581	R	86.4	Confident	91.1	Very high	88 Å²	88	43.9 Å²	43.9	33%	0.332	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-62.3	-35.3	179.3	58.5	176.7	-172.9	-171.9	-3.7	113	M513 D515 S517 E583 R584	M513-R581 PolarHBondContact O-NH1 3.07Å; D515-R581 WeakPolarHBondContact OD2-CD 3.47Å; D515-R581 IonicContact OD2-CZ 2.66Å; D515-R581 IonicContact OD2-NE 3.13Å; D515-R581 IonicContact OD2-NH1 3.07Å; S517-R581 WeakPolarHBondContact OG-CB 3.39Å; R581-E583 PolarHBondContact O-N 3.27Å; R581-R584 WeakPolarHBondContact O-CB 3.39Å; R581-R584 PolarHBondContact O-N 3.19Å; R581-R584 VanDerWaalsContact O-N 3.11Å
582	E	86.3	Confident	90.8	Very high	133 Å²	133	45.1 Å²	45.1	62%	0.621	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-65.6	-20.4	-178.7	-61.1	76	-165.8	0	0	112.3	R580	R580-E582 VanDerWaalsContact C-N 3.28Å; R580-E582 PolarHBondContact O-N 3.39Å
583	E	86.3	Confident	90.4	Very high	29 Å²	29	46.4 Å²	46.4	14%	0.136	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-91.3	-8.4	179.1	-57.4	179.1	171.8	0	0	113.2	R578 R580 R581 H694 R701	R578-E583 HydrophobicContact CB-CB 4.2Å; R578-E583 WeakPolarHBondContact CD-O 3.31Å; R578-E583 PolarHBondContact NH1-O 3.43Å; R580-E583 HydrophobicContact CB-CB 4.49Å; R580-E583 HydrophobicContact CB-CG 3.89Å; R580-E583 WeakPolarHBondContact CD-OE1 3.44Å; R580-E583 PolarHBondContact O-N 2.82Å; R581-E583 PolarHBondContact O-N 3.27Å; E583-H694 VanDerWaalsContact CD-NE2 3.28Å; E583-H694 IonicContact OE1-NE2 2.67Å; E583-H694 IonicContact OE2-CD2 2.72Å; E583-H694 IonicContact OE2-CE1 2.61Å; E583-H694 IonicContact OE2-NE2 3.7Å; E583-H694 PolarHBondContact OE2-NE2 2.91Å; E583-R701 IonicContact OE1-CZ 3.99Å; E583-R701 IonicContact OE1-NH1 3.63Å; E583-R701 PolarHBondContact OE1-NH1 2.85Å; E583-R701 IonicContact OE1-NH2 2.63Å; E583-R701 PolarHBondContact OE1-NH2 2.96Å; E583-R701 IonicContact OE2-NH1 3.73Å
584	R	93	Very high	89.6	Confident	14 Å²	14	47.4 Å²	47.4	5%	0.053	23%	0.227	C	C	.	.	S	Bend	trans	-81.3	144.7	-175.4	-60.3	177.9	-163.7	145.2	13.9	111.7	E508 S517 V520 R575 C576 R578 V579 R581 T586	E508-R584 IonicContact OE1-CZ 3.55Å; E508-R584 IonicContact OE1-NH1 3.83Å; E508-R584 PolarHBondContact OE1-NH1 2.93Å; E508-R584 IonicContact OE1-NH2 3.76Å; E508-R584 PolarHBondContact OE1-NH2 2.87Å; E508-R584 IonicContact OE2-CZ 3.66Å; E508-R584 IonicContact OE2-NH1 2.7Å; E508-R584 IonicContact OE2-NH2 3.96Å; E508-R584 PolarHBondContact OE2-NH2 3.17Å; S517-R584 PolarHBondContact O-NH1 3.38Å; S517-R584 VanDerWaalsContact O-NH1 3.1Å; S517-R584 PolarHBondContact OG-NH1 2.95Å; V520-R584 HydrophobicContact CG1-CB 4.2Å; R575-R584 CarbonylContact O-C 3.58Å; R575-R584 VanDerWaalsContact O-CA 3.27Å; R575-R584 WeakPolarHBondContact O-CA 3.4Å; C576-R584 WeakPolarHBondContact O-CD 3.46Å; R578-R584 HydrophobicContact CB-CG 4.17Å; R578-R584 PolarHBondContact O-NE 3.14Å; V579-R584 PolarHBondContact O-NH2 3.45Å; R581-R584 WeakPolarHBondContact O-CB 3.39Å; R581-R584 PolarHBondContact O-N 3.19Å; R581-R584 VanDerWaalsContact O-N 3.11Å; R584-T586 PolarHBondContact O-N 3.06Å
585	S	91.3	Very high	89	Confident	7 Å²	7	45.7 Å²	45.7	5%	0.049	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-64.9	122.9	173.7	-74.4	0	0	0	0	111.8	V520 R575	V520-S585 WeakPolarHBondContact CG1-O 3.29Å; R575-S585 PolarHBondContact O-N 2.74Å
586	T	93	Very high	88.5	Confident	69 Å²	69	45.3 Å²	45.3	42%	0.423	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-62.5	153.7	173.2	63.3	0	0	0	0	111.5	R584 K588 Q589 L590	R584-T586 PolarHBondContact O-N 3.06Å; T586-K588 PolarHBondContact O-N 2.79Å; T586-K588 VanDerWaalsContact O-N 3.12Å; T586-Q589 PolarHBondContact O-N 3.24Å; T586-Q589 VanDerWaalsContact OG1-CD 3.25Å; T586-Q589 WeakPolarHBondContact OG1-CG 3.4Å; T586-Q589 PolarHBondContact OG1-N 3.22Å; T586-Q589 PolarHBondContact OG1-OE1 3.01Å; T586-L590 PolarHBondContact O-N 3.38Å
587	V	94.4	Very high	87.3	Confident	9 Å²	9	47.4 Å²	47.4	6%	0.055	23%	0.229	C	C	.	.	H	α-helix	trans	-56.4	-31.2	175.9	-177.8	0	0	0	0	112.2	L447 L450 V520 L591	L447-V587 HydrophobicContact CB-CG1 4.33Å; L447-V587 HydrophobicContact CD2-CG1 4.05Å; L447-V587 VanDerWaalsContact O-CG1 3.22Å; L447-V587 WeakPolarHBondContact O-CG1 3.41Å; L450-V587 HydrophobicContact CB-CG1 4.17Å; L450-V587 HydrophobicContact CB-CG2 4.17Å; V520-V587 HydrophobicContact CG2-CG2 3.73Å; V587-L591 HydrophobicContact CG1-CD1 4.24Å; V587-L591 WeakPolarHBondContact O-CB 3.43Å; V587-L591 WeakPolarHBondContact O-CG 3.38Å; V587-L591 PolarHBondContact O-N 3.35Å
588	K	91.4	Very high	85.9	Confident	152 Å²	152	48.6 Å²	48.6	66%	0.661	24%	0.238	S	C	*	.	H	α-helix	trans	-64.2	-47.1	173.3	-68.7	-178.2	-179.6	176.6	0	112	T586 L591 V592	T586-K588 PolarHBondContact O-N 2.79Å; T586-K588 VanDerWaalsContact O-N 3.12Å; K588-L591 PolarHBondContact O-N 3.12Å; K588-V592 WeakPolarHBondContact O-CG2 3.45Å; K588-V592 PolarHBondContact O-N 3.34Å
589	Q	90.6	Very high	84.4	Confident	69 Å²	69	52 Å²	52	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-64.5	-41.5	176.4	-72.1	156.7	-32.3	0	0	111.4	T586 L591 V592 D593	T586-Q589 PolarHBondContact O-N 3.24Å; T586-Q589 VanDerWaalsContact OG1-CD 3.25Å; T586-Q589 WeakPolarHBondContact OG1-CG 3.4Å; T586-Q589 PolarHBondContact OG1-N 3.22Å; T586-Q589 PolarHBondContact OG1-OE1 3.01Å; Q589-L591 VanDerWaalsContact C-N 3.29Å; Q589-L591 PolarHBondContact O-N 3.01Å; Q589-V592 PolarHBondContact O-N 2.97Å; Q589-V592 VanDerWaalsContact O-N 3.15Å; Q589-D593 PolarHBondContact O-N 3.01Å
590	L	93.1	Very high	82.8	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-30	176.2	-66.5	173.3	0	0	0	113.1	L447 V520 F523 I572 T586 V592 F596	L447-L590 HydrophobicContact CD1-CB 3.89Å; L447-L590 HydrophobicContact CD2-CB 3.84Å; L447-L590 HydrophobicContact CD2-CD1 3.81Å; L447-L590 HydrophobicContact CD2-CG 4.49Å; V520-L590 HydrophobicContact CG1-CD1 4.24Å; F523-L590 HydrophobicContact CD1-CD1 4.15Å; F523-L590 HydrophobicContact CE1-CD1 4.17Å; I572-L590 HydrophobicContact CG2-CD2 4.19Å; T586-L590 PolarHBondContact O-N 3.38Å; L590-V592 VanDerWaalsContact C-N 3.3Å; L590-F596 WeakPolarHBondContact O-CD2 3.45Å
591	L	90.4	Very high	81.4	Confident	49 Å²	49	55.1 Å²	55.1	26%	0.257	28%	0.277	S	S	.	.	H	α-helix	trans	-75.9	-15.1	175.3	-79.7	170.7	0	0	0	114.3	L447 K448 V587 K588 Q589	L447-L591 HydrophobicContact CB-CD2 3.57Å; L447-L591 HydrophobicContact CB-CG 3.9Å; K448-L591 HydrophobicContact CG-CD2 4.02Å; V587-L591 HydrophobicContact CG1-CD1 4.24Å; V587-L591 WeakPolarHBondContact O-CB 3.43Å; V587-L591 WeakPolarHBondContact O-CG 3.38Å; V587-L591 PolarHBondContact O-N 3.35Å; K588-L591 PolarHBondContact O-N 3.12Å; Q589-L591 VanDerWaalsContact C-N 3.29Å; Q589-L591 PolarHBondContact O-N 3.01Å
592	V	85	Confident	80.2	Confident	72 Å²	72	52.5 Å²	52.5	44%	0.436	27%	0.27	S	S	.	.	H	α-helix	trans	-97.3	-23.1	179.5	175.9	0	0	0	0	112.2	K588 Q589 L590 D594	K588-V592 WeakPolarHBondContact O-CG2 3.45Å; K588-V592 PolarHBondContact O-N 3.34Å; Q589-V592 PolarHBondContact O-N 2.97Å; Q589-V592 VanDerWaalsContact O-N 3.15Å; L590-V592 VanDerWaalsContact C-N 3.3Å; V592-D594 PolarHBondContact O-N 3.14Å
593	D	84	Confident	79.4	Confident	29 Å²	29	46.6 Å²	46.6	16%	0.155	25%	0.245	C	C	.	.	S	Bend	trans	-54.6	130.9	179.8	-170.3	-67	0	0	0	112.8	R575 Q589 F595 F596 T597	R575-D593 IonicContact CZ-OD2 2.66Å; R575-D593 IonicContact NH2-OD2 3.34Å; R575-D593 PolarHBondContact NH2-OD2 2.81Å; Q589-D593 PolarHBondContact O-N 3.01Å; D593-F595 PolarHBondContact O-N 3.13Å; D593-F595 WeakPolarHBondContact OD1-CB 3.2Å; D593-F595 PolarHBondContact OD1-N 3.28Å; D593-F596 HydrophobicContact CB-CD2 4.33Å; D593-F596 PolarHBondContact O-N 3.2Å; D593-T597 PolarHBondContact O-N 2.9Å
594	D	78.6	Confident	79.1	Confident	21 Å²	21	45.8 Å²	45.8	11%	0.112	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-38.1	-177.9	-58.2	57.8	0	0	0	113.5	V592 F596 T597 K684	V592-D594 PolarHBondContact O-N 3.14Å; D594-F596 PolarHBondContact O-N 3.28Å; D594-T597 PolarHBondContact O-N 3.11Å; D594-T597 PolarHBondContact O-OG1 3.1Å; D594-K684 WeakPolarHBondContact OD1-CE 3.31Å; D594-K684 IonicContact OD1-NZ 3.09Å; D594-K684 PolarHBondContact OD1-NZ 3.15Å; D594-K684 WeakPolarHBondContact OD2-CE 3.45Å; D594-K684 IonicContact OD2-NZ 2.77Å; D594-K684 PolarHBondContact OD2-NZ 2.71Å
595	F	81.7	Confident	78.6	Confident	3 Å²	3	48.8 Å²	48.8	1%	0.013	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.1	-177.5	-179.6	-101.8	0	0	0	112	I436 K440 E568 I569 I572 D593	I436-F595 HydrophobicContact CD1-CE2 3.79Å; I436-F595 HydrophobicContact CD1-CZ 3.68Å; K440-F595 HydrophobicContact CD-CD2 4.49Å; K440-F595 HydrophobicContact CD-CE2 4.28Å; K440-F595 HydrophobicContact CD-CZ 4.37Å; K440-F595 WeakPolarHBondContact CD-O 3.46Å; K440-F595 WeakPolarHBondContact CE-O 3.27Å; K440-F595 HydrophobicContact CG-CD1 4.28Å; K440-F595 HydrophobicContact CG-CD2 4.48Å; K440-F595 HydrophobicContact CG-CE1 3.77Å; K440-F595 HydrophobicContact CG-CE2 4.03Å; K440-F595 HydrophobicContact CG-CZ 3.62Å; K440-F595 WeakPolarHBondContact CG-O 3.38Å; K440-F595 PolarHBondContact NZ-O 2.94Å; E568-F595 HydrophobicContact CG-CB 4.19Å; E568-F595 HydrophobicContact CG-CD2 3.32Å; E568-F595 HydrophobicContact CG-CE2 3.98Å; E568-F595 HydrophobicContact CG-CG 4.02Å; E568-F595 WeakPolarHBondContact OE1-CD2 3.43Å; E568-F595 WeakPolarHBondContact OE1-CE2 3.19Å; I569-F595 HydrophobicContact CD1-CE2 3.85Å; I569-F595 HydrophobicContact CD1-CZ 3.58Å; I569-F595 HydrophobicContact CG1-CD2 4.3Å; I569-F595 HydrophobicContact CG1-CE1 4.11Å; I569-F595 HydrophobicContact CG1-CE2 3.46Å; I569-F595 VanDerWaalsContact CG1-CE2 3.46Å; I569-F595 HydrophobicContact CG1-CZ 3.37Å; I572-F595 HydrophobicContact CD1-CB 3.46Å; I572-F595 VanDerWaalsContact CD1-CB 3.46Å; I572-F595 HydrophobicContact CD1-CD1 3.66Å; I572-F595 HydrophobicContact CD1-CG 3.69Å; D593-F595 PolarHBondContact O-N 3.13Å; D593-F595 WeakPolarHBondContact OD1-CB 3.2Å; D593-F595 PolarHBondContact OD1-N 3.28Å
596	F	82.1	Confident	78.4	Confident	3 Å²	3	48.4 Å²	48.4	1%	0.013	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-9.9	176.1	-56.1	-64.2	0	0	0	113.5	C443 R444 L447 F523 I572 L590 D593 D594	C443-F596 HydrophobicContact CB-CD1 3.93Å; C443-F596 HydrophobicContact CB-CE1 3.27Å; C443-F596 HydrophobicContact CB-CZ 4.08Å; R444-F596 HydrophobicContact CB-CB 4.49Å; R444-F596 WeakPolarHBondContact CD-O 3.43Å; R444-F596 PolarHBondContact NH1-O 2.86Å; L447-F596 HydrophobicContact CD1-CD2 4.01Å; L447-F596 HydrophobicContact CD1-CE2 3.93Å; L447-F596 HydrophobicContact CD1-CG 4.3Å; L447-F596 HydrophobicContact CD1-CZ 4.21Å; F523-F596 HydrophobicContact CZ-CZ 4.06Å; I572-F596 HydrophobicContact CD1-CE2 3.92Å; I572-F596 HydrophobicContact CD1-CZ 4.27Å; I572-F596 HydrophobicContact CG2-CE2 3.93Å; I572-F596 HydrophobicContact CG2-CZ 4Å; L590-F596 WeakPolarHBondContact O-CD2 3.45Å; D593-F596 HydrophobicContact CB-CD2 4.33Å; D593-F596 PolarHBondContact O-N 3.2Å; D594-F596 PolarHBondContact O-N 3.28Å
597	T	71.4	Confident	78.1	Confident	43 Å²	43	46.8 Å²	46.8	26%	0.264	24%	0.238	S	C	.	.	S	Bend	trans	-65.2	140.9	166.2	71.1	0	0	0	0	110.3	D593 D594 E599	D593-T597 PolarHBondContact O-N 2.9Å; D594-T597 PolarHBondContact O-N 3.11Å; D594-T597 PolarHBondContact O-OG1 3.1Å; T597-E599 PolarHBondContact O-N 3.09Å
598	P	64.3	Low	77.9	Confident	36 Å²	36	47.3 Å²	47.3	23%	0.234	24%	0.24	C	C	.	.			trans	-74.4	118.5	174.7	-13.4	29.2	0	0	0	110.5	D600 L601	P598-D600 PolarHBondContact O-N 3.29Å; P598-D600 VanDerWaalsContact O-N 3.14Å; P598-L601 HydrophobicContact CB-CB 4.32Å; P598-L601 HydrophobicContact CB-CD1 4.09Å; P598-L601 HydrophobicContact CG-CD1 4.37Å; P598-L601 HydrophobicContact CG-CD2 4.49Å; P598-L601 PolarHBondContact O-N 3.16Å
599	E	59.5	Low	77.7	Confident	98 Å²	98	44.2 Å²	44.2	46%	0.458	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-46.5	-42.8	174.3	-68.4	148	-157.3	0	0	111.8	K437 K440 T597 L601 G603	K437-E599 IonicContact NZ-OE2 2.91Å; K440-E599 IonicContact NZ-OE1 3.85Å; K440-E599 PolarHBondContact NZ-OE1 2.77Å; T597-E599 PolarHBondContact O-N 3.09Å; E599-L601 PolarHBondContact O-N 3.16Å; E599-G603 PolarHBondContact O-N 2.94Å
600	D	53.4	Low	77.5	Confident	101 Å²	101	44.8 Å²	44.8	54%	0.54	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-69	-12	-176.1	-42.4	-67.4	0	0	0	114.3	P598	P598-D600 PolarHBondContact O-N 3.29Å; P598-D600 VanDerWaalsContact O-N 3.14Å
601	L	53.2	Low	77.2	Confident	131 Å²	131	46.3 Å²	46.3	69%	0.686	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-92.9	-16.4	-176.9	-108.1	74.5	0	0	0	114.6	P598 E599	P598-L601 HydrophobicContact CB-CB 4.32Å; P598-L601 HydrophobicContact CB-CD1 4.09Å; P598-L601 HydrophobicContact CG-CD1 4.37Å; P598-L601 HydrophobicContact CG-CD2 4.49Å; P598-L601 PolarHBondContact O-N 3.16Å; E599-L601 PolarHBondContact O-N 3.16Å
602	I	61.2	Low	76.9	Confident	33 Å²	33	48.8 Å²	48.8	17%	0.169	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-40.1	-172.5	-51.3	-178	0	0	0	111.1	I604 M676 L680	I602-I604 HydrophobicContact CG2-CB 3.99Å; I602-I604 HydrophobicContact CG2-CD1 4.4Å; I602-I604 HydrophobicContact CG2-CG1 4.45Å; I602-I604 PolarHBondContact O-N 3.11Å; I602-M676 HydrophobicContact CD1-SD 4.45Å; I602-M676 HydrophobicContact CG1-SD 4.5Å; I602-M676 HydrophobicContact CG2-CE 4.45Å; I602-M676 HydrophobicContact CG2-CG 3.75Å; I602-M676 HydrophobicContact CG2-SD 4.02Å; I602-L680 HydrophobicContact CG2-CD1 4.32Å
603	G	70.5	Confident	77	Confident	10 Å²	10	47.6 Å²	47.6	10%	0.103	25%	0.248	C	C	.	.	S	Bend	trans	69.8	4	-176.2	0	0	0	0	0	114.6	E599 V628 Y629 D630	E599-G603 PolarHBondContact O-N 2.94Å; G603-V628 CarbonylContact O-C 3.49Å; G603-V628 WeakPolarHBondContact O-CA 3.5Å; G603-Y629 PolarHBondContact O-N 3.5Å; G603-D630 PolarHBondContact O-N 3.18Å
604	I	80.1	Confident	77.2	Confident	11 Å²	11	46.7 Å²	46.7	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.8	-173.7	-50.1	157.8	0	0	0	108	I602 L626 R627 V628 K633 Y637 D673 I677 L680	I602-I604 HydrophobicContact CG2-CB 3.99Å; I602-I604 HydrophobicContact CG2-CD1 4.4Å; I602-I604 HydrophobicContact CG2-CG1 4.45Å; I602-I604 PolarHBondContact O-N 3.11Å; I604-L626 HydrophobicContact CG2-CD1 3.4Å; I604-L626 HydrophobicContact CG2-CG 4.42Å; I604-R627 CarbonylContact C-O 3.32Å; I604-R627 WeakPolarHBondContact CA-O 3.39Å; I604-V628 HydrophobicContact CG1-CG2 4.33Å; I604-V628 HydrophobicContact CG2-CG2 4.42Å; I604-K633 HydrophobicContact CD1-CD 4.31Å; I604-K633 HydrophobicContact CG1-CD 4.35Å; I604-Y637 VanDerWaalsContact CD1-OH 3.31Å; I604-Y637 WeakPolarHBondContact CD1-OH 3.25Å; I604-D673 HydrophobicContact CD1-CB 4.25Å; I604-D673 WeakPolarHBondContact CD1-OD2 3.47Å; I604-I677 HydrophobicContact CD1-CD1 4.45Å; I604-I677 HydrophobicContact CD1-CG1 4.44Å; I604-I677 HydrophobicContact CG2-CD1 4.38Å; I604-I677 HydrophobicContact CG2-CG1 4.27Å; I604-L680 HydrophobicContact CB-CD1 4.47Å; I604-L680 HydrophobicContact CG2-CD1 4.3Å
605	R	81.3	Confident	77.6	Confident	77 Å²	77	47 Å²	47	29%	0.291	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	147.8	176.1	-167.4	-179.1	-174.3	-156.4	10.7	110.6	E607 L626 R627 Y629	R605-E607 WeakPolarHBondContact CD-OE1 3.45Å; R605-E607 HydrophobicContact CG-CG 4.31Å; R605-E607 IonicContact CZ-OE1 3.66Å; R605-E607 IonicContact NE-OE1 2.85Å; R605-E607 IonicContact NH1-OE1 3.1Å; R605-E607 PolarHBondContact NH1-OE1 3.38Å; R605-L626 WeakPolarHBondContact O-CA 3.49Å; R605-R627 PolarHBondContact N-O 3.27Å; R605-R627 PolarHBondContact O-N 3.44Å; R605-Y629 HydrophobicContact CB-CD2 4.31Å; R605-Y629 HydrophobicContact CB-CE2 3.89Å
606	V	87.7	Confident	77.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	132.5	168.3	-179	0	0	0	0	108.7	M624 Q625 L626 F647 L680 I681 K684	V606-M624 HydrophobicContact CG1-CE 3.67Å; V606-Q625 CarbonylContact C-O 3.55Å; V606-Q625 WeakPolarHBondContact CA-O 3.47Å; V606-L626 HydrophobicContact CG2-CD1 3.76Å; V606-F647 HydrophobicContact CG1-CZ 4.43Å; V606-L680 HydrophobicContact CB-CB 4.35Å; V606-L680 HydrophobicContact CG2-CB 3.72Å; V606-L680 HydrophobicContact CG2-CD1 4.33Å; V606-I681 HydrophobicContact CG1-CG1 4.34Å; V606-I681 HydrophobicContact CG2-CG1 4.23Å; V606-K684 HydrophobicContact CB-CG 4.3Å; V606-K684 HydrophobicContact CG1-CG 4.14Å; V606-K684 WeakPolarHBondContact O-CE 3.44Å
607	E	86.9	Confident	78.1	Confident	35 Å²	35	56.2 Å²	56.2	16%	0.164	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	154.5	178.5	-69.1	173.2	-155.9	0	0	110	R605 M624 Q625 R627	R605-E607 WeakPolarHBondContact CD-OE1 3.45Å; R605-E607 HydrophobicContact CG-CG 4.31Å; R605-E607 IonicContact CZ-OE1 3.66Å; R605-E607 IonicContact NE-OE1 2.85Å; R605-E607 IonicContact NH1-OE1 3.1Å; R605-E607 PolarHBondContact NH1-OE1 3.38Å; E607-M624 CarbonylContact O-C 3.58Å; E607-M624 WeakPolarHBondContact O-CA 3.27Å; E607-Q625 PolarHBondContact N-O 3.09Å; E607-Q625 PolarHBondContact O-N 2.91Å; E607-R627 IonicContact OE1-CZ 2.69Å; E607-R627 IonicContact OE1-NH1 2.76Å; E607-R627 PolarHBondContact OE1-NH1 3.42Å; E607-R627 IonicContact OE2-CZ 2.63Å; E607-R627 IonicContact OE2-NH1 3.73Å; E607-R627 PolarHBondContact OE2-NH1 3.32Å; E607-R627 IonicContact OE2-NH2 2.7Å; E607-R627 PolarHBondContact OE2-NH2 2.65Å
608	I	89.8	Confident	78.9	Confident	20 Å²	20	56.5 Å²	56.5	10%	0.103	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.8	170.2	-59.4	171.7	0	0	0	106.1	R611 I622 M624 K684 F688	I608-R611 HydrophobicContact CB-CB 4.15Å; I608-R611 HydrophobicContact CG2-CB 4.02Å; I608-I622 HydrophobicContact CD1-CD1 3.9Å; I608-I622 HydrophobicContact CG1-CD1 4.33Å; I608-I622 HydrophobicContact CG2-CB 4.29Å; I608-I622 HydrophobicContact CG2-CD1 4.49Å; I608-M624 HydrophobicContact CG1-CE 4.16Å; I608-M624 HydrophobicContact CG1-CG 4.37Å; I608-K684 HydrophobicContact CD1-CB 4.48Å; I608-F688 HydrophobicContact CD1-CB 4.04Å; I608-F688 HydrophobicContact CD1-CD2 3.68Å; I608-F688 HydrophobicContact CD1-CG 4.24Å; I608-F688 HydrophobicContact CG2-CD2 4.47Å; I608-F688 HydrophobicContact CG2-CE2 4.45Å
609	K	87.5	Confident	80.1	Confident	87 Å²	87	57.6 Å²	57.6	38%	0.378	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-48.4	-165.9	-77.5	-165.4	168.4	-168	0	113.5	Q623 Q625	K609-Q623 HydrophobicContact CB-CB 4.42Å; K609-Q623 PolarHBondContact N-O 2.97Å; K609-Q625 VanDerWaalsContact CE-CD 3.42Å; K609-Q625 HydrophobicContact CG-CB 4.18Å
610	N	86.6	Confident	81.6	Confident	80 Å²	80	55.3 Å²	55.3	43%	0.428	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	27.5	-172.5	-60.8	-16.9	0	0	0	111.8	D612 A613 D614	N610-D612 VanDerWaalsContact C-N 3.26Å; N610-D612 PolarHBondContact O-N 2.97Å; N610-A613 HydrophobicContact CB-CB 4.48Å; N610-A613 WeakPolarHBondContact O-CA 3.39Å; N610-A613 WeakPolarHBondContact O-CB 3.44Å; N610-A613 PolarHBondContact O-N 3.26Å; N610-D614 VanDerWaalsContact C-OD2 3.3Å; N610-D614 WeakPolarHBondContact CB-OD2 3.44Å; N610-D614 PolarHBondContact O-N 2.95Å
611	R	86.7	Confident	83.4	Confident	34 Å²	34	56.1 Å²	56.1	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-44	-44.2	-167.7	177.1	167.2	163.3	67.8	-5	114.7	E571 I608 L615 F688 D691	E571-R611 VanDerWaalsContact CD-NE 3.26Å; E571-R611 IonicContact OE1-NE 3.68Å; E571-R611 PolarHBondContact OE1-NE 3.21Å; E571-R611 IonicContact OE2-CZ 3.01Å; E571-R611 IonicContact OE2-NE 3.2Å; E571-R611 PolarHBondContact OE2-NE 2.98Å; E571-R611 IonicContact OE2-NH2 2.76Å; E571-R611 PolarHBondContact OE2-NH2 2.89Å; I608-R611 HydrophobicContact CB-CB 4.15Å; I608-R611 HydrophobicContact CG2-CB 4.02Å; R611-L615 WeakPolarHBondContact O-CB 3.5Å; R611-L615 PolarHBondContact O-N 2.91Å; R611-F688 HydrophobicContact CG-CD2 4.45Å; R611-F688 HydrophobicContact CG-CE2 4.42Å; R611-D691 IonicContact CZ-OD2 3.98Å; R611-D691 IonicContact NH1-OD2 3.64Å; R611-D691 IonicContact NH2-OD2 2.79Å; R611-D691 PolarHBondContact NH2-OD2 2.79Å
612	D	83.8	Confident	85.3	Confident	100 Å²	100	49.9 Å²	49.9	54%	0.535	26%	0.259	S	S	.	.	H	α-helix	trans	-67.5	-38.9	178.6	-77.9	-35.5	0	0	0	113.3	N610 N616	N610-D612 VanDerWaalsContact C-N 3.26Å; N610-D612 PolarHBondContact O-N 2.97Å; D612-N616 PolarHBondContact O-N 3.18Å; D612-N616 PolarHBondContact O-ND2 3.15Å
613	A	86.7	Confident	86.8	Confident	47 Å²	47	52.1 Å²	52.1	39%	0.388	27%	0.268	S	S	.	.	H	α-helix	trans	-70.4	-48.9	175.9	0	0	0	0	0	110.1	N610 L615 N616 D617	N610-A613 HydrophobicContact CB-CB 4.48Å; N610-A613 WeakPolarHBondContact O-CA 3.39Å; N610-A613 WeakPolarHBondContact O-CB 3.44Å; N610-A613 PolarHBondContact O-N 3.26Å; A613-L615 PolarHBondContact O-N 3.17Å; A613-N616 PolarHBondContact O-N 2.87Å; A613-D617 PolarHBondContact O-N 3.42Å
614	D	89	Confident	87.8	Confident	10 Å²	10	51.6 Å²	51.6	5%	0.053	26%	0.264	C	S	.	.	H	α-helix	trans	-59.4	-34	-180	-57.8	-37.7	0	0	0	112.3	N610 L618 N619 I622 F688	N610-D614 VanDerWaalsContact C-OD2 3.3Å; N610-D614 WeakPolarHBondContact CB-OD2 3.44Å; N610-D614 PolarHBondContact O-N 2.95Å; D614-L618 WeakPolarHBondContact O-CA 3.4Å; D614-L618 PolarHBondContact O-N 3.45Å; D614-L618 VanDerWaalsContact O-N 3.13Å; D614-N619 HydrophobicContact CB-CB 4.16Å; D614-N619 PolarHBondContact O-N 3.11Å; D614-N619 PolarHBondContact OD1-ND2 3.01Å; D614-I622 HydrophobicContact CB-CG2 3.94Å; D614-F688 HydrophobicContact CB-CE2 3.84Å; D614-F688 HydrophobicContact CB-CZ 3.57Å
615	L	86.9	Confident	88.3	Confident	29 Å²	29	51.7 Å²	51.7	15%	0.152	26%	0.264	C	S	.	.	H	α-helix	trans	-69.9	-35.7	172.4	-115.5	60.4	0	0	0	113.7	R611 A613 F688 D691	R611-L615 WeakPolarHBondContact O-CB 3.5Å; R611-L615 PolarHBondContact O-N 2.91Å; A613-L615 PolarHBondContact O-N 3.17Å; L615-F688 HydrophobicContact CD1-CD1 4.26Å; L615-F688 HydrophobicContact CD1-CD2 3.66Å; L615-F688 HydrophobicContact CD1-CE1 3.95Å; L615-F688 HydrophobicContact CD1-CE2 3.31Å; L615-F688 HydrophobicContact CD1-CG 4.13Å; L615-F688 HydrophobicContact CD1-CZ 3.47Å; L615-F688 VanDerWaalsContact CD1-CZ 3.47Å; L615-D691 HydrophobicContact CD1-CB 4.34Å; L615-D691 HydrophobicContact CD2-CB 4.11Å; L615-D691 HydrophobicContact CG-CB 4.47Å
616	N	86.2	Confident	88.7	Confident	82 Å²	82	48 Å²	48	44%	0.439	25%	0.25	S	C	.	.	H	α-helix	trans	-82	-40.9	-175.9	-83.4	-64.3	0	0	0	112.1	D612 A613 L618 R695	D612-N616 PolarHBondContact O-N 3.18Å; D612-N616 PolarHBondContact O-ND2 3.15Å; A613-N616 PolarHBondContact O-N 2.87Å; N616-L618 VanDerWaalsContact C-N 3.26Å; N616-R695 PolarHBondContact OD1-NH2 2.94Å
617	D	88.3	Confident	88.6	Confident	116 Å²	116	51.3 Å²	51.3	62%	0.62	26%	0.262	S	S	*	.	H	α-helix	trans	-80.8	-10	176.9	-60.8	-30.2	0	0	0	112.1	A613 N619	A613-D617 PolarHBondContact O-N 3.42Å; D617-N619 VanDerWaalsContact C-N 3.34Å
618	L	88	Confident	88.4	Confident	49 Å²	49	50.2 Å²	50.2	26%	0.257	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	36.2	179.9	-58.3	164.2	0	0	0	113.2	D614 N616 R692 R695 L696 I699	D614-L618 WeakPolarHBondContact O-CA 3.4Å; D614-L618 PolarHBondContact O-N 3.45Å; D614-L618 VanDerWaalsContact O-N 3.13Å; N616-L618 VanDerWaalsContact C-N 3.26Å; L618-R692 HydrophobicContact CD2-CG 3.81Å; L618-R695 HydrophobicContact CD2-CB 4.22Å; L618-R695 HydrophobicContact CD2-CG 4.11Å; L618-L696 HydrophobicContact CD1-CD2 3.71Å; L618-L696 HydrophobicContact CD1-CG 4.41Å; L618-L696 HydrophobicContact CD2-CD2 4.27Å; L618-L696 HydrophobicContact CD2-CG 4.08Å; L618-I699 HydrophobicContact CD1-CD1 4.12Å
619	N	88.3	Confident	87.7	Confident	59 Å²	59	55 Å²	55	32%	0.316	28%	0.275	S	S	.	.			trans	-57.2	143.2	-178.3	-68.9	-21.6	0	0	0	111.9	D614 D617	D614-N619 HydrophobicContact CB-CB 4.16Å; D614-N619 PolarHBondContact O-N 3.11Å; D614-N619 PolarHBondContact OD1-ND2 3.01Å; D617-N619 VanDerWaalsContact C-N 3.34Å
620	V	90.7	Very high	87	Confident	50 Å²	50	53.5 Å²	53.5	30%	0.303	27%	0.272	S	S	.	.	S	Bend	trans	-92.7	-39.9	175.1	-173.3	0	0	0	0	110.8	D650 I651 E652	V620-D650 WeakPolarHBondContact CG1-OD1 3.49Å; V620-I651 HydrophobicContact CG1-CB 4.4Å; V620-I651 VanDerWaalsContact O-CB 3.27Å; V620-I651 WeakPolarHBondContact O-CB 3.45Å; V620-I651 WeakPolarHBondContact O-CD1 3.44Å; V620-I651 WeakPolarHBondContact O-CG1 3.3Å; V620-I651 PolarHBondContact O-N 2.79Å; V620-E652 HydrophobicContact CG1-CB 4.01Å; V620-E652 HydrophobicContact CG1-CG 3.95Å
621	E	92.5	Very high	86.3	Confident	119 Å²	119	55.9 Å²	55.9	56%	0.556	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.5	169.9	-171	-170.7	162.4	0	0	109.7	A648	E621-A648 HydrophobicContact CG-CB 4.1Å; E621-A648 VanDerWaalsContact OE1-CB 3.3Å; E621-A648 WeakPolarHBondContact OE1-CB 3.39Å
622	I	92.8	Very high	85.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143.1	176.7	53.2	167.7	0	0	0	112.4	I608 D614 M624 A648 F649 I651 F688	I608-I622 HydrophobicContact CD1-CD1 3.9Å; I608-I622 HydrophobicContact CG1-CD1 4.33Å; I608-I622 HydrophobicContact CG2-CB 4.29Å; I608-I622 HydrophobicContact CG2-CD1 4.49Å; D614-I622 HydrophobicContact CB-CG2 3.94Å; I622-M624 HydrophobicContact CD1-CG 4.18Å; I622-M624 HydrophobicContact CD1-SD 4.23Å; I622-M624 HydrophobicContact CG1-CG 4.27Å; I622-A648 CarbonylContact O-C 3.39Å; I622-A648 WeakPolarHBondContact O-CA 3.19Å; I622-F649 HydrophobicContact CG1-CB 4.2Å; I622-F649 WeakPolarHBondContact CG1-O 3.45Å; I622-F649 PolarHBondContact N-O 3.31Å; I622-F649 PolarHBondContact O-N 2.92Å; I622-I651 HydrophobicContact CB-CD1 4.48Å; I622-I651 HydrophobicContact CD1-CD1 4.17Å; I622-I651 HydrophobicContact CD1-CG1 4.02Å; I622-I651 HydrophobicContact CG1-CD1 4.14Å; I622-I651 HydrophobicContact CG1-CG1 4Å; I622-I651 HydrophobicContact CG2-CD1 3.61Å; I622-I651 HydrophobicContact CG2-CG1 4.39Å; I622-F688 HydrophobicContact CD1-CD2 4.45Å; I622-F688 HydrophobicContact CD1-CG 4.37Å; I622-F688 HydrophobicContact CG2-CD2 4.42Å; I622-F688 HydrophobicContact CG2-CE1 3.98Å; I622-F688 HydrophobicContact CG2-CE2 3.86Å; I622-F688 HydrophobicContact CG2-CZ 3.62Å
623	Q	92.9	Very high	85.2	Confident	79 Å²	79	59.5 Å²	59.5	37%	0.369	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	110.5	177.5	-65.4	-170.4	5.9	0	0	111.1	K609	K609-Q623 HydrophobicContact CB-CB 4.42Å; K609-Q623 PolarHBondContact N-O 2.97Å
624	M	92.1	Very high	84.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	155.4	-179.6	-56.9	-169.1	81.5	0	0	111.6	V606 E607 I608 I622 Q646 F647 F649 I681 K684 V685	V606-M624 HydrophobicContact CG1-CE 3.67Å; E607-M624 CarbonylContact O-C 3.58Å; E607-M624 WeakPolarHBondContact O-CA 3.27Å; I608-M624 HydrophobicContact CG1-CE 4.16Å; I608-M624 HydrophobicContact CG1-CG 4.37Å; I622-M624 HydrophobicContact CD1-CG 4.18Å; I622-M624 HydrophobicContact CD1-SD 4.23Å; I622-M624 HydrophobicContact CG1-CG 4.27Å; M624-Q646 WeakPolarHBondContact O-CA 3.42Å; M624-F647 HydrophobicContact CB-CD1 4.15Å; M624-F647 HydrophobicContact CB-CD2 3.95Å; M624-F647 HydrophobicContact CB-CE1 3.71Å; M624-F647 HydrophobicContact CB-CE2 3.49Å; M624-F647 VanDerWaalsContact CB-CE2 3.49Å; M624-F647 HydrophobicContact CB-CG 4.25Å; M624-F647 HydrophobicContact CB-CZ 3.35Å; M624-F647 HydrophobicContact CG-CE2 4.01Å; M624-F647 HydrophobicContact CG-CZ 4.22Å; M624-F647 PolarHBondContact N-O 2.73Å; M624-F647 PolarHBondContact O-N 3.37Å; M624-F647 HydrophobicContact SD-CE2 3.64Å; M624-F647 HydrophobicContact SD-CZ 3.99Å; M624-F649 HydrophobicContact CG-CB 4.08Å; M624-F649 HydrophobicContact SD-CB 3.54Å; M624-F649 VanDerWaalsContact SD-CB 3.54Å; M624-F649 HydrophobicContact SD-CD2 4.19Å; M624-F649 HydrophobicContact SD-CG 3.9Å; M624-I681 HydrophobicContact CE-CG2 4.28Å; M624-I681 HydrophobicContact SD-CG2 4.23Å; M624-K684 HydrophobicContact CE-CB 3.65Å; M624-K684 HydrophobicContact CE-CG 4.27Å; M624-V685 HydrophobicContact CE-CG2 4.39Å; M624-V685 HydrophobicContact SD-CG2 4.34Å
625	Q	90.5	Very high	83.6	Confident	13 Å²	13	68.7 Å²	68.7	6%	0.061	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	117.6	179.4	-169.7	-175.1	6.6	0	0	111.5	V606 E607 K609 R627 E643 L645	V606-Q625 CarbonylContact C-O 3.55Å; V606-Q625 WeakPolarHBondContact CA-O 3.47Å; E607-Q625 PolarHBondContact N-O 3.09Å; E607-Q625 PolarHBondContact O-N 2.91Å; K609-Q625 VanDerWaalsContact CE-CD 3.42Å; K609-Q625 HydrophobicContact CG-CB 4.18Å; Q625-R627 HydrophobicContact CG-CG 4.28Å; Q625-R627 VanDerWaalsContact NE2-NE 3.19Å; Q625-E643 PolarHBondContact NE2-O 3.01Å; Q625-L645 CarbonylContact C-O 3.59Å; Q625-L645 WeakPolarHBondContact CA-O 3.31Å
626	L	89.5	Confident	83	Confident	0 Å²	0	72 Å²	72	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	131.8	171.9	176.4	73.9	0	0	0	110	I604 R605 V606 F639 G644 L645 F647 I669 I677	I604-L626 HydrophobicContact CG2-CD1 3.4Å; I604-L626 HydrophobicContact CG2-CG 4.42Å; R605-L626 WeakPolarHBondContact O-CA 3.49Å; V606-L626 HydrophobicContact CG2-CD1 3.76Å; L626-F639 HydrophobicContact CD2-CE1 4.06Å; L626-F639 HydrophobicContact CD2-CZ 4.4Å; L626-F639 HydrophobicContact CG-CZ 4.38Å; L626-G644 CarbonylContact O-C 3.48Å; L626-G644 WeakPolarHBondContact O-CA 3.35Å; L626-L645 HydrophobicContact CB-CB 4.23Å; L626-L645 HydrophobicContact CD2-CB 4.43Å; L626-L645 HydrophobicContact CD2-CD2 4.17Å; L626-L645 PolarHBondContact N-O 3Å; L626-L645 PolarHBondContact O-N 3.27Å; L626-F647 HydrophobicContact CB-CE1 4.24Å; L626-I669 HydrophobicContact CD2-CD1 3.6Å; L626-I669 HydrophobicContact CD2-CG1 3.97Å; L626-I677 HydrophobicContact CD1-CD1 4.13Å; L626-I677 HydrophobicContact CD1-CG1 4.23Å; L626-I677 HydrophobicContact CD1-CG2 4.05Å; L626-I677 HydrophobicContact CD2-CD1 4.11Å; L626-I677 HydrophobicContact CD2-CG2 4.45Å
627	R	85.3	Confident	82.6	Confident	68 Å²	68	68.7 Å²	68.7	26%	0.257	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	141.7	175.7	-61.4	-169	-166.2	130.3	11.2	111.6	I604 R605 E607 Q625 Y629	I604-R627 CarbonylContact C-O 3.32Å; I604-R627 WeakPolarHBondContact CA-O 3.39Å; R605-R627 PolarHBondContact N-O 3.27Å; R605-R627 PolarHBondContact O-N 3.44Å; E607-R627 IonicContact OE1-CZ 2.69Å; E607-R627 IonicContact OE1-NH1 2.76Å; E607-R627 PolarHBondContact OE1-NH1 3.42Å; E607-R627 IonicContact OE2-CZ 2.63Å; E607-R627 IonicContact OE2-NH1 3.73Å; E607-R627 PolarHBondContact OE2-NH1 3.32Å; E607-R627 IonicContact OE2-NH2 2.7Å; E607-R627 PolarHBondContact OE2-NH2 2.65Å; Q625-R627 HydrophobicContact CG-CG 4.28Å; Q625-R627 VanDerWaalsContact NE2-NE 3.19Å; R627-Y629 HydrophobicContact CB-CD2 4.44Å; R627-Y629 HydrophobicContact CB-CE2 3.83Å; R627-Y629 PolarHBondContact NH1-OH 2.66Å
628	V	82.1	Confident	81.8	Confident	12 Å²	12	72.1 Å²	72.1	7%	0.073	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	110.5	178.2	177.3	0	0	0	0	109.4	G603 I604 K633 R634 Y637 F639	G603-V628 CarbonylContact O-C 3.49Å; G603-V628 WeakPolarHBondContact O-CA 3.5Å; I604-V628 HydrophobicContact CG1-CG2 4.33Å; I604-V628 HydrophobicContact CG2-CG2 4.42Å; V628-K633 HydrophobicContact CG1-CB 3.81Å; V628-R634 HydrophobicContact CB-CG 4.45Å; V628-R634 HydrophobicContact CG1-CG 3.96Å; V628-Y637 HydrophobicContact CG1-CD2 4.27Å; V628-Y637 HydrophobicContact CG1-CE2 4.37Å; V628-Y637 HydrophobicContact CG2-CD1 3.86Å; V628-Y637 HydrophobicContact CG2-CD2 3.81Å; V628-Y637 HydrophobicContact CG2-CE1 3.83Å; V628-Y637 HydrophobicContact CG2-CE2 3.84Å; V628-Y637 HydrophobicContact CG2-CG 3.83Å; V628-F639 HydrophobicContact CG2-CZ 3.86Å
629	Y	75.5	Confident	81	Confident	120 Å²	120	71.3 Å²	71.3	47%	0.471	32%	0.316	S	S	.	.			trans	-87.5	-34.6	-179.1	-71.4	-87.9	0	0	0	112.3	G603 R605 R627 E631 R634	G603-Y629 PolarHBondContact O-N 3.5Å; R605-Y629 HydrophobicContact CB-CD2 4.31Å; R605-Y629 HydrophobicContact CB-CE2 3.89Å; R627-Y629 HydrophobicContact CB-CD2 4.44Å; R627-Y629 HydrophobicContact CB-CE2 3.83Å; R627-Y629 PolarHBondContact NH1-OH 2.66Å; Y629-E631 PolarHBondContact O-N 2.7Å; Y629-R634 PolarHBondContact O-NH2 2.83Å
630	D	73.6	Confident	79.8	Confident	56 Å²	56	74.8 Å²	74.8	30%	0.299	33%	0.328	S	S	.	.			trans	-68.6	113.1	178.7	178.8	13	0	0	0	111.6	G603 K632 K633 R634	G603-D630 PolarHBondContact O-N 3.18Å; D630-K632 PolarHBondContact O-N 2.92Å; D630-K632 WeakPolarHBondContact OD1-CB 3.44Å; D630-K632 PolarHBondContact OD1-N 3.08Å; D630-K633 HydrophobicContact CB-CB 4.22Å; D630-K633 HydrophobicContact CB-CG 4.41Å; D630-K633 PolarHBondContact O-N 2.76Å; D630-R634 PolarHBondContact O-N 3.04Å
631	E	72	Confident	78.2	Confident	130 Å²	130	78.5 Å²	78.5	61%	0.607	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-24	179.3	-164.7	149.9	-86.6	0	0	113.9	Y629 R634	Y629-E631 PolarHBondContact O-N 2.7Å; E631-R634 IonicContact OE1-CZ 2.73Å; E631-R634 IonicContact OE1-NH1 2.68Å; E631-R634 PolarHBondContact OE1-NH1 2.64Å; E631-R634 IonicContact OE1-NH2 3.19Å; E631-R634 PolarHBondContact OE1-NH2 3Å
632	K	72.9	Confident	76.5	Confident	172 Å²	172	80.3 Å²	80.3	75%	0.748	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-43.5	172.5	-61.7	173.5	-177.3	172.3	0	110.9	D630	D630-K632 PolarHBondContact O-N 2.92Å; D630-K632 WeakPolarHBondContact OD1-CB 3.44Å; D630-K632 PolarHBondContact OD1-N 3.08Å
633	K	73	Confident	75.1	Confident	39 Å²	39	85.6 Å²	85.6	17%	0.17	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-34.9	178.8	-77.5	-169	168.8	-161.6	0	113.7	I604 V628 D630 K635 Q636 Y637 D673	I604-K633 HydrophobicContact CD1-CD 4.31Å; I604-K633 HydrophobicContact CG1-CD 4.35Å; V628-K633 HydrophobicContact CG1-CB 3.81Å; D630-K633 HydrophobicContact CB-CB 4.22Å; D630-K633 HydrophobicContact CB-CG 4.41Å; D630-K633 PolarHBondContact O-N 2.76Å; K633-K635 PolarHBondContact O-N 3.04Å; K633-Q636 WeakPolarHBondContact O-CB 3.41Å; K633-Q636 PolarHBondContact O-N 3.25Å; K633-Y637 HydrophobicContact CB-CE2 4.27Å; K633-Y637 WeakPolarHBondContact O-CD2 3.5Å; K633-D673 WeakPolarHBondContact CE-OD2 3.4Å; K633-D673 IonicContact NZ-OD1 2.67Å; K633-D673 PolarHBondContact NZ-OD1 3Å; K633-D673 IonicContact NZ-OD2 2.7Å; K633-D673 PolarHBondContact NZ-OD2 2.84Å
634	R	71.1	Confident	74.4	Confident	64 Å²	64	82.5 Å²	82.5	24%	0.242	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-46	-37.9	-175.8	-73	-171.8	-142.9	130.2	15.1	114	V628 Y629 D630 E631 Q636 Y637	V628-R634 HydrophobicContact CB-CG 4.45Å; V628-R634 HydrophobicContact CG1-CG 3.96Å; Y629-R634 PolarHBondContact O-NH2 2.83Å; D630-R634 PolarHBondContact O-N 3.04Å; E631-R634 IonicContact OE1-CZ 2.73Å; E631-R634 IonicContact OE1-NH1 2.68Å; E631-R634 PolarHBondContact OE1-NH1 2.64Å; E631-R634 IonicContact OE1-NH2 3.19Å; E631-R634 PolarHBondContact OE1-NH2 3Å; R634-Q636 PolarHBondContact O-N 3.12Å; R634-Y637 PolarHBondContact O-N 2.97Å
635	K	71.4	Confident	74.1	Confident	185 Å²	185	83.3 Å²	83.3	80%	0.804	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-65.7	-16.9	180	-62.5	-176.9	-178.9	179.6	0	115.3	K633	K633-K635 PolarHBondContact O-N 3.04Å
636	Q	73.9	Confident	74.1	Confident	100 Å²	100	86.7 Å²	86.7	47%	0.467	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-90.9	-19.1	178.6	-60.3	173.6	-81.6	0	0	112.2	K633 R634 P670	K633-Q636 WeakPolarHBondContact O-CB 3.41Å; K633-Q636 PolarHBondContact O-N 3.25Å; R634-Q636 PolarHBondContact O-N 3.12Å; Q636-P670 HydrophobicContact CB-CB 4.4Å; Q636-P670 HydrophobicContact CB-CG 4.17Å
637	Y	78.7	Confident	74.2	Confident	12 Å²	12	87.9 Å²	87.9	5%	0.047	40%	0.395	C	S	.	.			trans	-94.4	146.3	178.7	-69.1	-101.5	0	0	0	110.2	I604 V628 K633 R634 F639 H668 I669 P670 D673 I677	I604-Y637 VanDerWaalsContact CD1-OH 3.31Å; I604-Y637 WeakPolarHBondContact CD1-OH 3.25Å; V628-Y637 HydrophobicContact CG1-CD2 4.27Å; V628-Y637 HydrophobicContact CG1-CE2 4.37Å; V628-Y637 HydrophobicContact CG2-CD1 3.86Å; V628-Y637 HydrophobicContact CG2-CD2 3.81Å; V628-Y637 HydrophobicContact CG2-CE1 3.83Å; V628-Y637 HydrophobicContact CG2-CE2 3.84Å; V628-Y637 HydrophobicContact CG2-CG 3.83Å; K633-Y637 HydrophobicContact CB-CE2 4.27Å; K633-Y637 WeakPolarHBondContact O-CD2 3.5Å; R634-Y637 PolarHBondContact O-N 2.97Å; Y637-F639 HydrophobicContact CD1-CD1 4.42Å; Y637-F639 AromaticContact CD1-CE1 3.61Å; Y637-F639 HydrophobicContact CD1-CE1 3.61Å; Y637-F639 HydrophobicContact CD1-CZ 4.13Å; Y637-F639 HydrophobicContact CE1-CE1 4.5Å; Y637-F639 HydrophobicContact CG-CE1 4.22Å; Y637-H668 WeakPolarHBondContact CD1-O 3.2Å; Y637-I669 HydrophobicContact CD1-CG1 4.42Å; Y637-I669 HydrophobicContact CE1-CB 4.45Å; Y637-I669 HydrophobicContact CE1-CG1 4.2Å; Y637-I669 HydrophobicContact CE1-CG2 4.31Å; Y637-P670 HydrophobicContact CD2-CG 4.34Å; Y637-P670 HydrophobicContact CE1-CG 4.37Å; Y637-P670 HydrophobicContact CE2-CG 3.83Å; Y637-D673 VanDerWaalsContact OH-CB 3.27Å; Y637-D673 WeakPolarHBondContact OH-CB 3.31Å; Y637-D673 VanDerWaalsContact OH-CG 3.3Å; Y637-D673 PolarHBondContact OH-OD2 2.76Å; Y637-I677 HydrophobicContact CE1-CD1 4.01Å
638	R	70.8	Confident	74.6	Confident	188 Å²	188	86.9 Å²	86.9	71%	0.709	40%	0.401	S	S	*	.			trans	-98.2	-5.9	-174.1	-63.9	-60.7	-169.3	160.5	3.1	115.3	Q667	R638-Q667 VanDerWaalsContact CB-O 3.3Å; R638-Q667 WeakPolarHBondContact CB-O 3.42Å; R638-Q667 WeakPolarHBondContact CG-O 3.23Å
639	F	71.5	Confident	75.2	Confident	32 Å²	32	86.4 Å²	86.4	14%	0.14	40%	0.398	C	S	.	.	S	Bend	trans	-85.7	157.4	176.6	60.2	-102.1	0	0	0	112.5	L626 V628 Y637 L645	L626-F639 HydrophobicContact CD2-CE1 4.06Å; L626-F639 HydrophobicContact CD2-CZ 4.4Å; L626-F639 HydrophobicContact CG-CZ 4.38Å; V628-F639 HydrophobicContact CG2-CZ 3.86Å; Y637-F639 HydrophobicContact CD1-CD1 4.42Å; Y637-F639 AromaticContact CD1-CE1 3.61Å; Y637-F639 HydrophobicContact CD1-CE1 3.61Å; Y637-F639 HydrophobicContact CD1-CZ 4.13Å; Y637-F639 HydrophobicContact CE1-CE1 4.5Å; Y637-F639 HydrophobicContact CG-CE1 4.22Å; F639-L645 HydrophobicContact CD1-CB 3.6Å; F639-L645 HydrophobicContact CE1-CB 3.74Å; F639-L645 HydrophobicContact CG-CB 4.03Å; F639-L645 HydrophobicContact CZ-CB 4.32Å
640	K	63.5	Low	76.1	Confident	132 Å²	132	82.5 Å²	82.5	57%	0.574	39%	0.385	S	S	*	.			trans	-63.6	137.9	-178.1	-67.6	163.1	173.6	176.7	0	111.9	N642 E643 G644	K640-N642 PolarHBondContact O-N 2.71Å; K640-E643 HydrophobicContact CB-CB 4.42Å; K640-E643 VanDerWaalsContact CD-CD 3.43Å; K640-E643 HydrophobicContact CD-CG 4.32Å; K640-E643 WeakPolarHBondContact CD-OE2 3.34Å; K640-E643 WeakPolarHBondContact CE-OE2 3.49Å; K640-E643 IonicContact NZ-OE1 2.83Å; K640-E643 PolarHBondContact NZ-OE1 2.86Å; K640-E643 IonicContact NZ-OE2 3.9Å; K640-E643 PolarHBondContact NZ-OE2 2.72Å; K640-E643 PolarHBondContact O-N 3.48Å; K640-G644 PolarHBondContact O-N 2.75Å
641	E	57.8	Low	77	Confident	128 Å²	128	79.9 Å²	79.9	60%	0.598	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.8	-171.8	-57.8	-172.6	118.3	0	0	115.6
642	N	55.1	Low	77.8	Confident	156 Å²	156	79 Å²	79	83%	0.834	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-15.2	-175.4	-62.9	-41.3	0	0	0	114.8	K640	K640-N642 PolarHBondContact O-N 2.71Å
643	E	64.8	Low	78.7	Confident	111 Å²	111	77 Å²	77	52%	0.519	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-22.7	-172.8	-71.4	173.5	-160.7	0	0	112.6	Q625 K640	Q625-E643 PolarHBondContact NE2-O 3.01Å; K640-E643 HydrophobicContact CB-CB 4.42Å; K640-E643 VanDerWaalsContact CD-CD 3.43Å; K640-E643 HydrophobicContact CD-CG 4.32Å; K640-E643 WeakPolarHBondContact CD-OE2 3.34Å; K640-E643 WeakPolarHBondContact CE-OE2 3.49Å; K640-E643 IonicContact NZ-OE1 2.83Å; K640-E643 PolarHBondContact NZ-OE1 2.86Å; K640-E643 IonicContact NZ-OE2 3.9Å; K640-E643 PolarHBondContact NZ-OE2 2.72Å; K640-E643 PolarHBondContact O-N 3.48Å
644	G	77.5	Confident	79.7	Confident	14 Å²	14	77.8 Å²	77.8	14%	0.144	37%	0.371	C	S	.	.			trans	69.4	171.5	-174.3	0	0	0	0	0	113.1	L626 K640	L626-G644 CarbonylContact O-C 3.48Å; L626-G644 WeakPolarHBondContact O-CA 3.35Å; K640-G644 PolarHBondContact O-N 2.75Å
645	L	86.5	Confident	80.7	Confident	17 Å²	17	76.6 Å²	76.6	9%	0.089	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	110.7	166.8	176.7	68.6	0	0	0	108.3	Q625 L626 F639 M663 H668 I669	Q625-L645 CarbonylContact C-O 3.59Å; Q625-L645 WeakPolarHBondContact CA-O 3.31Å; L626-L645 HydrophobicContact CB-CB 4.23Å; L626-L645 HydrophobicContact CD2-CB 4.43Å; L626-L645 HydrophobicContact CD2-CD2 4.17Å; L626-L645 PolarHBondContact N-O 3Å; L626-L645 PolarHBondContact O-N 3.27Å; F639-L645 HydrophobicContact CD1-CB 3.6Å; F639-L645 HydrophobicContact CE1-CB 3.74Å; F639-L645 HydrophobicContact CG-CB 4.03Å; F639-L645 HydrophobicContact CZ-CB 4.32Å; L645-M663 HydrophobicContact CD2-CB 4.4Å; L645-M663 HydrophobicContact CD2-CE 4.28Å; L645-M663 HydrophobicContact CD2-CG 3.9Å; L645-M663 HydrophobicContact CD2-SD 3.85Å; L645-H668 HydrophobicContact CD1-CB 4.26Å; L645-H668 VanDerWaalsContact CD1-CD2 3.43Å; L645-H668 WeakPolarHBondContact CD1-CD2 3.37Å; L645-H668 HydrophobicContact CD2-CB 3.85Å; L645-I669 HydrophobicContact CD2-CD1 4.43Å; L645-I669 HydrophobicContact CD2-CG1 4.49Å
646	Q	90	Very high	81.8	Confident	84 Å²	84	68.7 Å²	68.7	39%	0.393	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	138.8	170	176	173	-5.5	0	0	110	M624	M624-Q646 WeakPolarHBondContact O-CA 3.42Å
647	F	92.4	Very high	82.7	Confident	26 Å²	26	68.8 Å²	68.8	11%	0.114	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	157.8	176.5	57.4	-77.3	0	0	0	109.9	V606 M624 L626 V659 M663 I681	V606-F647 HydrophobicContact CG1-CZ 4.43Å; M624-F647 HydrophobicContact CB-CD1 4.15Å; M624-F647 HydrophobicContact CB-CD2 3.95Å; M624-F647 HydrophobicContact CB-CE1 3.71Å; M624-F647 HydrophobicContact CB-CE2 3.49Å; M624-F647 VanDerWaalsContact CB-CE2 3.49Å; M624-F647 HydrophobicContact CB-CG 4.25Å; M624-F647 HydrophobicContact CB-CZ 3.35Å; M624-F647 HydrophobicContact CG-CE2 4.01Å; M624-F647 HydrophobicContact CG-CZ 4.22Å; M624-F647 PolarHBondContact N-O 2.73Å; M624-F647 PolarHBondContact O-N 3.37Å; M624-F647 HydrophobicContact SD-CE2 3.64Å; M624-F647 HydrophobicContact SD-CZ 3.99Å; L626-F647 HydrophobicContact CB-CE1 4.24Å; F647-V659 HydrophobicContact CD2-CG1 3.89Å; F647-V659 HydrophobicContact CE2-CG1 4.01Å; F647-M663 HydrophobicContact CB-CE 3.81Å; F647-M663 HydrophobicContact CD1-CE 3.37Å; F647-M663 HydrophobicContact CD2-CE 3.38Å; F647-M663 HydrophobicContact CE1-CE 3.65Å; F647-M663 HydrophobicContact CE2-CE 3.66Å; F647-M663 HydrophobicContact CG-CE 3.24Å; F647-M663 HydrophobicContact CZ-CE 3.79Å; F647-I681 HydrophobicContact CE2-CD1 3.85Å; F647-I681 HydrophobicContact CE2-CG1 4.38Å; F647-I681 HydrophobicContact CZ-CD1 3.58Å; F647-I681 HydrophobicContact CZ-CG1 3.92Å
648	A	93.1	Very high	83.3	Confident	47 Å²	47	74 Å²	74	39%	0.388	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	156	164.8	0	0	0	0	0	109.5	E621 I622	E621-A648 HydrophobicContact CG-CB 4.1Å; E621-A648 VanDerWaalsContact OE1-CB 3.3Å; E621-A648 WeakPolarHBondContact OE1-CB 3.39Å; I622-A648 CarbonylContact O-C 3.39Å; I622-A648 WeakPolarHBondContact O-CA 3.19Å
649	F	95.1	Very high	84.4	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	121	170.4	-169.5	-76.5	0	0	0	108.6	I622 M624 D654 P656 V659 I681 V685	I622-F649 HydrophobicContact CG1-CB 4.2Å; I622-F649 WeakPolarHBondContact CG1-O 3.45Å; I622-F649 PolarHBondContact N-O 3.31Å; I622-F649 PolarHBondContact O-N 2.92Å; M624-F649 HydrophobicContact CG-CB 4.08Å; M624-F649 HydrophobicContact SD-CB 3.54Å; M624-F649 VanDerWaalsContact SD-CB 3.54Å; M624-F649 HydrophobicContact SD-CD2 4.19Å; M624-F649 HydrophobicContact SD-CG 3.9Å; F649-D654 WeakPolarHBondContact CA-OD2 3.46Å; F649-D654 HydrophobicContact CD1-CB 4.16Å; F649-D654 HydrophobicContact CD2-CB 4.14Å; F649-D654 HydrophobicContact CE1-CB 3.84Å; F649-D654 HydrophobicContact CE2-CB 3.82Å; F649-D654 HydrophobicContact CG-CB 4.29Å; F649-D654 HydrophobicContact CZ-CB 3.66Å; F649-D654 VanDerWaalsContact CZ-O 3.29Å; F649-D654 WeakPolarHBondContact CZ-O 3.39Å; F649-P656 HydrophobicContact CE2-CB 4.46Å; F649-V659 HydrophobicContact CD2-CB 4.33Å; F649-V659 HydrophobicContact CD2-CG1 4.25Å; F649-V659 HydrophobicContact CD2-CG2 3.87Å; F649-V659 HydrophobicContact CE2-CB 4.26Å; F649-V659 HydrophobicContact CE2-CG2 3.83Å; F649-I681 HydrophobicContact CD2-CG2 3.93Å; F649-I681 HydrophobicContact CE2-CG2 3.78Å; F649-V685 HydrophobicContact CD1-CG2 3.67Å; F649-V685 HydrophobicContact CD2-CG2 4.45Å; F649-V685 HydrophobicContact CE1-CB 4.32Å; F649-V685 HydrophobicContact CE1-CG1 3.86Å; F649-V685 HydrophobicContact CE1-CG2 3.51Å; F649-V685 HydrophobicContact CE2-CG2 4.31Å; F649-V685 HydrophobicContact CG-CG2 4.18Å; F649-V685 HydrophobicContact CZ-CG1 4.47Å; F649-V685 HydrophobicContact CZ-CG2 3.85Å
650	D	93.9	Very high	85.4	Confident	38 Å²	38	64 Å²	64	20%	0.203	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	115.8	171.5	-174.2	-48.1	0	0	0	109.8	V620 E652 N653 D654	V620-D650 WeakPolarHBondContact CG1-OD1 3.49Å; D650-E652 PolarHBondContact O-N 2.93Å; D650-E652 VanDerWaalsContact O-N 3.15Å; D650-E652 PolarHBondContact OD1-N 3.31Å; D650-N653 HydrophobicContact CB-CB 4.13Å; D650-N653 VanDerWaalsContact CG-ND2 3.26Å; D650-N653 PolarHBondContact OD1-N 2.98Å; D650-N653 PolarHBondContact OD1-ND2 3.45Å; D650-N653 PolarHBondContact OD2-ND2 3.3Å; D650-D654 HydrophobicContact CB-CB 4.4Å; D650-D654 PolarHBondContact N-OD2 2.89Å; D650-D654 WeakPolarHBondContact O-CB 3.13Å; D650-D654 PolarHBondContact O-N 3.48Å
651	I	91.4	Very high	86.7	Confident	1 Å²	1	62 Å²	62	1%	0.005	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.6	-175.7	-71.3	162.8	0	0	0	113	V620 I622 F688 R689	V620-I651 HydrophobicContact CG1-CB 4.4Å; V620-I651 VanDerWaalsContact O-CB 3.27Å; V620-I651 WeakPolarHBondContact O-CB 3.45Å; V620-I651 WeakPolarHBondContact O-CD1 3.44Å; V620-I651 WeakPolarHBondContact O-CG1 3.3Å; V620-I651 PolarHBondContact O-N 2.79Å; I622-I651 HydrophobicContact CB-CD1 4.48Å; I622-I651 HydrophobicContact CD1-CD1 4.17Å; I622-I651 HydrophobicContact CD1-CG1 4.02Å; I622-I651 HydrophobicContact CG1-CD1 4.14Å; I622-I651 HydrophobicContact CG1-CG1 4Å; I622-I651 HydrophobicContact CG2-CD1 3.61Å; I622-I651 HydrophobicContact CG2-CG1 4.39Å; I651-F688 HydrophobicContact CD1-CD1 3.32Å; I651-F688 HydrophobicContact CD1-CE1 3.29Å; I651-F688 HydrophobicContact CD1-CG 4.29Å; I651-F688 HydrophobicContact CD1-CZ 4.23Å; I651-F688 HydrophobicContact CG1-CD1 4.36Å; I651-R689 HydrophobicContact CG2-CG 3.51Å; I651-R689 PolarHBondContact O-NE 3.01Å; I651-R689 PolarHBondContact O-NH2 3.09Å
652	E	90.4	Very high	88.2	Confident	112 Å²	112	60.6 Å²	60.6	52%	0.523	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-30.8	-174.3	-70.1	175.9	-166.4	0	0	112.6	V620 D650 R692	V620-E652 HydrophobicContact CG1-CB 4.01Å; V620-E652 HydrophobicContact CG1-CG 3.95Å; D650-E652 PolarHBondContact O-N 2.93Å; D650-E652 VanDerWaalsContact O-N 3.15Å; D650-E652 PolarHBondContact OD1-N 3.31Å; E652-R692 IonicContact OE1-CZ 2.61Å; E652-R692 IonicContact OE1-NH1 2.73Å; E652-R692 PolarHBondContact OE1-NH1 2.85Å; E652-R692 IonicContact OE1-NH2 2.7Å; E652-R692 PolarHBondContact OE1-NH2 2.87Å
653	N	91.5	Very high	89.9	Confident	129 Å²	129	53.5 Å²	53.5	69%	0.69	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-30.9	-176.3	-60.8	-65.6	0	0	0	114.7	D650	D650-N653 HydrophobicContact CB-CB 4.13Å; D650-N653 VanDerWaalsContact CG-ND2 3.26Å; D650-N653 PolarHBondContact OD1-N 2.98Å; D650-N653 PolarHBondContact OD1-ND2 3.45Å; D650-N653 PolarHBondContact OD2-ND2 3.3Å
654	D	93.5	Very high	91	Very high	56 Å²	56	49.5 Å²	49.5	30%	0.299	26%	0.261	S	S	.	.			trans	-86.1	141.5	-172.5	-73.4	-21.8	0	0	0	113.8	F649 D650 V659	F649-D654 WeakPolarHBondContact CA-OD2 3.46Å; F649-D654 HydrophobicContact CD1-CB 4.16Å; F649-D654 HydrophobicContact CD2-CB 4.14Å; F649-D654 HydrophobicContact CE1-CB 3.84Å; F649-D654 HydrophobicContact CE2-CB 3.82Å; F649-D654 HydrophobicContact CG-CB 4.29Å; F649-D654 HydrophobicContact CZ-CB 3.66Å; F649-D654 VanDerWaalsContact CZ-O 3.29Å; F649-D654 WeakPolarHBondContact CZ-O 3.39Å; D650-D654 HydrophobicContact CB-CB 4.4Å; D650-D654 PolarHBondContact N-OD2 2.89Å; D650-D654 WeakPolarHBondContact O-CB 3.13Å; D650-D654 PolarHBondContact O-N 3.48Å; D654-V659 HydrophobicContact CB-CG2 3.97Å
655	S	92.8	Very high	91.5	Very high	39 Å²	39	55.2 Å²	55.2	27%	0.273	28%	0.284	S	S	.	.			trans	-96.2	132.6	168.8	176.9	0	0	0	0	110.9	D657 E658 V659	S655-D657 PolarHBondContact O-N 2.96Å; S655-E658 PolarHBondContact O-N 3.4Å; S655-E658 VanDerWaalsContact O-N 3.16Å; S655-V659 WeakPolarHBondContact O-CG2 3.27Å; S655-V659 PolarHBondContact O-N 3.33Å
656	P	93	Very high	91.5	Very high	20 Å²	20	59.7 Å²	59.7	13%	0.13	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-29.6	179.2	27.5	-34.8	0	0	0	112.8	F649 V660 T678 I681 K682	F649-P656 HydrophobicContact CE2-CB 4.46Å; P656-V660 WeakPolarHBondContact O-CG2 3.27Å; P656-V660 PolarHBondContact O-N 2.98Å; P656-T678 HydrophobicContact CB-CG2 4.31Å; P656-I681 HydrophobicContact CB-CB 4.38Å; P656-I681 HydrophobicContact CB-CG2 3.99Å; P656-K682 HydrophobicContact CB-CB 4.21Å; P656-K682 HydrophobicContact CG-CB 4.06Å; P656-K682 HydrophobicContact CG-CD 4.48Å; P656-K682 HydrophobicContact CG-CG 4.48Å
657	D	92.8	Very high	90.9	Very high	101 Å²	101	62.3 Å²	62.3	54%	0.54	32%	0.317	S	S	.	.	H	α-helix	trans	-69	-41	175.5	-65.1	-103.5	0	0	0	111.2	S655 Q661 T678	S655-D657 PolarHBondContact O-N 2.96Å; D657-Q661 WeakPolarHBondContact O-CB 3.28Å; D657-Q661 PolarHBondContact O-N 3.47Å; D657-T678 HydrophobicContact CB-CG2 4.27Å; D657-T678 WeakPolarHBondContact OD1-CG2 3.48Å
658	E	92.7	Very high	90.4	Very high	121 Å²	121	63.8 Å²	63.8	57%	0.565	32%	0.324	S	S	*	.	H	α-helix	trans	-71.9	-40.9	179.6	-65.4	178	-178.9	0	0	112.1	S655 V660 Q661 Q662	S655-E658 PolarHBondContact O-N 3.4Å; S655-E658 VanDerWaalsContact O-N 3.16Å; E658-V660 VanDerWaalsContact C-N 3.33Å; E658-V660 PolarHBondContact O-N 2.73Å; E658-Q661 WeakPolarHBondContact O-CB 3.41Å; E658-Q661 PolarHBondContact O-N 3.01Å; E658-Q662 WeakPolarHBondContact O-CG 3.48Å; E658-Q662 PolarHBondContact O-N 3.29Å
659	V	93.1	Very high	89.9	Confident	11 Å²	11	61.9 Å²	61.9	7%	0.067	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-39.4	176	169.7	0	0	0	0	111.2	F647 F649 D654 S655 M663	F647-V659 HydrophobicContact CD2-CG1 3.89Å; F647-V659 HydrophobicContact CE2-CG1 4.01Å; F649-V659 HydrophobicContact CD2-CB 4.33Å; F649-V659 HydrophobicContact CD2-CG1 4.25Å; F649-V659 HydrophobicContact CD2-CG2 3.87Å; F649-V659 HydrophobicContact CE2-CB 4.26Å; F649-V659 HydrophobicContact CE2-CG2 3.83Å; D654-V659 HydrophobicContact CB-CG2 3.97Å; S655-V659 WeakPolarHBondContact O-CG2 3.27Å; S655-V659 PolarHBondContact O-N 3.33Å; V659-M663 HydrophobicContact CG1-CE 3.56Å; V659-M663 VanDerWaalsContact O-CG 3.3Å; V659-M663 WeakPolarHBondContact O-CG 3.05Å; V659-M663 PolarHBondContact O-N 2.86Å
660	V	92.3	Very high	89.3	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-71.1	-37.6	174.2	176	0	0	0	0	111.9	P656 E658 Q662 M663 I664 T674 I677 I681	P656-V660 WeakPolarHBondContact O-CG2 3.27Å; P656-V660 PolarHBondContact O-N 2.98Å; E658-V660 VanDerWaalsContact C-N 3.33Å; E658-V660 PolarHBondContact O-N 2.73Å; V660-Q662 VanDerWaalsContact C-N 3.31Å; V660-Q662 PolarHBondContact O-N 3.36Å; V660-M663 WeakPolarHBondContact O-CB 3.41Å; V660-M663 PolarHBondContact O-N 2.89Å; V660-M663 VanDerWaalsContact O-N 3.09Å; V660-I664 HydrophobicContact CG1-CD1 4.1Å; V660-I664 WeakPolarHBondContact O-CG1 3.13Å; V660-I664 PolarHBondContact O-N 2.84Å; V660-T674 HydrophobicContact CG1-CG2 3.94Å; V660-I677 HydrophobicContact CG2-CG2 3.99Å; V660-I681 HydrophobicContact CG2-CD1 3.69Å
661	Q	91	Very high	88.9	Confident	89 Å²	89	66.4 Å²	66.4	42%	0.416	33%	0.332	S	S	.	.	H	α-helix	trans	-58.8	-42.3	174.3	-179.1	57.2	36.9	0	0	111.7	D657 E658 M663 I664 E665	D657-Q661 WeakPolarHBondContact O-CB 3.28Å; D657-Q661 PolarHBondContact O-N 3.47Å; E658-Q661 WeakPolarHBondContact O-CB 3.41Å; E658-Q661 PolarHBondContact O-N 3.01Å; Q661-M663 VanDerWaalsContact C-N 3.34Å; Q661-M663 PolarHBondContact O-N 2.89Å; Q661-I664 WeakPolarHBondContact O-CB 3.29Å; Q661-I664 PolarHBondContact O-N 2.81Å; Q661-E665 WeakPolarHBondContact CG-OE1 3.29Å; Q661-E665 PolarHBondContact NE2-OE1 2.86Å; Q661-E665 WeakPolarHBondContact O-CG 3.48Å; Q661-E665 PolarHBondContact O-N 2.84Å
662	Q	90.2	Very high	88.5	Confident	100 Å²	100	72.9 Å²	72.9	47%	0.467	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-37.6	173.4	-68.6	176.2	38.9	0	0	112.7	E658 V660 I664 E665 Q666	E658-Q662 WeakPolarHBondContact O-CG 3.48Å; E658-Q662 PolarHBondContact O-N 3.29Å; V660-Q662 VanDerWaalsContact C-N 3.31Å; V660-Q662 PolarHBondContact O-N 3.36Å; Q662-I664 VanDerWaalsContact C-N 3.32Å; Q662-I664 PolarHBondContact O-N 2.71Å; Q662-E665 PolarHBondContact O-N 2.84Å; Q662-Q666 WeakPolarHBondContact O-CB 3.32Å; Q662-Q666 WeakPolarHBondContact O-CG 3.27Å; Q662-Q666 PolarHBondContact O-N 2.78Å
663	M	89.1	Confident	88.2	Confident	7 Å²	7	68.4 Å²	68.4	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-68.3	-29.3	176.5	-65.9	169.8	-177.3	0	0	113.3	L645 F647 V659 V660 Q661 Q667 H668 I669 I681	L645-M663 HydrophobicContact CD2-CB 4.4Å; L645-M663 HydrophobicContact CD2-CE 4.28Å; L645-M663 HydrophobicContact CD2-CG 3.9Å; L645-M663 HydrophobicContact CD2-SD 3.85Å; F647-M663 HydrophobicContact CB-CE 3.81Å; F647-M663 HydrophobicContact CD1-CE 3.37Å; F647-M663 HydrophobicContact CD2-CE 3.38Å; F647-M663 HydrophobicContact CE1-CE 3.65Å; F647-M663 HydrophobicContact CE2-CE 3.66Å; F647-M663 HydrophobicContact CG-CE 3.24Å; F647-M663 HydrophobicContact CZ-CE 3.79Å; V659-M663 HydrophobicContact CG1-CE 3.56Å; V659-M663 VanDerWaalsContact O-CG 3.3Å; V659-M663 WeakPolarHBondContact O-CG 3.05Å; V659-M663 PolarHBondContact O-N 2.86Å; V660-M663 WeakPolarHBondContact O-CB 3.41Å; V660-M663 PolarHBondContact O-N 2.89Å; V660-M663 VanDerWaalsContact O-N 3.09Å; Q661-M663 VanDerWaalsContact C-N 3.34Å; Q661-M663 PolarHBondContact O-N 2.89Å; M663-Q667 PolarHBondContact O-N 2.86Å; M663-H668 PolarHBondContact O-N 2.86Å; M663-I669 HydrophobicContact CB-CB 4.5Å; M663-I669 HydrophobicContact CB-CD1 3.56Å; M663-I669 HydrophobicContact CB-CG1 4.01Å; M663-I669 HydrophobicContact CG-CD1 4.1Å; M663-I669 PolarHBondContact O-N 3.45Å; M663-I669 HydrophobicContact SD-CD1 3.47Å; M663-I669 WeakPolarHBondContact SD-CD1 3.21Å; M663-I681 HydrophobicContact CE-CD1 4.38Å
664	I	88.6	Confident	88.1	Confident	26 Å²	26	63.9 Å²	63.9	13%	0.133	32%	0.319	C	S	.	.	H	α-helix	trans	-71.8	-45.7	172.6	-67.2	162.9	0	0	0	110	V660 Q661 Q662 Q666 Q667 I669 D671 T674	V660-I664 HydrophobicContact CG1-CD1 4.1Å; V660-I664 WeakPolarHBondContact O-CG1 3.13Å; V660-I664 PolarHBondContact O-N 2.84Å; Q661-I664 WeakPolarHBondContact O-CB 3.29Å; Q661-I664 PolarHBondContact O-N 2.81Å; Q662-I664 VanDerWaalsContact C-N 3.32Å; Q662-I664 PolarHBondContact O-N 2.71Å; I664-Q666 VanDerWaalsContact C-N 3.28Å; I664-Q666 PolarHBondContact O-N 3.42Å; I664-Q667 VanDerWaalsContact O-CA 3.31Å; I664-Q667 WeakPolarHBondContact O-CA 3.07Å; I664-Q667 PolarHBondContact O-N 3.01Å; I664-I669 HydrophobicContact CG1-CB 4.5Å; I664-D671 WeakPolarHBondContact CG2-OD1 3.26Å; I664-T674 HydrophobicContact CD1-CG2 3.74Å; I664-T674 VanDerWaalsContact CD1-OG1 3.24Å; I664-T674 WeakPolarHBondContact CD1-OG1 3.26Å
665	E	88.4	Confident	87.8	Confident	135 Å²	135	71.1 Å²	71.1	63%	0.631	34%	0.342	S	S	*	.	H	α-helix	trans	-62.2	-35	177.2	-72.7	170.3	-163.1	0	0	112.5	Q661 Q662 Q667	Q661-E665 WeakPolarHBondContact CG-OE1 3.29Å; Q661-E665 PolarHBondContact NE2-OE1 2.86Å; Q661-E665 WeakPolarHBondContact O-CG 3.48Å; Q661-E665 PolarHBondContact O-N 2.84Å; Q662-E665 PolarHBondContact O-N 2.84Å; E665-Q667 PolarHBondContact O-N 2.84Å
666	Q	86	Confident	87.4	Confident	110 Å²	110	72.8 Å²	72.8	51%	0.514	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	2	171	-66.6	168.1	16.6	0	0	113.7	Q662 I664 H668	Q662-Q666 WeakPolarHBondContact O-CB 3.32Å; Q662-Q666 WeakPolarHBondContact O-CG 3.27Å; Q662-Q666 PolarHBondContact O-N 2.78Å; I664-Q666 VanDerWaalsContact C-N 3.28Å; I664-Q666 PolarHBondContact O-N 3.42Å; Q666-H668 PolarHBondContact O-N 3.15Å; Q666-H668 PolarHBondContact O-ND1 2.72Å; Q666-H668 PolarHBondContact OE1-CD2 2.87Å
667	Q	78.5	Confident	87.2	Confident	139 Å²	139	71.9 Å²	71.9	65%	0.65	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	27.2	-177	-55.8	-171.8	0.9	0	0	114.4	R638 M663 I664 E665	R638-Q667 VanDerWaalsContact CB-O 3.3Å; R638-Q667 WeakPolarHBondContact CB-O 3.42Å; R638-Q667 WeakPolarHBondContact CG-O 3.23Å; M663-Q667 PolarHBondContact O-N 2.86Å; I664-Q667 VanDerWaalsContact O-CA 3.31Å; I664-Q667 WeakPolarHBondContact O-CA 3.07Å; I664-Q667 PolarHBondContact O-N 3.01Å; E665-Q667 PolarHBondContact O-N 2.84Å
668	H	80.6	Confident	87.2	Confident	57 Å²	57	67.7 Å²	67.7	26%	0.264	32%	0.319	S	S	.	.			trans	-82.2	-25.5	178.8	-68.4	-25.3	0	0	0	113.2	Y637 L645 M663 Q666	Y637-H668 WeakPolarHBondContact CD1-O 3.2Å; L645-H668 HydrophobicContact CD1-CB 4.26Å; L645-H668 VanDerWaalsContact CD1-CD2 3.43Å; L645-H668 WeakPolarHBondContact CD1-CD2 3.37Å; L645-H668 HydrophobicContact CD2-CB 3.85Å; M663-H668 PolarHBondContact O-N 2.86Å; Q666-H668 PolarHBondContact O-N 3.15Å; Q666-H668 PolarHBondContact O-ND1 2.72Å; Q666-H668 PolarHBondContact OE1-CD2 2.87Å
669	I	83.7	Confident	86.9	Confident	8 Å²	8	67.2 Å²	67.2	4%	0.041	32%	0.315	C	S	.	.	S	Bend	trans	-128.9	141	-173	-65	-179.1	0	0	0	110.3	L626 Y637 L645 M663 I664 I677	L626-I669 HydrophobicContact CD2-CD1 3.6Å; L626-I669 HydrophobicContact CD2-CG1 3.97Å; Y637-I669 HydrophobicContact CD1-CG1 4.42Å; Y637-I669 HydrophobicContact CE1-CB 4.45Å; Y637-I669 HydrophobicContact CE1-CG1 4.2Å; Y637-I669 HydrophobicContact CE1-CG2 4.31Å; L645-I669 HydrophobicContact CD2-CD1 4.43Å; L645-I669 HydrophobicContact CD2-CG1 4.49Å; M663-I669 HydrophobicContact CB-CB 4.5Å; M663-I669 HydrophobicContact CB-CD1 3.56Å; M663-I669 HydrophobicContact CB-CG1 4.01Å; M663-I669 HydrophobicContact CG-CD1 4.1Å; M663-I669 PolarHBondContact O-N 3.45Å; M663-I669 HydrophobicContact SD-CD1 3.47Å; M663-I669 WeakPolarHBondContact SD-CD1 3.21Å; I664-I669 HydrophobicContact CG1-CB 4.5Å; I669-I677 HydrophobicContact CD1-CD1 3.9Å; I669-I677 HydrophobicContact CD1-CG2 4.13Å; I669-I677 HydrophobicContact CG1-CD1 4.33Å; I669-I677 HydrophobicContact CG2-CD1 3.75Å
670	P	82.9	Confident	86.7	Confident	17 Å²	17	67.4 Å²	67.4	11%	0.11	32%	0.315	C	S	.	.			trans	-81.8	141.5	172.7	33.5	-34.7	0	0	0	112.9	Q636 Y637 E672 D673	Q636-P670 HydrophobicContact CB-CB 4.4Å; Q636-P670 HydrophobicContact CB-CG 4.17Å; Y637-P670 HydrophobicContact CD2-CG 4.34Å; Y637-P670 HydrophobicContact CE1-CG 4.37Å; Y637-P670 HydrophobicContact CE2-CG 3.83Å; P670-E672 PolarHBondContact O-N 3.42Å; P670-E672 VanDerWaalsContact O-N 3.07Å; P670-D673 HydrophobicContact CG-CB 4.47Å; P670-D673 PolarHBondContact O-N 2.8Å; P670-D673 VanDerWaalsContact O-N 3.11Å
671	D	83.7	Confident	86.6	Confident	116 Å²	116	67.4 Å²	67.4	62%	0.62	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-54.3	-31.1	-173.9	-65.4	-37.8	0	0	0	114.2	I664 D673 T674	I664-D671 WeakPolarHBondContact CG2-OD1 3.26Å; D671-D673 VanDerWaalsContact C-N 3.31Å; D671-D673 PolarHBondContact O-N 3.29Å; D671-T674 WeakPolarHBondContact CA-OG1 3.23Å; D671-T674 WeakPolarHBondContact O-CB 3.49Å; D671-T674 PolarHBondContact O-N 2.75Å; D671-T674 PolarHBondContact O-OG1 2.84Å
672	E	83.4	Confident	86.6	Confident	138 Å²	138	68.3 Å²	68.3	65%	0.645	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-67.5	-29.5	-177.6	-59.1	92.1	158.1	0	0	113.3	P670	P670-E672 PolarHBondContact O-N 3.42Å; P670-E672 VanDerWaalsContact O-N 3.07Å
673	D	84.8	Confident	86.4	Confident	18 Å²	18	65.5 Å²	65.5	10%	0.096	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-92.5	-6.9	-178.3	-85.2	-32.3	0	0	0	113.5	I604 K633 Y637 P670 D671 R675 M676 I677	I604-D673 HydrophobicContact CD1-CB 4.25Å; I604-D673 WeakPolarHBondContact CD1-OD2 3.47Å; K633-D673 WeakPolarHBondContact CE-OD2 3.4Å; K633-D673 IonicContact NZ-OD1 2.67Å; K633-D673 PolarHBondContact NZ-OD1 3Å; K633-D673 IonicContact NZ-OD2 2.7Å; K633-D673 PolarHBondContact NZ-OD2 2.84Å; Y637-D673 VanDerWaalsContact OH-CB 3.27Å; Y637-D673 WeakPolarHBondContact OH-CB 3.31Å; Y637-D673 VanDerWaalsContact OH-CG 3.3Å; Y637-D673 PolarHBondContact OH-OD2 2.76Å; P670-D673 HydrophobicContact CG-CB 4.47Å; P670-D673 PolarHBondContact O-N 2.8Å; P670-D673 VanDerWaalsContact O-N 3.11Å; D671-D673 VanDerWaalsContact C-N 3.31Å; D671-D673 PolarHBondContact O-N 3.29Å; D673-R675 PolarHBondContact O-N 2.84Å; D673-M676 WeakPolarHBondContact O-CA 3.16Å; D673-M676 VanDerWaalsContact O-CB 3.26Å; D673-M676 WeakPolarHBondContact O-CB 3.32Å; D673-M676 PolarHBondContact O-N 3.33Å; D673-I677 HydrophobicContact CB-CD1 4.2Å; D673-I677 PolarHBondContact O-N 3.23Å
674	T	88.5	Confident	86.4	Confident	34 Å²	34	66.8 Å²	66.8	21%	0.209	31%	0.312	C	S	.	.	H	α-helix	trans	-40.2	-60.5	179.3	-57.1	0	0	0	0	113.1	V660 I664 D671 M676 I677 T678	V660-T674 HydrophobicContact CG1-CG2 3.94Å; I664-T674 HydrophobicContact CD1-CG2 3.74Å; I664-T674 VanDerWaalsContact CD1-OG1 3.24Å; I664-T674 WeakPolarHBondContact CD1-OG1 3.26Å; D671-T674 WeakPolarHBondContact CA-OG1 3.23Å; D671-T674 WeakPolarHBondContact O-CB 3.49Å; D671-T674 PolarHBondContact O-N 2.75Å; D671-T674 PolarHBondContact O-OG1 2.84Å; T674-M676 PolarHBondContact O-N 3.21Å; T674-M676 VanDerWaalsContact O-N 3.16Å; T674-I677 PolarHBondContact O-N 3.12Å; T674-I677 VanDerWaalsContact O-N 3.12Å; T674-T678 WeakPolarHBondContact O-CB 3.47Å; T674-T678 PolarHBondContact O-N 3Å; T674-T678 PolarHBondContact O-OG1 3.25Å
675	R	87.2	Confident	86.6	Confident	208 Å²	208	65.8 Å²	65.8	79%	0.785	31%	0.307	S	S	*	.	H	α-helix	trans	-61.1	-28.3	-178.6	-67.2	-174.6	-63.1	-101.9	-8.2	113.6	D673 K679	D673-R675 PolarHBondContact O-N 2.84Å; R675-K679 WeakPolarHBondContact O-CB 3.49Å; R675-K679 PolarHBondContact O-N 3.32Å
676	M	85.2	Confident	86.6	Confident	74 Å²	74	62.2 Å²	62.2	37%	0.365	29%	0.292	S	S	.	.	H	α-helix	trans	-73.5	-46.2	177.1	-169.2	73.4	77	0	0	110.2	I602 D673 T674 K679 L680	I602-M676 HydrophobicContact CD1-SD 4.45Å; I602-M676 HydrophobicContact CG1-SD 4.5Å; I602-M676 HydrophobicContact CG2-CE 4.45Å; I602-M676 HydrophobicContact CG2-CG 3.75Å; I602-M676 HydrophobicContact CG2-SD 4.02Å; D673-M676 WeakPolarHBondContact O-CA 3.16Å; D673-M676 VanDerWaalsContact O-CB 3.26Å; D673-M676 WeakPolarHBondContact O-CB 3.32Å; D673-M676 PolarHBondContact O-N 3.33Å; T674-M676 PolarHBondContact O-N 3.21Å; T674-M676 VanDerWaalsContact O-N 3.16Å; M676-K679 PolarHBondContact O-N 3.43Å; M676-L680 HydrophobicContact CG-CD1 4.46Å; M676-L680 WeakPolarHBondContact O-CG 3.17Å; M676-L680 PolarHBondContact O-N 3.2Å
677	I	88.7	Confident	86.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-74.4	-40	-175.7	-63.3	172.6	0	0	0	111.1	I604 L626 Y637 V660 I669 D673 T674 K679 L680 I681	I604-I677 HydrophobicContact CD1-CD1 4.45Å; I604-I677 HydrophobicContact CD1-CG1 4.44Å; I604-I677 HydrophobicContact CG2-CD1 4.38Å; I604-I677 HydrophobicContact CG2-CG1 4.27Å; L626-I677 HydrophobicContact CD1-CD1 4.13Å; L626-I677 HydrophobicContact CD1-CG1 4.23Å; L626-I677 HydrophobicContact CD1-CG2 4.05Å; L626-I677 HydrophobicContact CD2-CD1 4.11Å; L626-I677 HydrophobicContact CD2-CG2 4.45Å; Y637-I677 HydrophobicContact CE1-CD1 4.01Å; V660-I677 HydrophobicContact CG2-CG2 3.99Å; I669-I677 HydrophobicContact CD1-CD1 3.9Å; I669-I677 HydrophobicContact CD1-CG2 4.13Å; I669-I677 HydrophobicContact CG1-CD1 4.33Å; I669-I677 HydrophobicContact CG2-CD1 3.75Å; D673-I677 HydrophobicContact CB-CD1 4.2Å; D673-I677 PolarHBondContact O-N 3.23Å; T674-I677 PolarHBondContact O-N 3.12Å; T674-I677 VanDerWaalsContact O-N 3.12Å; I677-K679 PolarHBondContact O-N 3.25Å; I677-L680 PolarHBondContact O-N 3.35Å; I677-L680 VanDerWaalsContact O-N 3.1Å; I677-I681 HydrophobicContact CG2-CD1 3.98Å; I677-I681 HydrophobicContact CG2-CG1 4.32Å; I677-I681 WeakPolarHBondContact O-CG1 3.29Å; I677-I681 PolarHBondContact O-N 3.46Å
678	T	91.7	Very high	87.2	Confident	14 Å²	14	51.1 Å²	51.1	9%	0.086	24%	0.242	C	C	.	.	H	α-helix	trans	-54.3	-44.4	170.8	-55.9	0	0	0	0	110.9	P656 D657 T674 K682	P656-T678 HydrophobicContact CB-CG2 4.31Å; D657-T678 HydrophobicContact CB-CG2 4.27Å; D657-T678 WeakPolarHBondContact OD1-CG2 3.48Å; T674-T678 WeakPolarHBondContact O-CB 3.47Å; T674-T678 PolarHBondContact O-N 3Å; T674-T678 PolarHBondContact O-OG1 3.25Å; T678-K682 WeakPolarHBondContact O-CB 3.47Å; T678-K682 PolarHBondContact O-N 3.13Å
679	K	88.2	Confident	87.6	Confident	111 Å²	111	52.7 Å²	52.7	48%	0.483	25%	0.246	S	C	.	.	H	α-helix	trans	-64.6	-45.1	175.4	-172.5	-176	-179.4	-70.3	0	112.2	R675 M676 I677 I681 K682 D683	R675-K679 WeakPolarHBondContact O-CB 3.49Å; R675-K679 PolarHBondContact O-N 3.32Å; M676-K679 PolarHBondContact O-N 3.43Å; I677-K679 PolarHBondContact O-N 3.25Å; K679-I681 PolarHBondContact O-N 3.41Å; K679-K682 PolarHBondContact O-N 2.95Å; K679-D683 IonicContact NZ-OD1 2.66Å; K679-D683 IonicContact NZ-OD2 3.79Å; K679-D683 PolarHBondContact NZ-OD2 3.36Å; K679-D683 WeakPolarHBondContact O-CB 3.48Å; K679-D683 VanDerWaalsContact O-CG 3.23Å; K679-D683 PolarHBondContact O-N 3.06Å
680	L	87.9	Confident	87.8	Confident	14 Å²	14	56.8 Å²	56.8	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-41.8	178.5	-72	171.1	0	0	0	112.2	I602 I604 V606 M676 I677 K684	I602-L680 HydrophobicContact CG2-CD1 4.32Å; I604-L680 HydrophobicContact CB-CD1 4.47Å; I604-L680 HydrophobicContact CG2-CD1 4.3Å; V606-L680 HydrophobicContact CB-CB 4.35Å; V606-L680 HydrophobicContact CG2-CB 3.72Å; V606-L680 HydrophobicContact CG2-CD1 4.33Å; M676-L680 HydrophobicContact CG-CD1 4.46Å; M676-L680 WeakPolarHBondContact O-CG 3.17Å; M676-L680 PolarHBondContact O-N 3.2Å; I677-L680 PolarHBondContact O-N 3.35Å; I677-L680 VanDerWaalsContact O-N 3.1Å; L680-K684 WeakPolarHBondContact O-CG 3.22Å; L680-K684 PolarHBondContact O-N 3.27Å; L680-K684 VanDerWaalsContact O-N 3.12Å
681	I	90.9	Very high	88	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-47.3	175.9	-66.6	175.9	0	0	0	109.7	V606 M624 F647 F649 P656 V660 M663 I677 K679 K684 V685	V606-I681 HydrophobicContact CG1-CG1 4.34Å; V606-I681 HydrophobicContact CG2-CG1 4.23Å; M624-I681 HydrophobicContact CE-CG2 4.28Å; M624-I681 HydrophobicContact SD-CG2 4.23Å; F647-I681 HydrophobicContact CE2-CD1 3.85Å; F647-I681 HydrophobicContact CE2-CG1 4.38Å; F647-I681 HydrophobicContact CZ-CD1 3.58Å; F647-I681 HydrophobicContact CZ-CG1 3.92Å; F649-I681 HydrophobicContact CD2-CG2 3.93Å; F649-I681 HydrophobicContact CE2-CG2 3.78Å; P656-I681 HydrophobicContact CB-CB 4.38Å; P656-I681 HydrophobicContact CB-CG2 3.99Å; V660-I681 HydrophobicContact CG2-CD1 3.69Å; M663-I681 HydrophobicContact CE-CD1 4.38Å; I677-I681 HydrophobicContact CG2-CD1 3.98Å; I677-I681 HydrophobicContact CG2-CG1 4.32Å; I677-I681 WeakPolarHBondContact O-CG1 3.29Å; I677-I681 PolarHBondContact O-N 3.46Å; K679-I681 PolarHBondContact O-N 3.41Å; I681-K684 WeakPolarHBondContact O-CB 3.04Å; I681-K684 PolarHBondContact O-N 2.93Å; I681-V685 HydrophobicContact CG2-CG2 4.3Å; I681-V685 WeakPolarHBondContact O-CG2 3.3Å; I681-V685 PolarHBondContact O-N 3.1Å
682	K	90.8	Very high	88.3	Confident	109 Å²	109	52.3 Å²	52.3	47%	0.474	23%	0.234	S	C	.	.	H	α-helix	trans	-58.7	-50.3	176.5	-177.9	166.6	-177.4	163.6	0	112.8	P656 T678 K679 K684 V685 D686	P656-K682 HydrophobicContact CB-CB 4.21Å; P656-K682 HydrophobicContact CG-CB 4.06Å; P656-K682 HydrophobicContact CG-CD 4.48Å; P656-K682 HydrophobicContact CG-CG 4.48Å; T678-K682 WeakPolarHBondContact O-CB 3.47Å; T678-K682 PolarHBondContact O-N 3.13Å; K679-K682 PolarHBondContact O-N 2.95Å; K682-K684 PolarHBondContact O-N 3.02Å; K682-V685 PolarHBondContact O-N 2.89Å; K682-V685 VanDerWaalsContact O-N 3.15Å; K682-D686 WeakPolarHBondContact CE-OD2 3.47Å; K682-D686 WeakPolarHBondContact CG-OD2 3.44Å; K682-D686 WeakPolarHBondContact O-CB 3.46Å; K682-D686 PolarHBondContact O-N 3.37Å
683	D	86.6	Confident	88.6	Confident	40 Å²	40	49.2 Å²	49.2	21%	0.214	22%	0.222	C	C	.	.	H	α-helix	trans	-57.9	-33	178.4	-71	-22.7	0	0	0	111.4	K679 A687	K679-D683 IonicContact NZ-OD1 2.66Å; K679-D683 IonicContact NZ-OD2 3.79Å; K679-D683 PolarHBondContact NZ-OD2 3.36Å; K679-D683 WeakPolarHBondContact O-CB 3.48Å; K679-D683 VanDerWaalsContact O-CG 3.23Å; K679-D683 PolarHBondContact O-N 3.06Å; D683-A687 WeakPolarHBondContact O-CB 3.41Å; D683-A687 PolarHBondContact O-N 3.34Å
684	K	88.6	Confident	88.7	Confident	35 Å²	35	49.4 Å²	49.4	15%	0.152	22%	0.222	C	C	.	.	H	α-helix	trans	-72.6	-47	172.9	-75.7	-49.8	-166.9	-162.9	0	113.9	D594 V606 I608 M624 L680 I681 K682 A687 F688	D594-K684 WeakPolarHBondContact OD1-CE 3.31Å; D594-K684 IonicContact OD1-NZ 3.09Å; D594-K684 PolarHBondContact OD1-NZ 3.15Å; D594-K684 WeakPolarHBondContact OD2-CE 3.45Å; D594-K684 IonicContact OD2-NZ 2.77Å; D594-K684 PolarHBondContact OD2-NZ 2.71Å; V606-K684 HydrophobicContact CB-CG 4.3Å; V606-K684 HydrophobicContact CG1-CG 4.14Å; V606-K684 WeakPolarHBondContact O-CE 3.44Å; I608-K684 HydrophobicContact CD1-CB 4.48Å; M624-K684 HydrophobicContact CE-CB 3.65Å; M624-K684 HydrophobicContact CE-CG 4.27Å; L680-K684 WeakPolarHBondContact O-CG 3.22Å; L680-K684 PolarHBondContact O-N 3.27Å; L680-K684 VanDerWaalsContact O-N 3.12Å; I681-K684 WeakPolarHBondContact O-CB 3.04Å; I681-K684 PolarHBondContact O-N 2.93Å; K682-K684 PolarHBondContact O-N 3.02Å; K684-A687 WeakPolarHBondContact O-CB 3.41Å; K684-A687 PolarHBondContact O-N 2.89Å; K684-F688 PolarHBondContact O-N 3.16Å
685	V	91.7	Very high	88.7	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.03	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-44	179.6	173.4	0	0	0	0	110.2	M624 F649 I681 K682 A687 F688 R689	M624-V685 HydrophobicContact CE-CG2 4.39Å; M624-V685 HydrophobicContact SD-CG2 4.34Å; F649-V685 HydrophobicContact CD1-CG2 3.67Å; F649-V685 HydrophobicContact CD2-CG2 4.45Å; F649-V685 HydrophobicContact CE1-CB 4.32Å; F649-V685 HydrophobicContact CE1-CG1 3.86Å; F649-V685 HydrophobicContact CE1-CG2 3.51Å; F649-V685 HydrophobicContact CE2-CG2 4.31Å; F649-V685 HydrophobicContact CG-CG2 4.18Å; F649-V685 HydrophobicContact CZ-CG1 4.47Å; F649-V685 HydrophobicContact CZ-CG2 3.85Å; I681-V685 HydrophobicContact CG2-CG2 4.3Å; I681-V685 WeakPolarHBondContact O-CG2 3.3Å; I681-V685 PolarHBondContact O-N 3.1Å; K682-V685 PolarHBondContact O-N 2.89Å; K682-V685 VanDerWaalsContact O-N 3.15Å; V685-A687 PolarHBondContact O-N 3.38Å; V685-F688 PolarHBondContact O-N 2.73Å; V685-F688 VanDerWaalsContact O-N 3.16Å; V685-R689 HydrophobicContact CG1-CG 4.31Å; V685-R689 WeakPolarHBondContact O-CB 3.36Å; V685-R689 WeakPolarHBondContact O-CG 3.47Å; V685-R689 PolarHBondContact O-N 2.66Å
686	D	89.4	Confident	88.8	Confident	60 Å²	60	45.5 Å²	45.5	32%	0.321	21%	0.209	S	C	.	.	H	α-helix	trans	-64.8	-23.9	174.9	-73.7	-19.4	0	0	0	112.5	K682 R690	K682-D686 WeakPolarHBondContact CE-OD2 3.47Å; K682-D686 WeakPolarHBondContact CG-OD2 3.44Å; K682-D686 WeakPolarHBondContact O-CB 3.46Å; K682-D686 PolarHBondContact O-N 3.37Å; D686-R690 WeakPolarHBondContact O-CG 3.39Å; D686-R690 PolarHBondContact O-NE 3.26Å; D686-R690 PolarHBondContact O-NH2 3.43Å
687	A	86	Confident	89	Confident	15 Å²	15	46.4 Å²	46.4	12%	0.124	22%	0.215	C	C	.	.	H	α-helix	trans	-79	-43.8	169.8	0	0	0	0	0	112.6	D683 K684 V685 D691	D683-A687 WeakPolarHBondContact O-CB 3.41Å; D683-A687 PolarHBondContact O-N 3.34Å; K684-A687 WeakPolarHBondContact O-CB 3.41Å; K684-A687 PolarHBondContact O-N 2.89Å; V685-A687 PolarHBondContact O-N 3.38Å; A687-D691 PolarHBondContact O-N 2.85Å
688	F	90.3	Very high	88.8	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-46.8	179.3	-168.5	-76	0	0	0	111.8	I608 R611 D614 L615 I622 I651 K684 V685 R690 D691 R692	I608-F688 HydrophobicContact CD1-CB 4.04Å; I608-F688 HydrophobicContact CD1-CD2 3.68Å; I608-F688 HydrophobicContact CD1-CG 4.24Å; I608-F688 HydrophobicContact CG2-CD2 4.47Å; I608-F688 HydrophobicContact CG2-CE2 4.45Å; R611-F688 HydrophobicContact CG-CD2 4.45Å; R611-F688 HydrophobicContact CG-CE2 4.42Å; D614-F688 HydrophobicContact CB-CE2 3.84Å; D614-F688 HydrophobicContact CB-CZ 3.57Å; L615-F688 HydrophobicContact CD1-CD1 4.26Å; L615-F688 HydrophobicContact CD1-CD2 3.66Å; L615-F688 HydrophobicContact CD1-CE1 3.95Å; L615-F688 HydrophobicContact CD1-CE2 3.31Å; L615-F688 HydrophobicContact CD1-CG 4.13Å; L615-F688 HydrophobicContact CD1-CZ 3.47Å; L615-F688 VanDerWaalsContact CD1-CZ 3.47Å; I622-F688 HydrophobicContact CD1-CD2 4.45Å; I622-F688 HydrophobicContact CD1-CG 4.37Å; I622-F688 HydrophobicContact CG2-CD2 4.42Å; I622-F688 HydrophobicContact CG2-CE1 3.98Å; I622-F688 HydrophobicContact CG2-CE2 3.86Å; I622-F688 HydrophobicContact CG2-CZ 3.62Å; I651-F688 HydrophobicContact CD1-CD1 3.32Å; I651-F688 HydrophobicContact CD1-CE1 3.29Å; I651-F688 HydrophobicContact CD1-CG 4.29Å; I651-F688 HydrophobicContact CD1-CZ 4.23Å; I651-F688 HydrophobicContact CG1-CD1 4.36Å; K684-F688 PolarHBondContact O-N 3.16Å; V685-F688 PolarHBondContact O-N 2.73Å; V685-F688 VanDerWaalsContact O-N 3.16Å; F688-R690 PolarHBondContact O-N 3.05Å; F688-D691 PolarHBondContact O-N 3.21Å; F688-D691 VanDerWaalsContact O-N 3.13Å; F688-R692 HydrophobicContact CD1-CB 4.46Å; F688-R692 HydrophobicContact CE1-CB 4.35Å; F688-R692 PolarHBondContact O-N 2.85Å
689	R	90.5	Very high	88.7	Confident	91 Å²	91	52 Å²	52	34%	0.343	24%	0.241	S	C	.	.	H	α-helix	trans	-50.1	-53	175.4	-75.8	178.9	177.3	-175.2	3.8	111.3	I651 V685 D691 R692 D693	I651-R689 HydrophobicContact CG2-CG 3.51Å; I651-R689 PolarHBondContact O-NE 3.01Å; I651-R689 PolarHBondContact O-NH2 3.09Å; V685-R689 HydrophobicContact CG1-CG 4.31Å; V685-R689 WeakPolarHBondContact O-CB 3.36Å; V685-R689 WeakPolarHBondContact O-CG 3.47Å; V685-R689 PolarHBondContact O-N 2.66Å; R689-D691 VanDerWaalsContact C-N 3.34Å; R689-D691 PolarHBondContact O-N 2.82Å; R689-R692 WeakPolarHBondContact O-CB 3.21Å; R689-R692 PolarHBondContact O-N 2.96Å; R689-D693 PolarHBondContact O-N 2.94Å
690	R	87.2	Confident	88.8	Confident	93 Å²	93	52.4 Å²	52.4	35%	0.351	24%	0.243	S	C	.	.	H	α-helix	trans	-60.1	-36.9	179.2	-76.3	-178.9	-71.7	132.8	-1.1	114.4	D686 F688 H694	D686-R690 WeakPolarHBondContact O-CG 3.39Å; D686-R690 PolarHBondContact O-NE 3.26Å; D686-R690 PolarHBondContact O-NH2 3.43Å; F688-R690 PolarHBondContact O-N 3.05Å; R690-H694 WeakPolarHBondContact O-CB 3.4Å; R690-H694 PolarHBondContact O-N 2.9Å; R690-H694 VanDerWaalsContact O-N 3.07Å
691	D	87.3	Confident	88.6	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.053	25%	0.249	C	C	.	.	H	α-helix	trans	-78	-32.2	178.1	-73.7	-39.7	0	0	0	111.9	R575 R578 R611 L615 A687 F688 R689 R695	R575-D691 WeakPolarHBondContact CD-OD1 3.44Å; R575-D691 WeakPolarHBondContact CD-OD2 3.26Å; R575-D691 IonicContact NH1-OD2 2.85Å; R575-D691 PolarHBondContact NH1-OD2 3.27Å; R578-D691 IonicContact CZ-OD1 2.71Å; R578-D691 IonicContact NH1-OD1 2.8Å; R578-D691 IonicContact NH2-OD1 2.79Å; R578-D691 PolarHBondContact NH2-OD1 3.45Å; R611-D691 IonicContact CZ-OD2 3.98Å; R611-D691 IonicContact NH1-OD2 3.64Å; R611-D691 IonicContact NH2-OD2 2.79Å; R611-D691 PolarHBondContact NH2-OD2 2.79Å; L615-D691 HydrophobicContact CD1-CB 4.34Å; L615-D691 HydrophobicContact CD2-CB 4.11Å; L615-D691 HydrophobicContact CG-CB 4.47Å; A687-D691 PolarHBondContact O-N 2.85Å; F688-D691 PolarHBondContact O-N 3.21Å; F688-D691 VanDerWaalsContact O-N 3.13Å; R689-D691 VanDerWaalsContact C-N 3.34Å; R689-D691 PolarHBondContact O-N 2.82Å; D691-R695 PolarHBondContact O-N 2.82Å
692	R	90.6	Very high	88.4	Confident	30 Å²	30	57 Å²	57	11%	0.113	27%	0.272	C	S	.	.	H	α-helix	trans	-62.2	-46.4	168.7	-169.7	-173.7	76.1	157.8	4	111.4	L618 E652 F688 R689 H694 R695 L696	L618-R692 HydrophobicContact CD2-CG 3.81Å; E652-R692 IonicContact OE1-CZ 2.61Å; E652-R692 IonicContact OE1-NH1 2.73Å; E652-R692 PolarHBondContact OE1-NH1 2.85Å; E652-R692 IonicContact OE1-NH2 2.7Å; E652-R692 PolarHBondContact OE1-NH2 2.87Å; F688-R692 HydrophobicContact CD1-CB 4.46Å; F688-R692 HydrophobicContact CE1-CB 4.35Å; F688-R692 PolarHBondContact O-N 2.85Å; R689-R692 WeakPolarHBondContact O-CB 3.21Å; R689-R692 PolarHBondContact O-N 2.96Å; R692-H694 PolarHBondContact O-N 3.21Å; R692-R695 WeakPolarHBondContact O-CB 3.47Å; R692-R695 PolarHBondContact O-N 3Å; R692-L696 HydrophobicContact CG-CD1 4.49Å; R692-L696 WeakPolarHBondContact O-CG 3.39Å; R692-L696 PolarHBondContact O-N 3.29Å
693	D	89.8	Confident	88.4	Confident	73 Å²	73	58.3 Å²	58.3	39%	0.39	28%	0.278	S	S	.	.	H	α-helix	trans	-65.6	-38	179.4	-61	-22.1	0	0	0	111.6	R689 L696 L697	R689-D693 PolarHBondContact O-N 2.94Å; D693-L696 PolarHBondContact O-N 2.7Å; D693-L697 WeakPolarHBondContact O-CB 2.9Å; D693-L697 WeakPolarHBondContact O-CG 3.33Å; D693-L697 PolarHBondContact O-N 2.67Å
694	H	86.3	Confident	88.4	Confident	21 Å²	21	60.5 Å²	60.5	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-61.4	-44.2	171.4	179.6	-101.9	0	0	0	111.9	R578 E583 R690 R692 L696 L697 E698	R578-H694 VanDerWaalsContact CZ-CG 3.41Å; R578-H694 VanDerWaalsContact CZ-ND1 3.32Å; R578-H694 PolarHBondContact NE-CE1 3.46Å; R578-H694 VanDerWaalsContact NE-CE1 3.34Å; R578-H694 PolarHBondContact NE-ND1 3.13Å; R578-H694 PolarHBondContact NH2-ND1 3.1Å; E583-H694 VanDerWaalsContact CD-NE2 3.28Å; E583-H694 IonicContact OE1-NE2 2.67Å; E583-H694 IonicContact OE2-CD2 2.72Å; E583-H694 IonicContact OE2-CE1 2.61Å; E583-H694 IonicContact OE2-NE2 3.7Å; E583-H694 PolarHBondContact OE2-NE2 2.91Å; R690-H694 WeakPolarHBondContact O-CB 3.4Å; R690-H694 PolarHBondContact O-N 2.9Å; R690-H694 VanDerWaalsContact O-N 3.07Å; R692-H694 PolarHBondContact O-N 3.21Å; H694-L696 PolarHBondContact O-N 3.16Å; H694-L697 WeakPolarHBondContact O-CB 3.32Å; H694-L697 PolarHBondContact O-N 2.85Å; H694-E698 PolarHBondContact O-N 2.91Å
695	R	87.9	Confident	88.1	Confident	82 Å²	82	63.9 Å²	63.9	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-64.4	-39.5	177.6	-170.7	56.5	160.3	168.1	-2.8	112.2	N616 L618 D691 R692 E698 I699	N616-R695 PolarHBondContact OD1-NH2 2.94Å; L618-R695 HydrophobicContact CD2-CB 4.22Å; L618-R695 HydrophobicContact CD2-CG 4.11Å; D691-R695 PolarHBondContact O-N 2.82Å; R692-R695 WeakPolarHBondContact O-CB 3.47Å; R692-R695 PolarHBondContact O-N 3Å; R695-E698 IonicContact CZ-OE2 3.85Å; R695-E698 IonicContact NH1-OE2 3.37Å; R695-E698 PolarHBondContact NH1-OE2 2.79Å; R695-E698 PolarHBondContact O-N 3.29Å; R695-I699 HydrophobicContact CG-CD1 4.05Å; R695-I699 WeakPolarHBondContact O-CB 3.46Å; R695-I699 VanDerWaalsContact O-CG1 3.29Å; R695-I699 WeakPolarHBondContact O-CG1 3.45Å; R695-I699 PolarHBondContact O-N 3.02Å
696	L	90.3	Very high	87.8	Confident	79 Å²	79	68.7 Å²	68.7	41%	0.414	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-44.2	171.9	-75.3	167.2	0	0	0	112	L618 R692 D693 H694 I699 K700	L618-L696 HydrophobicContact CD1-CD2 3.71Å; L618-L696 HydrophobicContact CD1-CG 4.41Å; L618-L696 HydrophobicContact CD2-CD2 4.27Å; L618-L696 HydrophobicContact CD2-CG 4.08Å; R692-L696 HydrophobicContact CG-CD1 4.49Å; R692-L696 WeakPolarHBondContact O-CG 3.39Å; R692-L696 PolarHBondContact O-N 3.29Å; D693-L696 PolarHBondContact O-N 2.7Å; H694-L696 PolarHBondContact O-N 3.16Å; L696-I699 PolarHBondContact O-N 3.46Å; L696-K700 VanDerWaalsContact O-CB 3.3Å; L696-K700 WeakPolarHBondContact O-CB 3.47Å; L696-K700 PolarHBondContact O-N 3.13Å
697	L	88.5	Confident	87.7	Confident	92 Å²	92	71.5 Å²	71.5	48%	0.482	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-37.4	175.9	-78.1	162.1	0	0	0	112.7	D693 H694 R701	D693-L697 WeakPolarHBondContact O-CB 2.9Å; D693-L697 WeakPolarHBondContact O-CG 3.33Å; D693-L697 PolarHBondContact O-N 2.67Å; H694-L697 WeakPolarHBondContact O-CB 3.32Å; H694-L697 PolarHBondContact O-N 2.85Å; L697-R701 VanDerWaalsContact O-CB 3.25Å; L697-R701 WeakPolarHBondContact O-CB 3.46Å; L697-R701 PolarHBondContact O-N 3.39Å
698	E	85	Confident	87.7	Confident	77 Å²	77	77.4 Å²	77.4	36%	0.36	36%	0.355	S	S	.	.	H	α-helix	trans	-67	-46.6	174.9	-172.5	178.8	-124.1	0	0	111.7	H694 R695 K700 R701 A702	H694-E698 PolarHBondContact O-N 2.91Å; R695-E698 IonicContact CZ-OE2 3.85Å; R695-E698 IonicContact NH1-OE2 3.37Å; R695-E698 PolarHBondContact NH1-OE2 2.79Å; R695-E698 PolarHBondContact O-N 3.29Å; E698-K700 PolarHBondContact O-N 2.9Å; E698-R701 PolarHBondContact O-N 3.28Å; E698-A702 WeakPolarHBondContact O-CB 3.42Å; E698-A702 PolarHBondContact O-N 2.79Å
699	I	89.1	Confident	87.5	Confident	54 Å²	54	82 Å²	82	28%	0.277	38%	0.379	S	S	.	.	H	α-helix	trans	-63.2	-41.5	176.8	-69.2	164.6	0	0	0	111.2	L618 R695 L696 A702 K703	L618-I699 HydrophobicContact CD1-CD1 4.12Å; R695-I699 HydrophobicContact CG-CD1 4.05Å; R695-I699 WeakPolarHBondContact O-CB 3.46Å; R695-I699 VanDerWaalsContact O-CG1 3.29Å; R695-I699 WeakPolarHBondContact O-CG1 3.45Å; R695-I699 PolarHBondContact O-N 3.02Å; L696-I699 PolarHBondContact O-N 3.46Å; I699-A702 PolarHBondContact O-N 3.41Å; I699-K703 HydrophobicContact CG2-CD 4.42Å; I699-K703 WeakPolarHBondContact O-CG 3.41Å; I699-K703 PolarHBondContact O-N 2.71Å; I699-K703 VanDerWaalsContact O-N 3.17Å
700	K	90	Very high	87.4	Confident	121 Å²	121	85.1 Å²	85.1	53%	0.526	39%	0.391	S	S	.	.	H	α-helix	trans	-60	-46.1	175.4	-176.4	173.9	-173.5	-71.4	0	111.2	L696 E698 K703 E704	L696-K700 VanDerWaalsContact O-CB 3.3Å; L696-K700 WeakPolarHBondContact O-CB 3.47Å; L696-K700 PolarHBondContact O-N 3.13Å; E698-K700 PolarHBondContact O-N 2.9Å; K700-K703 WeakPolarHBondContact O-CB 3.39Å; K700-K703 PolarHBondContact O-N 3.05Å; K700-E704 IonicContact NZ-OE1 3.37Å; K700-E704 PolarHBondContact NZ-OE1 3.45Å; K700-E704 WeakPolarHBondContact O-CG 3.29Å; K700-E704 PolarHBondContact O-N 2.8Å
701	R	85.1	Confident	87.4	Confident	52 Å²	52	85.6 Å²	85.6	20%	0.196	40%	0.397	C	S	.	.	H	α-helix	trans	-66.3	-40	178.4	179.4	-175.7	-56.6	146	5.7	113.5	R580 E583 L697 E698 K703 E704 E705	R580-R701 VanDerWaalsContact CZ-CZ 3.48Å; R580-R701 VanDerWaalsContact NH1-CZ 3.32Å; E583-R701 IonicContact OE1-CZ 3.99Å; E583-R701 IonicContact OE1-NH1 3.63Å; E583-R701 PolarHBondContact OE1-NH1 2.85Å; E583-R701 IonicContact OE1-NH2 2.63Å; E583-R701 PolarHBondContact OE1-NH2 2.96Å; E583-R701 IonicContact OE2-NH1 3.73Å; L697-R701 VanDerWaalsContact O-CB 3.25Å; L697-R701 WeakPolarHBondContact O-CB 3.46Å; L697-R701 PolarHBondContact O-N 3.39Å; E698-R701 PolarHBondContact O-N 3.28Å; R701-K703 VanDerWaalsContact C-N 3.26Å; R701-K703 PolarHBondContact O-N 3.14Å; R701-E704 PolarHBondContact O-N 2.96Å; R701-E705 WeakPolarHBondContact O-CB 3.24Å; R701-E705 PolarHBondContact O-N 3.01Å
702	A	86.5	Confident	87.2	Confident	58 Å²	58	89.2 Å²	89.2	48%	0.479	41%	0.413	S	S	.	.	H	α-helix	trans	-60.7	-39.7	175.6	0	0	0	0	0	111	E698 I699 E705 E706	E698-A702 WeakPolarHBondContact O-CB 3.42Å; E698-A702 PolarHBondContact O-N 2.79Å; I699-A702 PolarHBondContact O-N 3.41Å; A702-E705 PolarHBondContact O-N 2.84Å; A702-E706 WeakPolarHBondContact O-CB 3.49Å; A702-E706 PolarHBondContact O-N 3.28Å
703	K	89	Confident	87.1	Confident	137 Å²	137	89.5 Å²	89.5	60%	0.596	42%	0.422	S	S	*	.	H	α-helix	trans	-66.1	-45.6	173.1	-68.5	171.8	-178.9	-179.8	0	112.3	I699 K700 R701 E705 E706 E707	I699-K703 HydrophobicContact CG2-CD 4.42Å; I699-K703 WeakPolarHBondContact O-CG 3.41Å; I699-K703 PolarHBondContact O-N 2.71Å; I699-K703 VanDerWaalsContact O-N 3.17Å; K700-K703 WeakPolarHBondContact O-CB 3.39Å; K700-K703 PolarHBondContact O-N 3.05Å; R701-K703 VanDerWaalsContact C-N 3.26Å; R701-K703 PolarHBondContact O-N 3.14Å; K703-E705 VanDerWaalsContact C-N 3.28Å; K703-E705 PolarHBondContact O-N 3.47Å; K703-E706 PolarHBondContact O-N 2.9Å; K703-E707 WeakPolarHBondContact O-CB 3.29Å; K703-E707 PolarHBondContact O-N 2.73Å
704	E	86.6	Confident	87.1	Confident	85 Å²	85	92.6 Å²	92.6	40%	0.397	43%	0.434	S	S	.	.	H	α-helix	trans	-61.3	-33.4	175.5	-71.7	167.7	176.4	0	0	112.9	K700 R701 R708	K700-E704 IonicContact NZ-OE1 3.37Å; K700-E704 PolarHBondContact NZ-OE1 3.45Å; K700-E704 WeakPolarHBondContact O-CG 3.29Å; K700-E704 PolarHBondContact O-N 2.8Å; R701-E704 PolarHBondContact O-N 2.96Å; E704-R708 WeakPolarHBondContact O-CB 3.28Å; E704-R708 WeakPolarHBondContact O-CG 3.34Å; E704-R708 PolarHBondContact O-N 2.62Å; E704-R708 VanDerWaalsContact O-N 3.08Å
705	E	83	Confident	87.1	Confident	107 Å²	107	96.2 Å²	96.2	50%	0.5	45%	0.453	S	S	.	.	H	α-helix	trans	-78	-39.6	176	-175.1	154.5	-145.8	0	0	112.3	R701 A702 K703 R708 I709	R701-E705 WeakPolarHBondContact O-CB 3.24Å; R701-E705 PolarHBondContact O-N 3.01Å; A702-E705 PolarHBondContact O-N 2.84Å; K703-E705 VanDerWaalsContact C-N 3.28Å; K703-E705 PolarHBondContact O-N 3.47Å; E705-R708 PolarHBondContact O-N 2.78Å; E705-I709 HydrophobicContact CG-CD1 4.02Å; E705-I709 WeakPolarHBondContact O-CB 3.36Å; E705-I709 WeakPolarHBondContact O-CD1 3.47Å; E705-I709 VanDerWaalsContact O-CG1 3.24Å; E705-I709 WeakPolarHBondContact O-CG1 3.5Å; E705-I709 PolarHBondContact O-N 3.37Å
706	E	84.9	Confident	87	Confident	105 Å²	105	95.7 Å²	95.7	49%	0.491	45%	0.453	S	S	.	.	H	α-helix	trans	-62.1	-43.3	171.7	-163	-156.1	134.1	0	0	111.5	A702 K703 I709 R710	A702-E706 WeakPolarHBondContact O-CB 3.49Å; A702-E706 PolarHBondContact O-N 3.28Å; K703-E706 PolarHBondContact O-N 2.9Å; E706-I709 PolarHBondContact O-N 3.4Å; E706-R710 WeakPolarHBondContact O-CB 3.45Å; E706-R710 PolarHBondContact O-N 2.85Å; E706-R710 IonicContact OE1-CZ 2.62Å; E706-R710 IonicContact OE1-NH2 3.63Å; E706-R710 PolarHBondContact OE1-NH2 2.98Å
707	E	88.3	Confident	87	Confident	120 Å²	120	96.2 Å²	96.2	56%	0.561	45%	0.454	S	S	*	.	H	α-helix	trans	-59.5	-49.4	175.1	-175.6	166	-134.1	0	0	110.8	K703 I709 R710 E711	K703-E707 WeakPolarHBondContact O-CB 3.29Å; K703-E707 PolarHBondContact O-N 2.73Å; E707-I709 VanDerWaalsContact C-N 3.33Å; E707-I709 PolarHBondContact O-N 2.9Å; E707-R710 CarbonylContact O-C 3.6Å; E707-R710 WeakPolarHBondContact O-CA 3.49Å; E707-R710 VanDerWaalsContact O-CB 3.3Å; E707-R710 WeakPolarHBondContact O-CB 3.11Å; E707-R710 PolarHBondContact O-N 3.22Å; E707-R710 VanDerWaalsContact O-N 3.1Å; E707-E711 WeakPolarHBondContact O-CG 3.35Å; E707-E711 PolarHBondContact O-N 3.3Å
708	R	85.3	Confident	87	Confident	138 Å²	138	96.8 Å²	96.8	52%	0.521	45%	0.454	S	S	.	.	H	α-helix	trans	-61.9	-34.8	174.1	-80.7	-177.5	57	-97	-16.9	114.3	E704 E705 R710 E712	E704-R708 WeakPolarHBondContact O-CB 3.28Å; E704-R708 WeakPolarHBondContact O-CG 3.34Å; E704-R708 PolarHBondContact O-N 2.62Å; E704-R708 VanDerWaalsContact O-N 3.08Å; E705-R708 PolarHBondContact O-N 2.78Å; R708-R710 VanDerWaalsContact C-N 3.32Å; R708-E712 WeakPolarHBondContact O-CB 3.46Å; R708-E712 PolarHBondContact O-N 2.98Å
709	I	86.7	Confident	87	Confident	98 Å²	98	98.4 Å²	98.4	50%	0.503	46%	0.464	S	S	.	.	H	α-helix	trans	-69.5	-35.4	175.5	-72.4	165.2	0	0	0	110.2	E705 E706 E707 A713	E705-I709 HydrophobicContact CG-CD1 4.02Å; E705-I709 WeakPolarHBondContact O-CB 3.36Å; E705-I709 WeakPolarHBondContact O-CD1 3.47Å; E705-I709 VanDerWaalsContact O-CG1 3.24Å; E705-I709 WeakPolarHBondContact O-CG1 3.5Å; E705-I709 PolarHBondContact O-N 3.37Å; E706-I709 PolarHBondContact O-N 3.4Å; E707-I709 VanDerWaalsContact C-N 3.33Å; E707-I709 PolarHBondContact O-N 2.9Å; I709-A713 WeakPolarHBondContact O-CB 3.2Å; I709-A713 PolarHBondContact O-N 3.36Å
710	R	88.6	Confident	87	Confident	156 Å²	156	100.3 Å²	100.3	59%	0.589	47%	0.468	S	S	*	.	H	α-helix	trans	-66.9	-47.6	174	-162.2	-175.8	-62.6	179.3	-0.5	111.3	E706 E707 R708 E712 A713 E714	E706-R710 WeakPolarHBondContact O-CB 3.45Å; E706-R710 PolarHBondContact O-N 2.85Å; E706-R710 IonicContact OE1-CZ 2.62Å; E706-R710 IonicContact OE1-NH2 3.63Å; E706-R710 PolarHBondContact OE1-NH2 2.98Å; E707-R710 CarbonylContact O-C 3.6Å; E707-R710 WeakPolarHBondContact O-CA 3.49Å; E707-R710 VanDerWaalsContact O-CB 3.3Å; E707-R710 WeakPolarHBondContact O-CB 3.11Å; E707-R710 PolarHBondContact O-N 3.22Å; E707-R710 VanDerWaalsContact O-N 3.1Å; R708-R710 VanDerWaalsContact C-N 3.32Å; R710-E712 PolarHBondContact O-N 2.95Å; R710-A713 WeakPolarHBondContact O-CB 3.43Å; R710-A713 PolarHBondContact O-N 3.26Å; R710-E714 WeakPolarHBondContact O-CB 3.31Å; R710-E714 PolarHBondContact O-N 3.09Å
711	E	86.7	Confident	87	Confident	102 Å²	102	98.8 Å²	98.8	48%	0.477	47%	0.465	S	S	.	.	H	α-helix	trans	-57	-45.9	171.8	-70.3	-179.5	149.5	0	0	111.9	E707 A713 E714 I715	E707-E711 WeakPolarHBondContact O-CG 3.35Å; E707-E711 PolarHBondContact O-N 3.3Å; E711-A713 VanDerWaalsContact C-N 3.28Å; E711-A713 PolarHBondContact O-N 2.93Å; E711-E714 PolarHBondContact O-N 3.35Å; E711-I715 WeakPolarHBondContact O-CB 3.45Å; E711-I715 VanDerWaalsContact O-CG1 3.27Å; E711-I715 WeakPolarHBondContact O-CG1 3.41Å; E711-I715 PolarHBondContact O-N 3.48Å
712	E	82.7	Confident	87	Confident	87 Å²	87	103.6 Å²	103.6	41%	0.407	48%	0.483	S	S	.	.	H	α-helix	trans	-68.7	-27	179.9	-159.6	-171.9	-179	0	0	112.5	R708 R710 K716 R877	R708-E712 WeakPolarHBondContact O-CB 3.46Å; R708-E712 PolarHBondContact O-N 2.98Å; R710-E712 PolarHBondContact O-N 2.95Å; E712-K716 VanDerWaalsContact O-CB 3.3Å; E712-K716 WeakPolarHBondContact O-CB 3.43Å; E712-K716 PolarHBondContact O-N 3.48Å; E712-R877 IonicContact OE1-CZ 3.57Å; E712-R877 IonicContact OE1-NH1 3.82Å; E712-R877 PolarHBondContact OE1-NH1 3.08Å; E712-R877 IonicContact OE1-NH2 2.68Å; E712-R877 PolarHBondContact OE1-NH2 3.14Å; E712-R877 IonicContact OE2-CZ 2.76Å; E712-R877 IonicContact OE2-NH1 2.82Å; E712-R877 IonicContact OE2-NH2 3.93Å; E712-R877 PolarHBondContact OE2-NH2 3.01Å; E712-R877 VanDerWaalsContact OE2-NH2 3.09Å
713	A	88	Confident	86.9	Confident	36 Å²	36	103.6 Å²	103.6	30%	0.298	48%	0.483	S	S	.	.	H	α-helix	trans	-72.2	-47	170.3	0	0	0	0	0	111.4	I709 R710 E711 K716 E717 I879	I709-A713 WeakPolarHBondContact O-CB 3.2Å; I709-A713 PolarHBondContact O-N 3.36Å; R710-A713 WeakPolarHBondContact O-CB 3.43Å; R710-A713 PolarHBondContact O-N 3.26Å; E711-A713 VanDerWaalsContact C-N 3.28Å; E711-A713 PolarHBondContact O-N 2.93Å; A713-K716 PolarHBondContact O-N 3.34Å; A713-E717 PolarHBondContact O-N 3.4Å; A713-I879 HydrophobicContact CB-CD1 4.13Å
714	E	90	Very high	86.9	Confident	138 Å²	138	99.9 Å²	99.9	65%	0.645	47%	0.468	S	S	*	.	H	α-helix	trans	-63.3	-48.8	-179.9	-175.2	171.9	-174.2	0	0	112.2	R710 E711 K716 E717 E718	R710-E714 WeakPolarHBondContact O-CB 3.31Å; R710-E714 PolarHBondContact O-N 3.09Å; E711-E714 PolarHBondContact O-N 3.35Å; E714-K716 PolarHBondContact O-N 3.33Å; E714-E717 PolarHBondContact O-N 3.17Å; E714-E718 PolarHBondContact O-N 3.01Å
715	I	86.7	Confident	87.1	Confident	97 Å²	97	98.4 Å²	98.4	50%	0.497	47%	0.471	S	S	.	.	H	α-helix	trans	-57.4	-35.4	174.1	-69.4	166.4	0	0	0	110.9	E711 L719	E711-I715 WeakPolarHBondContact O-CB 3.45Å; E711-I715 VanDerWaalsContact O-CG1 3.27Å; E711-I715 WeakPolarHBondContact O-CG1 3.41Å; E711-I715 PolarHBondContact O-N 3.48Å; I715-L719 HydrophobicContact CG2-CD1 4.17Å; I715-L719 WeakPolarHBondContact O-CB 3.22Å; I715-L719 WeakPolarHBondContact O-CG 3.15Å; I715-L719 PolarHBondContact O-N 3.26Å
716	K	86.2	Confident	87.2	Confident	70 Å²	70	99.9 Å²	99.9	30%	0.304	48%	0.475	S	S	.	.	H	α-helix	trans	-75.3	-33.1	177.4	-176.7	158.9	179.7	159.5	0	112.9	E712 A713 E714 R720 R877	E712-K716 VanDerWaalsContact O-CB 3.3Å; E712-K716 WeakPolarHBondContact O-CB 3.43Å; E712-K716 PolarHBondContact O-N 3.48Å; A713-K716 PolarHBondContact O-N 3.34Å; E714-K716 PolarHBondContact O-N 3.33Å; K716-R720 PolarHBondContact O-N 3Å; K716-R877 HydrophobicContact CD-CB 3.87Å; K716-R877 HydrophobicContact CD-CG 4.36Å; K716-R877 WeakPolarHBondContact CE-O 2.92Å
717	E	89.6	Confident	87.1	Confident	91 Å²	91	101.7 Å²	101.7	43%	0.425	48%	0.484	S	S	.	.	H	α-helix	trans	-68.2	-42.4	172	-174.2	155.7	-159.5	0	0	111.2	A713 E714 L719 R720 L721	A713-E717 PolarHBondContact O-N 3.4Å; E714-E717 PolarHBondContact O-N 3.17Å; E717-L719 PolarHBondContact O-N 2.97Å; E717-R720 WeakPolarHBondContact O-CB 3.38Å; E717-R720 PolarHBondContact O-N 3.32Å; E717-R720 VanDerWaalsContact O-N 3.08Å; E717-L721 HydrophobicContact CG-CD1 4.24Å; E717-L721 WeakPolarHBondContact O-CG 3.27Å; E717-L721 PolarHBondContact O-N 2.94Å
718	E	87.9	Confident	87	Confident	103 Å²	103	102.2 Å²	102.2	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-58.2	-46.8	171.6	-163.2	-142.7	137.4	0	0	111.2	E714 R720 L721 R722	E714-E718 PolarHBondContact O-N 3.01Å; E718-R720 VanDerWaalsContact C-N 3.26Å; E718-R720 PolarHBondContact O-N 3.08Å; E718-L721 PolarHBondContact O-N 3.45Å; E718-R722 VanDerWaalsContact O-CB 3.23Å; E718-R722 WeakPolarHBondContact O-CB 3.49Å; E718-R722 PolarHBondContact O-N 3.43Å; E718-R722 IonicContact OE1-NH1 2.72Å
719	L	85.8	Confident	87	Confident	111 Å²	111	101.5 Å²	101.5	58%	0.581	49%	0.487	S	S	*	.	H	α-helix	trans	-59.6	-34.7	175	-80.9	166.5	0	0	0	112.7	I715 E717 A723	I715-L719 HydrophobicContact CG2-CD1 4.17Å; I715-L719 WeakPolarHBondContact O-CB 3.22Å; I715-L719 WeakPolarHBondContact O-CG 3.15Å; I715-L719 PolarHBondContact O-N 3.26Å; E717-L719 PolarHBondContact O-N 2.97Å; L719-A723 WeakPolarHBondContact O-CB 3.36Å; L719-A723 PolarHBondContact O-N 2.92Å; L719-A723 VanDerWaalsContact O-N 3.09Å
720	R	88.4	Confident	86.8	Confident	95 Å²	95	103.7 Å²	103.7	36%	0.358	49%	0.492	S	S	.	.	H	α-helix	trans	-69.9	-51.3	176	-152.1	-167.8	84.5	-139	-3	110.8	K716 E717 E718 R722 A723 E724	K716-R720 PolarHBondContact O-N 3Å; E717-R720 WeakPolarHBondContact O-CB 3.38Å; E717-R720 PolarHBondContact O-N 3.32Å; E717-R720 VanDerWaalsContact O-N 3.08Å; E718-R720 VanDerWaalsContact C-N 3.26Å; E718-R720 PolarHBondContact O-N 3.08Å; R720-R722 VanDerWaalsContact C-N 3.25Å; R720-R722 PolarHBondContact O-N 2.61Å; R720-A723 WeakPolarHBondContact O-CB 3.13Å; R720-A723 PolarHBondContact O-N 2.95Å; R720-A723 VanDerWaalsContact O-N 3.08Å; R720-E724 IonicContact CZ-OE1 2.68Å; R720-E724 IonicContact NE-OE1 2.68Å; R720-E724 PolarHBondContact NE-OE1 2.78Å; R720-E724 IonicContact NH2-OE1 2.78Å; R720-E724 PolarHBondContact NH2-OE1 2.68Å; R720-E724 WeakPolarHBondContact O-CG 3.37Å; R720-E724 PolarHBondContact O-N 2.68Å
721	L	90	Very high	86.6	Confident	89 Å²	89	102.9 Å²	102.9	47%	0.466	50%	0.495	S	S	.	.	H	α-helix	trans	-58.6	-37.2	176.9	-68.6	171	0	0	0	112	E717 E718 E724 A725	E717-L721 HydrophobicContact CG-CD1 4.24Å; E717-L721 WeakPolarHBondContact O-CG 3.27Å; E717-L721 PolarHBondContact O-N 2.94Å; E718-L721 PolarHBondContact O-N 3.45Å; L721-E724 PolarHBondContact O-N 2.98Å; L721-A725 WeakPolarHBondContact O-CB 3.45Å; L721-A725 PolarHBondContact O-N 2.81Å
722	R	85.4	Confident	86.5	Confident	152 Å²	152	107 Å²	107	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-73.9	-27.3	177.2	-164.1	168.8	-172.5	165.6	-0.9	113.3	E718 R720 K726	E718-R722 VanDerWaalsContact O-CB 3.23Å; E718-R722 WeakPolarHBondContact O-CB 3.49Å; E718-R722 PolarHBondContact O-N 3.43Å; E718-R722 IonicContact OE1-NH1 2.72Å; R720-R722 VanDerWaalsContact C-N 3.25Å; R720-R722 PolarHBondContact O-N 2.61Å; R722-K726 WeakPolarHBondContact O-CG 3.47Å; R722-K726 PolarHBondContact O-N 2.81Å
723	A	85.8	Confident	86.5	Confident	58 Å²	58	108 Å²	108	48%	0.479	51%	0.514	S	S	.	.	H	α-helix	trans	-70.9	-48.8	168.4	0	0	0	0	0	111	L719 R720 A725 K726 E727	L719-A723 WeakPolarHBondContact O-CB 3.36Å; L719-A723 PolarHBondContact O-N 2.92Å; L719-A723 VanDerWaalsContact O-N 3.09Å; R720-A723 WeakPolarHBondContact O-CB 3.13Å; R720-A723 PolarHBondContact O-N 2.95Å; R720-A723 VanDerWaalsContact O-N 3.08Å; A723-A725 PolarHBondContact O-N 2.82Å; A723-K726 PolarHBondContact O-N 2.82Å; A723-K726 VanDerWaalsContact O-N 3.15Å; A723-E727 PolarHBondContact O-N 3.38Å
724	E	88.8	Confident	86.3	Confident	60 Å²	60	111.8 Å²	111.8	28%	0.28	53%	0.526	S	S	.	.	H	α-helix	trans	-57.4	-35.7	175.3	-67.3	173.2	-147.2	0	0	112.1	R720 L721 K728	R720-E724 IonicContact CZ-OE1 2.68Å; R720-E724 IonicContact NE-OE1 2.68Å; R720-E724 PolarHBondContact NE-OE1 2.78Å; R720-E724 IonicContact NH2-OE1 2.78Å; R720-E724 PolarHBondContact NH2-OE1 2.68Å; R720-E724 WeakPolarHBondContact O-CG 3.37Å; R720-E724 PolarHBondContact O-N 2.68Å; L721-E724 PolarHBondContact O-N 2.98Å; E724-K728 WeakPolarHBondContact O-CD 3.46Å; E724-K728 WeakPolarHBondContact O-CG 3.39Å; E724-K728 PolarHBondContact O-N 2.79Å
725	A	89.9	Confident	86	Confident	54 Å²	54	112.5 Å²	112.5	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-69.3	-43.3	175.5	0	0	0	0	0	112.9	L721 A723 E727 K728 E729	L721-A725 WeakPolarHBondContact O-CB 3.45Å; L721-A725 PolarHBondContact O-N 2.81Å; A723-A725 PolarHBondContact O-N 2.82Å; A725-E727 VanDerWaalsContact C-N 3.31Å; A725-E727 PolarHBondContact O-N 3Å; A725-K728 PolarHBondContact O-N 2.87Å; A725-E729 PolarHBondContact O-N 3.28Å
726	K	85.3	Confident	85.7	Confident	137 Å²	137	111.5 Å²	111.5	60%	0.596	52%	0.52	S	S	*	.	H	α-helix	trans	-65.2	-33.6	176.1	-79.2	-177	173.9	-172.8	0	112.7	R722 A723 E729 K730	R722-K726 WeakPolarHBondContact O-CG 3.47Å; R722-K726 PolarHBondContact O-N 2.81Å; A723-K726 PolarHBondContact O-N 2.82Å; A723-K726 VanDerWaalsContact O-N 3.15Å; K726-E729 PolarHBondContact O-N 2.99Å; K726-K730 WeakPolarHBondContact O-CB 3.26Å; K726-K730 PolarHBondContact O-N 3.04Å
727	E	83.7	Confident	85.6	Confident	144 Å²	144	117.2 Å²	117.2	67%	0.673	54%	0.54	S	S	*	.	H	α-helix	trans	-64.8	-47.2	175	-171	161.2	-144.7	0	0	111.1	A723 A725 E729 K730 E731	A723-E727 PolarHBondContact O-N 3.38Å; A725-E727 VanDerWaalsContact C-N 3.31Å; A725-E727 PolarHBondContact O-N 3Å; E727-E729 VanDerWaalsContact C-N 3.35Å; E727-E729 PolarHBondContact O-N 3.43Å; E727-K730 PolarHBondContact O-N 3.2Å; E727-E731 PolarHBondContact O-N 3.14Å
728	K	86.1	Confident	85.1	Confident	131 Å²	131	118.5 Å²	118.5	57%	0.57	55%	0.548	S	S	*	.	H	α-helix	trans	-62.8	-35.9	174.1	-70.1	165.3	-176.3	162.8	0	113.1	E724 A725 R732	E724-K728 WeakPolarHBondContact O-CD 3.46Å; E724-K728 WeakPolarHBondContact O-CG 3.39Å; E724-K728 PolarHBondContact O-N 2.79Å; A725-K728 PolarHBondContact O-N 2.87Å; K728-R732 WeakPolarHBondContact O-CB 3.43Å; K728-R732 PolarHBondContact O-N 3.15Å
729	E	84.2	Confident	84.8	Confident	123 Å²	123	119.8 Å²	119.8	58%	0.575	56%	0.555	S	S	*	*	H	α-helix	trans	-66.4	-43.9	174.5	-177	173.8	-146.1	0	0	111.8	A725 K726 E727 R732 L733	A725-E729 PolarHBondContact O-N 3.28Å; K726-E729 PolarHBondContact O-N 2.99Å; E727-E729 VanDerWaalsContact C-N 3.35Å; E727-E729 PolarHBondContact O-N 3.43Å; E729-R732 PolarHBondContact O-N 2.81Å; E729-L733 HydrophobicContact CG-CD1 4.48Å; E729-L733 PolarHBondContact O-N 2.88Å
730	K	83.4	Confident	84.4	Confident	143 Å²	143	120.8 Å²	120.8	62%	0.622	55%	0.554	S	S	*	*	H	α-helix	trans	-61.3	-46.3	175.4	-175.1	-167.6	171.4	-161.4	0	111.5	K726 E727 R732 L733 E734	K726-K730 WeakPolarHBondContact O-CB 3.26Å; K726-K730 PolarHBondContact O-N 3.04Å; E727-K730 PolarHBondContact O-N 3.2Å; K730-R732 VanDerWaalsContact C-N 3.31Å; K730-R732 PolarHBondContact O-N 2.8Å; K730-L733 PolarHBondContact O-N 2.89Å; K730-E734 WeakPolarHBondContact O-CB 3.45Å; K730-E734 PolarHBondContact O-N 2.94Å
731	E	83.1	Confident	83.8	Confident	139 Å²	139	123.6 Å²	123.6	65%	0.65	57%	0.569	S	S	*	*	H	α-helix	trans	-58.4	-42.6	176.4	-172.2	-174.7	-173.2	0	0	111.5	E727 E734 K735	E727-E731 PolarHBondContact O-N 3.14Å; E731-E734 PolarHBondContact O-N 2.84Å; E731-K735 WeakPolarHBondContact O-CB 3.46Å; E731-K735 PolarHBondContact O-N 2.89Å
732	R	86.2	Confident	83.2	Confident	190 Å²	190	122.3 Å²	122.3	72%	0.717	57%	0.571	S	S	*	*	H	α-helix	trans	-63.6	-43.5	176.1	-173.3	-179.8	177.4	-153.8	-2.7	112.6	K728 E729 K730 K735 E736	K728-R732 WeakPolarHBondContact O-CB 3.43Å; K728-R732 PolarHBondContact O-N 3.15Å; E729-R732 PolarHBondContact O-N 2.81Å; K730-R732 VanDerWaalsContact C-N 3.31Å; K730-R732 PolarHBondContact O-N 2.8Å; R732-K735 PolarHBondContact O-N 3.25Å; R732-E736 PolarHBondContact O-N 2.82Å
733	L	82.7	Confident	82.6	Confident	106 Å²	106	117.8 Å²	117.8	56%	0.555	57%	0.567	S	S	*	*	H	α-helix	trans	-65.6	-36.8	176.3	-88.9	166	0	0	0	112.6	E729 K730 E736 R737	E729-L733 HydrophobicContact CG-CD1 4.48Å; E729-L733 PolarHBondContact O-N 2.88Å; K730-L733 PolarHBondContact O-N 2.89Å; L733-E736 PolarHBondContact O-N 3.05Å; L733-R737 WeakPolarHBondContact O-CB 3.44Å; L733-R737 PolarHBondContact O-N 3.37Å
734	E	82.9	Confident	81.8	Confident	117 Å²	117	118.2 Å²	118.2	55%	0.547	57%	0.57	S	S	.	*	H	α-helix	trans	-66.9	-41.9	175.4	-175.3	154.7	-161.4	0	0	111.5	K730 E731 R737 L738	K730-E734 WeakPolarHBondContact O-CB 3.45Å; K730-E734 PolarHBondContact O-N 2.94Å; E731-E734 PolarHBondContact O-N 2.84Å; E734-R737 PolarHBondContact O-N 3.37Å; E734-L738 PolarHBondContact O-N 2.95Å
735	K	83.5	Confident	80.8	Confident	153 Å²	153	118.9 Å²	118.9	67%	0.665	59%	0.586	S	S	*	*	H	α-helix	trans	-60.4	-45.8	172	-173.9	175	179.8	176.9	0	112.4	E731 R732 R737 L738 E739	E731-K735 WeakPolarHBondContact O-CB 3.46Å; E731-K735 PolarHBondContact O-N 2.89Å; R732-K735 PolarHBondContact O-N 3.25Å; K735-R737 VanDerWaalsContact C-N 3.3Å; K735-R737 PolarHBondContact O-N 2.92Å; K735-L738 WeakPolarHBondContact O-CB 3.27Å; K735-L738 PolarHBondContact O-N 2.84Å; K735-E739 PolarHBondContact O-N 3.41Å
736	E	81.8	Confident	79.5	Confident	75 Å²	75	120 Å²	120	35%	0.35	60%	0.595	S	S	.	*	H	α-helix	trans	-64.9	-34.4	177.2	-162.9	-168.9	126.8	0	0	112	R732 L733 E739 K740	R732-E736 PolarHBondContact O-N 2.82Å; L733-E736 PolarHBondContact O-N 3.05Å; E736-E739 PolarHBondContact O-N 2.92Å; E736-K740 HydrophobicContact CG-CD 4.43Å; E736-K740 WeakPolarHBondContact O-CB 3.21Å; E736-K740 WeakPolarHBondContact O-CG 3.37Å; E736-K740 PolarHBondContact O-N 2.99Å; E736-K740 VanDerWaalsContact OE1-CE 3.32Å; E736-K740 WeakPolarHBondContact OE1-CE 3.32Å; E736-K740 IonicContact OE1-NZ 3.19Å; E736-K740 PolarHBondContact OE1-NZ 3.25Å
737	R	82.2	Confident	78.4	Confident	191 Å²	191	117.5 Å²	117.5	72%	0.721	60%	0.6	S	S	*	*	H	α-helix	trans	-68.5	-36	175	-170.8	176.2	-175	176.8	1.6	112.5	L733 E734 K735 K741	L733-R737 WeakPolarHBondContact O-CB 3.44Å; L733-R737 PolarHBondContact O-N 3.37Å; E734-R737 PolarHBondContact O-N 3.37Å; K735-R737 VanDerWaalsContact C-N 3.3Å; K735-R737 PolarHBondContact O-N 2.92Å; R737-K741 PolarHBondContact O-N 3.31Å; R737-K741 VanDerWaalsContact O-N 3.07Å
738	L	80.5	Confident	77.1	Confident	117 Å²	117	114.7 Å²	114.7	61%	0.613	60%	0.601	S	S	*	*	H	α-helix	trans	-65.7	-45.5	171.3	-82.8	159.9	0	0	0	111.4	E734 K735 K741 A742	E734-L738 PolarHBondContact O-N 2.95Å; K735-L738 WeakPolarHBondContact O-CB 3.27Å; K735-L738 PolarHBondContact O-N 2.84Å; L738-K741 WeakPolarHBondContact O-CB 3.24Å; L738-K741 PolarHBondContact O-N 3.25Å; L738-A742 PolarHBondContact O-N 2.93Å
739	E	81.1	Confident	75.4	Confident	131 Å²	131	115 Å²	115	61%	0.612	61%	0.609	S	S	*	*	H	α-helix	trans	-63.3	-42.8	177.9	-170.3	166	-167.8	0	0	111.9	K735 E736 K741 A742 A743	K735-E739 PolarHBondContact O-N 3.41Å; E736-E739 PolarHBondContact O-N 2.92Å; E739-K741 VanDerWaalsContact C-N 3.34Å; E739-K741 PolarHBondContact O-N 3.13Å; E739-A742 WeakPolarHBondContact O-CB 3.5Å; E739-A742 PolarHBondContact O-N 3.32Å; E739-A742 VanDerWaalsContact O-N 3.17Å; E739-A743 WeakPolarHBondContact O-CB 3.17Å; E739-A743 PolarHBondContact O-N 3.35Å
740	K	77.8	Confident	73.2	Confident	132 Å²	132	114.9 Å²	114.9	57%	0.574	62%	0.619	S	S	*	*	H	α-helix	trans	-63.8	-33.7	172.4	-79.7	172.1	170.6	168.4	0	113.2	E736 A744	E736-K740 HydrophobicContact CG-CD 4.43Å; E736-K740 WeakPolarHBondContact O-CB 3.21Å; E736-K740 WeakPolarHBondContact O-CG 3.37Å; E736-K740 PolarHBondContact O-N 2.99Å; E736-K740 VanDerWaalsContact OE1-CE 3.32Å; E736-K740 WeakPolarHBondContact OE1-CE 3.32Å; E736-K740 IonicContact OE1-NZ 3.19Å; E736-K740 PolarHBondContact OE1-NZ 3.25Å; K740-A744 WeakPolarHBondContact O-CB 3.3Å; K740-A744 PolarHBondContact O-N 3Å
741	K	76.3	Confident	71.3	Confident	153 Å²	153	115.6 Å²	115.6	67%	0.665	63%	0.63	S	S	*	*	H	α-helix	trans	-65.6	-41.8	170.6	-96.9	-171.1	170.6	-173.2	0	112	R737 L738 E739 A744 A745	R737-K741 PolarHBondContact O-N 3.31Å; R737-K741 VanDerWaalsContact O-N 3.07Å; L738-K741 WeakPolarHBondContact O-CB 3.24Å; L738-K741 PolarHBondContact O-N 3.25Å; E739-K741 VanDerWaalsContact C-N 3.34Å; E739-K741 PolarHBondContact O-N 3.13Å; K741-A744 PolarHBondContact O-N 3.39Å; K741-A745 PolarHBondContact O-N 3.03Å
742	A	76.2	Confident	69.2	Low	62 Å²	62	114 Å²	114	51%	0.512	63%	0.631	S	S	.	*	H	α-helix	trans	-65	-43.4	176	0	0	0	0	0	111.7	L738 E739 A745 A746	L738-A742 PolarHBondContact O-N 2.93Å; E739-A742 WeakPolarHBondContact O-CB 3.5Å; E739-A742 PolarHBondContact O-N 3.32Å; E739-A742 VanDerWaalsContact O-N 3.17Å; A742-A745 PolarHBondContact O-N 3.19Å; A742-A746 PolarHBondContact O-N 3.3Å
743	A	72.3	Confident	67.2	Low	58 Å²	58	111.8 Å²	111.8	48%	0.479	64%	0.639	S	S	.	*	H	α-helix	trans	-63.1	-40.9	175.5	0	0	0	0	0	112.6	E739 A745 A746 A747	E739-A743 WeakPolarHBondContact O-CB 3.17Å; E739-A743 PolarHBondContact O-N 3.35Å; A743-A745 VanDerWaalsContact C-N 3.34Å; A743-A745 PolarHBondContact O-N 3.45Å; A743-A746 PolarHBondContact O-N 2.99Å; A743-A747 WeakPolarHBondContact O-CB 3.41Å; A743-A747 PolarHBondContact O-N 3.4Å
744	A	70.2	Confident	65.1	Low	66 Å²	66	111.8 Å²	111.8	55%	0.545	65%	0.646	S	S	.	*	H	α-helix	trans	-64.5	-36.9	175.2	0	0	0	0	0	112.6	K740 K741 A747	K740-A744 WeakPolarHBondContact O-CB 3.3Å; K740-A744 PolarHBondContact O-N 3Å; K741-A744 PolarHBondContact O-N 3.39Å; A744-A747 PolarHBondContact O-N 3Å
745	A	66.6	Low	62.9	Low	75 Å²	75	113.6 Å²	113.6	62%	0.62	66%	0.657	S	S	*	*	H	α-helix	trans	-67.4	-36	173	0	0	0	0	0	112.4	K741 A742 A743	K741-A745 PolarHBondContact O-N 3.03Å; A742-A745 PolarHBondContact O-N 3.19Å; A743-A745 VanDerWaalsContact C-N 3.34Å; A743-A745 PolarHBondContact O-N 3.45Å
746	A	63.5	Low	61.2	Low	76 Å²	76	111.6 Å²	111.6	63%	0.628	66%	0.66	S	S	*	*	H	α-helix	trans	-70.7	-32.5	175.5	0	0	0	0	0	113.3	A742 A743 A748	A742-A746 PolarHBondContact O-N 3.3Å; A743-A746 PolarHBondContact O-N 2.99Å; A746-A748 PolarHBondContact O-N 3.34Å
747	A	61.2	Low	59.5	Low	85 Å²	85	112.7 Å²	112.7	70%	0.702	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-11	-178.2	0	0	0	0	0	114.7	A743 A744 N749	A743-A747 WeakPolarHBondContact O-CB 3.41Å; A743-A747 PolarHBondContact O-N 3.4Å; A744-A747 PolarHBondContact O-N 3Å; A747-N749 VanDerWaalsContact C-N 3.27Å; A747-N749 PolarHBondContact O-N 2.94Å
748	A	56.6	Low	57.4	Low	85 Å²	85	109.7 Å²	109.7	70%	0.702	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	10.2	-175.4	0	0	0	0	0	114.8	A746	A746-A748 PolarHBondContact O-N 3.34Å
749	N	50.9	Low	55.5	Low	139 Å²	139	109.8 Å²	109.8	74%	0.743	68%	0.684	S	S	*	*	S	Bend	trans	-131.8	113	-171.9	-160.9	10.5	0	0	0	112	A747	A747-N749 VanDerWaalsContact C-N 3.27Å; A747-N749 PolarHBondContact O-N 2.94Å
750	P	39.2	Very low	53	Low	119 Å²	119	107.2 Å²	107.2	77%	0.773	69%	0.685	S	S	*	*			trans	-90.4	112.3	-172.3	33.4	-32.8	0	0	0	113.1
751	N	43.2	Very low	50.9	Low	158 Å²	158	106.8 Å²	106.8	85%	0.845	69%	0.694	S	S	*	*			trans	-151.6	130.7	157.1	-149.4	14.2	0	0	0	111
752	P	38.7	Very low	48.9	Very low	106 Å²	106	103.7 Å²	103.7	69%	0.688	69%	0.689	S	S	*	*			trans	-104	155.3	-170.2	38	-33.5	0	0	0	114.3
753	T	43.1	Very low	46.5	Very low	144 Å²	144	108.3 Å²	108.3	88%	0.883	70%	0.7	S	S	*	*			trans	-163.8	143.9	137.2	2.9	0	0	0	0	111.1
754	P	38.9	Very low	44.4	Very low	106 Å²	106	110.6 Å²	110.6	69%	0.688	71%	0.712	S	S	*	*			trans	-138.9	-174.4	-160.1	37.2	-14.4	0	0	0	116.9
755	I	37.3	Very low	42.3	Very low	155 Å²	155	113.2 Å²	113.2	80%	0.795	73%	0.727	S	S	*	*			trans	71	164.6	162.8	12.6	179.2	0	0	0	117.4
756	P	46.8	Very low	40.3	Very low	111 Å²	111	114 Å²	114	72%	0.721	73%	0.733	S	S	*	*				-135.5	-132.1	-117.6	46.6	-24.8	0	0	0	111.3
757	P	47.8	Very low	38.9	Very low	98 Å²	98	119.5 Å²	119.5	64%	0.636	75%	0.746	S	S	*	*			cis	-128.8	-145.3	-32.5	38	-18.4	0	0	0	111.5
758	T	36.5	Very low	37.3	Very low	127 Å²	127	122.9 Å²	122.9	78%	0.779	75%	0.747	S	S	*	*			trans	79.8	150.9	157.3	32.9	0	0	0	0	117.3
759	P	40.4	Very low	36.3	Very low	120 Å²	120	125.3 Å²	125.3	78%	0.779	74%	0.744	S	S	*	*			trans	-111.2	-147.1	-151	45.2	-36.9	0	0	0	111.6
760	A	29.1	Very low	35.6	Very low	76 Å²	76	124.5 Å²	124.5	63%	0.628	75%	0.747	S	S	*	*			trans	77.8	132.7	-169.1	0	0	0	0	0	111
761	T	33.3	Very low	35.2	Very low	124 Å²	124	125.5 Å²	125.5	76%	0.761	74%	0.744	S	S	*	*			cis	56.7	167.4	33.5	86.7	0	0	0	0	113.1
762	P	35	Very low	34.5	Very low	87 Å²	87	122.6 Å²	122.6	57%	0.565	73%	0.734	S	S	*	*			cis	-106.2	-149.1	-27.9	8.2	16.4	0	0	0	108
763	H	26.7	Very low	34.6	Very low	159 Å²	159	123.7 Å²	123.7	74%	0.736	74%	0.741	S	S	*	*			trans	70.7	111.9	159.1	-50.8	-45.6	0	0	0	115.9
764	S	27.3	Very low	34	Very low	106 Å²	106	121.9 Å²	121.9	74%	0.741	73%	0.731	S	S	*	*				65.7	111.6	66.3	-54.6	0	0	0	0	112.8
765	S	25.8	Very low	33.9	Very low	122 Å²	122	124 Å²	124	85%	0.853	74%	0.736	S	S	*	*			trans	159.1	137.1	149.5	-76.3	0	0	0	0	109.9
766	A	26	Very low	33.8	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	73%	0.733	S	S	*	*			trans	61.2	125	-177.3	0	0	0	0	0	114.6
767	Q	33.8	Very low	32.9	Very low	192 Å²	192	121.3 Å²	121.3	90%	0.897	73%	0.73	S	S	*	*				61.9	129.9	50.4	-58.8	-179	-27	0	0	112.7
768	Q	27.8	Very low	32.1	Very low	156 Å²	156	124.9 Å²	124.9	73%	0.729	74%	0.737	S	S	*	*			cis	-99	-151.8	-5.1	-163.2	-173.7	93.1	0	0	108.6
769	Q	34.3	Very low	32	Very low	136 Å²	136	124.1 Å²	124.1	64%	0.636	73%	0.733	S	S	*	*			trans	63.7	-174.4	145.8	-67	147.6	14.9	0	0	116.3	I771	Q769-I771 HydrophobicContact CG-CD1 4.21Å
770	P	36	Very low	31.6	Very low	122 Å²	122	123.7 Å²	123.7	79%	0.792	73%	0.733	S	S	*	*			cis	-119.9	170.8	-20.9	16.5	6.7	0	0	0	113.2
771	I	31.1	Very low	31.9	Very low	140 Å²	140	124.4 Å²	124.4	72%	0.718	74%	0.738	S	S	*	*			cis	-158.7	140.5	-38.6	-122.5	166.3	0	0	0	107.5	Q769	Q769-I771 HydrophobicContact CG-CD1 4.21Å
772	P	29.4	Very low	31.7	Very low	97 Å²	97	126.6 Å²	126.6	63%	0.63	74%	0.74	S	S	*	*			trans	-112.6	174.7	-176.7	41.4	-35	0	0	0	114
773	P	40.4	Very low	31.4	Very low	128 Å²	128	128.1 Å²	128.1	83%	0.831	74%	0.742	S	S	*	*	S	Bend	trans	-100.4	132.8	155.1	34.6	-25.1	0	0	0	111.5
774	P	30.5	Very low	31.5	Very low	106 Å²	106	127.6 Å²	127.6	69%	0.688	74%	0.74	S	S	*	*	S	Bend		-125.2	175.9	-72.6	39.8	-33.7	0	0	0	114.9
775	L	36.8	Very low	31.6	Very low	151 Å²	151	130.6 Å²	130.6	79%	0.791	74%	0.743	S	S	*	*			trans	80.4	103.6	170.5	-87.7	67.4	0	0	0	120.1
776	S	34.7	Very low	31.7	Very low	103 Å²	103	130.3 Å²	130.3	72%	0.72	74%	0.741	S	S	*	*				47.5	141.2	119.7	-50.6	0	0	0	0	123.3
777	T	28.3	Very low	31.7	Very low	107 Å²	107	130.1 Å²	130.1	66%	0.656	74%	0.739	S	S	*	*			cis	-174.4	134.7	-14.9	28	0	0	0	0	110.2
778	Q	30.9	Very low	31.5	Very low	172 Å²	172	129.7 Å²	129.7	80%	0.804	74%	0.737	S	S	*	*			trans	61.6	162.9	151.3	-64	175.2	46.4	0	0	117.4
779	T	34.3	Very low	31.5	Very low	112 Å²	112	130.8 Å²	130.8	69%	0.687	74%	0.742	S	S	*	*			cis	-147.9	133.5	0.2	5.6	0	0	0	0	105.9
780	S	31.8	Very low	31.2	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	75%	0.746	S	S	*	*				70.8	93.3	74.1	-52.7	0	0	0	0	116
781	A	36.5	Very low	30.8	Very low	90 Å²	90	128.9 Å²	128.9	74%	0.744	74%	0.744	S	S	*	*			trans	-176.3	128.7	138	0	0	0	0	0	107.3
782	E	28.6	Very low	30.7	Very low	170 Å²	170	128 Å²	128	79%	0.794	75%	0.745	S	S	*	*			cis	71.3	128.3	47.7	-64.3	-162.5	111.5	0	0	112.5
783	I	27.7	Very low	30.8	Very low	119 Å²	119	129 Å²	129	61%	0.61	75%	0.751	S	S	*	*			cis	-163.7	169.7	4.5	-140.2	168.5	0	0	0	112.5
784	Q	29.3	Very low	30.2	Very low	149 Å²	149	128.1 Å²	128.1	70%	0.696	74%	0.744	S	S	*	*			trans	66.3	130.2	164.5	-76.6	156.2	1.3	0	0	117.4
785	Q	28.6	Very low	30.2	Very low	169 Å²	169	129.2 Å²	129.2	79%	0.79	75%	0.748	S	S	*	*				89	153.1	51	-73.2	177.6	5.6	0	0	113.8
786	S	28.3	Very low	29.8	Very low	116 Å²	116	129.3 Å²	129.3	81%	0.811	75%	0.747	S	S	*	*			trans	64.6	127.8	-165.2	63.3	0	0	0	0	113.6
787	A	26.7	Very low	29.5	Very low	86 Å²	86	131.6 Å²	131.6	71%	0.711	75%	0.749	S	S	*	*			cis	85.7	147.2	43.4	0	0	0	0	0	112.9
788	Q	28.6	Very low	29.6	Very low	183 Å²	183	130.2 Å²	130.2	86%	0.855	75%	0.749	S	S	*	*			trans	72.9	149.3	-160.7	-40.1	163.9	14.5	0	0	109.7
789	Q	27.9	Very low	29.6	Very low	179 Å²	179	128.7 Å²	128.7	84%	0.836	75%	0.746	S	S	*	*			cis	57.2	145.4	37.3	-76	-169.2	-15.9	0	0	113.9
790	P	29.8	Very low	29.5	Very low	110 Å²	110	130.5 Å²	130.5	71%	0.714	75%	0.75	S	S	*	*			cis	-126.2	-144.6	-28.2	40.2	-22.7	0	0	0	109.8
791	S	26	Very low	29.7	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	75%	0.748	S	S	*	*			trans	76.7	148.7	149.4	60.8	0	0	0	0	122.1
792	V	30.2	Very low	29.4	Very low	120 Å²	120	130.6 Å²	130.6	73%	0.727	75%	0.748	S	S	*	*			trans	-81.1	160.1	175.6	-64.6	0	0	0	0	112.3	V794	V792-V794 HydrophobicContact CB-CG2 4.4Å; V792-V794 HydrophobicContact CG2-CG2 4.06Å
793	P	31.1	Very low	29.7	Very low	119 Å²	119	131.2 Å²	131.2	77%	0.773	75%	0.753	S	S	*	*				-133.4	148.3	99.8	38.4	-29.3	0	0	0	111.8
794	V	27.3	Very low	30.1	Very low	110 Å²	110	130.3 Å²	130.3	67%	0.667	76%	0.758	S	S	*	*			cis	70.3	135	48.4	-178.4	0	0	0	0	113.3	V792	V792-V794 HydrophobicContact CB-CG2 4.4Å; V792-V794 HydrophobicContact CG2-CG2 4.06Å
795	T	29.9	Very low	30.7	Very low	129 Å²	129	128.4 Å²	128.4	79%	0.791	76%	0.758	S	S	*	*			trans	104.8	126.7	175.6	-47.1	0	0	0	0	113.5
796	M	28.8	Very low	30.9	Very low	153 Å²	153	126.4 Å²	126.4	75%	0.754	76%	0.757	S	S	*	*			cis	172.1	167.3	-27.7	-103.8	-86.3	-169.4	0	0	105.9
797	I	29.9	Very low	31	Very low	150 Å²	150	125.9 Å²	125.9	77%	0.769	75%	0.754	S	S	*	*			trans	65	102.3	165.2	-56.5	138.2	0	0	0	113.9
798	A	29.3	Very low	31.3	Very low	79 Å²	79	126.5 Å²	126.5	65%	0.653	76%	0.759	S	S	*	*			cis	71.6	110.4	44.4	0	0	0	0	0	115.4
799	N	31.8	Very low	31.3	Very low	139 Å²	139	126.7 Å²	126.7	74%	0.743	76%	0.76	S	S	*	*			trans	173.4	120.7	133.1	-95	6.7	0	0	0	109.5
800	I	32.2	Very low	31.5	Very low	151 Å²	151	123.9 Å²	123.9	77%	0.774	76%	0.757	S	S	*	*				98.9	140.3	70.5	-86.1	-179.5	0	0	0	110.7
801	P	36	Very low	31.5	Very low	113 Å²	113	127.1 Å²	127.1	73%	0.734	76%	0.763	S	S	*	*			trans	-131.5	-163.4	-139.1	43.8	-27.4	0	0	0	115
802	A	30.6	Very low	31.9	Very low	90 Å²	90	126.9 Å²	126.9	74%	0.744	76%	0.758	S	S	*	*			trans	73.3	150.4	167.7	0	0	0	0	0	114.8
803	M	34.4	Very low	31.7	Very low	182 Å²	182	127 Å²	127	90%	0.897	76%	0.759	S	S	*	*			cis	-150.7	164.5	46.7	-71.6	175	63.6	0	0	114.5
804	S	35.3	Very low	31.8	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	77%	0.765	S	S	*	*			trans	-94.6	-165.1	170.6	61.1	0	0	0	0	111.4
805	P	41.4	Very low	32.1	Very low	109 Å²	109	129 Å²	129	71%	0.708	77%	0.766	S	S	*	*			cis	-124.8	-159.1	-30.4	34.4	-15.1	0	0	0	110.8
806	T	33.4	Very low	32.3	Very low	126 Å²	126	128.3 Å²	128.3	77%	0.773	76%	0.764	S	S	*	*				157.4	153.6	121	-61.9	0	0	0	0	113.3
807	S	30.5	Very low	32.5	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	77%	0.767	S	S	*	*			trans	-73.6	161.1	-175.9	57	0	0	0	0	117.2
808	A	33.9	Very low	32.6	Very low	98 Å²	98	125.4 Å²	125.4	81%	0.81	77%	0.767	S	S	*	*				-170.8	151.5	123.8	0	0	0	0	0	114.7
809	Q	28.1	Very low	32.8	Very low	187 Å²	187	126.1 Å²	126.1	87%	0.874	77%	0.773	S	S	*	*			trans	-77	170.7	158.6	-83.4	179.4	-63	0	0	110.3
810	P	31.9	Very low	32.9	Very low	121 Å²	121	123.5 Å²	123.5	79%	0.786	77%	0.771	S	S	*	*			cis	-148.1	-169.3	32.8	40.1	-16.1	0	0	0	117.9
811	Q	30.2	Very low	33.1	Very low	177 Å²	177	123 Å²	123	83%	0.827	78%	0.775	S	S	*	*			trans	-76.9	-171.7	157.5	-49.2	-176.4	-22.4	0	0	110.1
812	P	34	Very low	33	Very low	104 Å²	104	123.4 Å²	123.4	68%	0.675	78%	0.777	S	S	*	*			cis	-137.9	-155.9	-3	37	-13.7	0	0	0	114.6
813	V	26.6	Very low	33.3	Very low	123 Å²	123	124.7 Å²	124.7	75%	0.745	78%	0.776	S	S	*	*			trans	78.6	134.8	152	-70.3	0	0	0	0	124.7
814	L	32	Very low	33.1	Very low	170 Å²	170	121.7 Å²	121.7	89%	0.89	77%	0.77	S	S	*	*			trans	91.7	148.2	147.3	-74.2	157	0	0	0	122
815	S	33.3	Very low	32.9	Very low	100 Å²	100	122 Å²	122	70%	0.699	77%	0.767	S	S	*	*			trans	-118	165.6	-172.3	56.6	0	0	0	0	110.8
816	P	35.4	Very low	32.4	Very low	115 Å²	115	122.6 Å²	122.6	75%	0.747	77%	0.769	S	S	*	*				-157.9	150.9	83.3	39.6	-18.2	0	0	0	120
817	T	32	Very low	32.1	Very low	131 Å²	131	124.2 Å²	124.2	80%	0.804	77%	0.77	S	S	*	*			trans	25.8	128.2	133	-27.4	0	0	0	0	124
818	S	32.2	Very low	32	Very low	112 Å²	112	126.2 Å²	126.2	78%	0.783	77%	0.771	S	S	*	*				142.4	145.8	108.5	-151.4	0	0	0	0	118.9
819	A	34.1	Very low	31.6	Very low	94 Å²	94	130.2 Å²	130.2	78%	0.777	77%	0.772	S	S	*	*			trans	70	147.7	155.8	0	0	0	0	0	121.9
820	A	33.4	Very low	32.1	Very low	84 Å²	84	126.9 Å²	126.9	69%	0.694	76%	0.764	S	S	*	*			cis	-174.1	129.3	-20.2	0	0	0	0	0	113.9
821	V	35.8	Very low	32	Very low	141 Å²	141	126.5 Å²	126.5	86%	0.855	76%	0.762	S	S	*	*			trans	42.9	163	153.1	-83.3	0	0	0	0	122.7
822	P	35.3	Very low	32	Very low	121 Å²	121	126 Å²	126	79%	0.786	76%	0.757	S	S	*	*			cis	-126.1	-179.5	6.2	41	-24.5	0	0	0	117.1
823	V	35.2	Very low	32.1	Very low	117 Å²	117	126.5 Å²	126.5	71%	0.709	76%	0.76	S	S	*	*			trans	-124.9	163.8	179.5	-144.6	0	0	0	0	110.4
824	P	31.1	Very low	32.3	Very low	119 Å²	119	126.1 Å²	126.1	77%	0.773	76%	0.763	S	S	*	*				-141.2	146	102.5	39.5	-26.6	0	0	0	112.8
825	T	30.9	Very low	32.3	Very low	107 Å²	107	126.1 Å²	126.1	66%	0.656	76%	0.759	S	S	*	*			cis	68	109.3	48.7	-45	0	0	0	0	111.7
826	T	30.4	Very low	32.3	Very low	122 Å²	122	128.4 Å²	128.4	75%	0.748	76%	0.762	S	S	*	*				-175.7	117.6	87.5	-57.3	0	0	0	0	107
827	M	27.7	Very low	32.1	Very low	159 Å²	159	128.3 Å²	128.3	78%	0.783	76%	0.761	S	S	*	*				70.6	136.1	81.8	-92.3	-72.4	-173.8	0	0	117.6
828	I	27.7	Very low	32	Very low	149 Å²	149	128.3 Å²	128.3	76%	0.764	76%	0.76	S	S	*	*			trans	89.8	103	149.8	-66.3	163	0	0	0	121.5
829	H	27.3	Very low	31.9	Very low	181 Å²	181	130.6 Å²	130.6	84%	0.838	76%	0.758	S	S	*	*				81.2	135.2	122.2	-155.6	81.3	0	0	0	124.7
830	V	37.7	Very low	31.8	Very low	117 Å²	117	132.1 Å²	132.1	71%	0.709	75%	0.754	S	S	*	*			trans	-58.2	140.3	171.9	170.5	0	0	0	0	113.1
831	P	30.2	Very low	31.6	Very low	113 Å²	113	134.4 Å²	134.4	73%	0.734	76%	0.759	S	S	*	*				-161.4	-171	98.1	42.8	-20.3	0	0	0	119.1
832	K	28.9	Very low	31.4	Very low	166 Å²	166	131.8 Å²	131.8	72%	0.722	75%	0.752	S	S	*	*			trans	-50.7	165.8	-178.9	-103.6	-168.6	170.3	-178.3	0	117.9
833	P	37.3	Very low	31.3	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	75%	0.749	S	S	*	*			trans	-86.9	170	-162.8	36.8	-39.7	0	0	0	117.1
834	S	31.3	Very low	31.1	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	75%	0.754	S	S	*	*			trans	-162.4	169.1	166.5	-68.3	0	0	0	0	111.5
835	E	30.4	Very low	31.2	Very low	170 Å²	170	130.7 Å²	130.7	79%	0.794	75%	0.75	S	S	*	*			trans	-106.5	161.2	-166.2	-66.3	172.3	101.3	0	0	116.3
836	I	33.6	Very low	31.3	Very low	148 Å²	148	130 Å²	130	76%	0.759	76%	0.755	S	S	*	*			trans	68.3	158.3	147.2	-71.3	159.4	0	0	0	117.1
837	P	32.4	Very low	31.5	Very low	113 Å²	113	129.7 Å²	129.7	73%	0.734	76%	0.755	S	S	*	*			cis	-123.9	170.1	-8.2	28.2	-6.8	0	0	0	117.9
838	V	29.4	Very low	31.7	Very low	130 Å²	130	128.4 Å²	128.4	79%	0.788	76%	0.756	S	S	*	*			trans	-31.4	146.1	153.2	-147.7	0	0	0	0	118.3
839	Q	30.7	Very low	31.9	Very low	160 Å²	160	125.3 Å²	125.3	75%	0.748	75%	0.753	S	S	*	*				173	134.5	115.6	-96.9	-164.7	-32.8	0	0	118.6
840	N	30.9	Very low	32.3	Very low	126 Å²	126	119.1 Å²	119.1	67%	0.674	73%	0.733	S	S	*	*			trans	65.5	165.7	147.6	-50	-15.1	0	0	0	118.4
841	V	30.6	Very low	32.2	Very low	132 Å²	132	120.8 Å²	120.8	80%	0.8	74%	0.738	S	S	*	*			cis	-144.1	132.7	17	-179.9	0	0	0	0	112.8
842	A	31	Very low	32.3	Very low	86 Å²	86	122.5 Å²	122.5	71%	0.711	74%	0.741	S	S	*	*			trans	62	166.7	156.3	0	0	0	0	0	119
843	T	32.6	Very low	32.7	Very low	117 Å²	117	120.8 Å²	120.8	72%	0.718	74%	0.744	S	S	*	*			cis	-151.7	135.1	15.3	-35	0	0	0	0	112.7
844	T	31.7	Very low	32.8	Very low	135 Å²	135	120.6 Å²	120.6	83%	0.828	74%	0.743	S	S	*	*			trans	51.8	148	155.2	50	0	0	0	0	121.7
845	A	32.4	Very low	33.5	Very low	83 Å²	83	120.3 Å²	120.3	69%	0.686	74%	0.738	S	S	*	*			cis	-166.9	133.9	-18.3	0	0	0	0	0	111.1
846	A	32.5	Very low	33.6	Very low	91 Å²	91	117.7 Å²	117.7	75%	0.752	74%	0.739	S	S	*	*				36.3	160.2	126	0	0	0	0	0	123
847	P	35.3	Very low	33.8	Very low	116 Å²	116	116.2 Å²	116.2	75%	0.753	74%	0.739	S	S	*	*			cis	-147.7	-169.1	-38.2	39.3	-18.7	0	0	0	115.9
848	V	31.4	Very low	33.9	Very low	132 Å²	132	115.4 Å²	115.4	80%	0.8	74%	0.742	S	S	*	*			trans	96.3	114.6	149.6	178.4	0	0	0	0	122.8
849	A	33.1	Very low	34.2	Very low	85 Å²	85	114.5 Å²	114.5	70%	0.702	74%	0.738	S	S	*	*			trans	59.4	164.3	141.3	0	0	0	0	0	124.1
850	A	35.3	Very low	34.1	Very low	51 Å²	51	116.4 Å²	116.4	42%	0.421	74%	0.744	S	S	.	*			cis	-171	147	-37.1	0	0	0	0	0	115
851	N	35	Very low	34	Very low	151 Å²	151	119 Å²	119	81%	0.807	75%	0.749	S	S	*	*			trans	64.2	142.6	144.3	-71.7	1.6	0	0	0	126.2
852	N	32.9	Very low	33.9	Very low	149 Å²	149	118.4 Å²	118.4	80%	0.797	75%	0.747	S	S	*	*			trans	105.5	152.7	143.7	-72.8	-1.7	0	0	0	123.5
853	V	37.6	Very low	33.9	Very low	131 Å²	131	123 Å²	123	79%	0.794	75%	0.753	S	S	*	*			trans	-169.9	168.3	-146.8	170.8	0	0	0	0	106.9
854	P	39.1	Very low	33.6	Very low	112 Å²	112	124.2 Å²	124.2	73%	0.727	76%	0.755	S	S	*	*			cis	-117.7	-130.7	-31.4	37.7	-16.5	0	0	0	109.9
855	P	45	Very low	33.7	Very low	109 Å²	109	123.8 Å²	123.8	71%	0.708	75%	0.747	S	S	*	*			cis	-133.6	166.9	-31.6	36.9	-18.6	0	0	0	118
856	S	32.9	Very low	33.5	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	75%	0.751	S	S	*	*			trans	34.3	135	142.7	-138.6	0	0	0	0	122
857	P	37.4	Very low	33.2	Very low	117 Å²	117	129.1 Å²	129.1	76%	0.76	75%	0.751	S	S	*	*				-155.7	168.3	78.2	42.2	-23.3	0	0	0	119
858	A	34.8	Very low	33.1	Very low	96 Å²	96	129.8 Å²	129.8	79%	0.793	76%	0.755	S	S	*	*			trans	56.3	151.5	151.1	0	0	0	0	0	122.4
859	P	36	Very low	32.9	Very low	111 Å²	111	129.2 Å²	129.2	72%	0.721	75%	0.752	S	S	*	*			trans	-110.9	147.5	-179.3	39.2	-31.1	0	0	0	115.6
860	F	29	Very low	33	Very low	199 Å²	199	133.1 Å²	133.1	87%	0.873	76%	0.76	S	S	*	*			trans	178.7	141.5	136.9	-96.5	-58.8	0	0	0	113.2
861	K	27.9	Very low	32.7	Very low	180 Å²	180	133.9 Å²	133.9	78%	0.783	77%	0.766	S	S	*	*			trans	57.6	116.5	150	-75.3	-171	175.9	-174	0	123.6
862	T	29	Very low	32.5	Very low	121 Å²	121	134.5 Å²	134.5	74%	0.742	76%	0.764	S	S	*	*			trans	72.5	152.4	131.8	-29.7	0	0	0	0	120.8
863	E	30.9	Very low	32.4	Very low	181 Å²	181	133.6 Å²	133.6	85%	0.846	76%	0.759	S	S	*	*			trans	67.2	152.5	173.9	-59.2	-175.4	179.9	0	0	116.3
864	D	27.4	Very low	31.9	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	76%	0.757	S	S	*	*			cis	-162.3	-173.8	-37	-165	-4.8	0	0	0	106.7
865	I	33.5	Very low	31.3	Very low	126 Å²	126	134.4 Å²	134.4	65%	0.646	76%	0.762	S	S	*	*			trans	74.9	95	156.5	-58.1	160.9	0	0	0	118.3
866	Q	28.1	Very low	30.5	Very low	165 Å²	165	132.9 Å²	132.9	77%	0.771	75%	0.753	S	S	*	*				52.8	118.8	126	-56.5	174.4	13.2	0	0	123
867	T	25.3	Very low	30.4	Very low	122 Å²	122	134 Å²	134	75%	0.748	74%	0.739	S	S	*	*			trans	70.3	152.8	138.6	48.7	0	0	0	0	119.4
868	P	33	Very low	29.9	Very low	129 Å²	129	132 Å²	132	84%	0.838	73%	0.725	S	S	*	*			cis	-118	140.2	22.9	39.3	-27	0	0	0	118
869	T	28.6	Very low	29.7	Very low	121 Å²	121	133.4 Å²	133.4	74%	0.742	72%	0.718	S	S	*	*			trans	-83.2	139.2	157.7	43.1	0	0	0	0	111.8
870	L	35	Very low	29.2	Very low	167 Å²	167	132.9 Å²	132.9	87%	0.874	72%	0.717	S	S	*	*			trans	-142.8	112.4	149.1	-129.9	68.7	0	0	0	104.8
871	A	29.2	Very low	29	Very low	67 Å²	67	129.3 Å²	129.3	55%	0.554	71%	0.711	S	S	*	*				67	125	56.6	0	0	0	0	0	112
872	Q	30.7	Very low	29	Very low	164 Å²	164	127.8 Å²	127.8	77%	0.766	71%	0.712	S	S	*	*			cis	-128.8	-169.9	-13.8	-57.6	92.4	-27.1	0	0	109.1
873	N	30.2	Very low	29	Very low	129 Å²	129	126.8 Å²	126.8	69%	0.69	72%	0.716	S	S	*	*			cis	-142.5	162	9.7	-101.1	-32.1	0	0	0	107.9
874	T	26.9	Very low	28.9	Very low	123 Å²	123	123.3 Å²	123.3	76%	0.755	71%	0.712	S	S	*	*			cis	73.1	72.6	14.3	-43.3	0	0	0	0	116
875	V	27.4	Very low	28.9	Very low	137 Å²	137	120.1 Å²	120.1	83%	0.83	71%	0.713	S	S	*	*			trans	-150.3	159.6	152.8	-101.4	0	0	0	0	109.3
876	P	27.2	Very low	28.5	Very low	78 Å²	78	122.1 Å²	122.1	51%	0.506	72%	0.724	S	S	.	*			trans	-117.8	-172.1	-140.7	44.6	-39.3	0	0	0	116.1	T878	P876-T878 VanDerWaalsContact CG-OG1 3.27Å; P876-T878 WeakPolarHBondContact CG-OG1 3.3Å
877	R	31.3	Very low	28.3	Very low	139 Å²	139	119.5 Å²	119.5	53%	0.525	72%	0.719	S	S	.	*			trans	-73.1	124.7	142.1	-66.9	175.5	177.5	152.7	-12	105.9	E712 K716	E712-R877 IonicContact OE1-CZ 3.57Å; E712-R877 IonicContact OE1-NH1 3.82Å; E712-R877 PolarHBondContact OE1-NH1 3.08Å; E712-R877 IonicContact OE1-NH2 2.68Å; E712-R877 PolarHBondContact OE1-NH2 3.14Å; E712-R877 IonicContact OE2-CZ 2.76Å; E712-R877 IonicContact OE2-NH1 2.82Å; E712-R877 IonicContact OE2-NH2 3.93Å; E712-R877 PolarHBondContact OE2-NH2 3.01Å; E712-R877 VanDerWaalsContact OE2-NH2 3.09Å; K716-R877 HydrophobicContact CD-CB 3.87Å; K716-R877 HydrophobicContact CD-CG 4.36Å; K716-R877 WeakPolarHBondContact CE-O 2.92Å
878	T	26.6	Very low	28.4	Very low	75 Å²	75	121.6 Å²	121.6	46%	0.46	72%	0.724	S	S	.	*			trans	-147.1	153.8	145.7	-23.9	0	0	0	0	107.9	P876	P876-T878 VanDerWaalsContact CG-OG1 3.27Å; P876-T878 WeakPolarHBondContact CG-OG1 3.3Å
879	I	30.2	Very low	28.1	Very low	124 Å²	124	121.9 Å²	121.9	64%	0.636	72%	0.718	S	S	*	*			trans	-76.7	138.1	164.7	-64.5	161.8	0	0	0	107.9	A713	A713-I879 HydrophobicContact CB-CD1 4.13Å
880	S	25.2	Very low	27.9	Very low	101 Å²	101	122.4 Å²	122.4	71%	0.706	72%	0.721	S	S	*	*			trans	175.4	118.4	148.8	-98.8	0	0	0	0	107.1
881	T	26.5	Very low	27.8	Very low	123 Å²	123	120.1 Å²	120.1	76%	0.755	72%	0.717	S	S	*	*				53.2	87.5	72.7	70.8	0	0	0	0	112.5
882	D	27.2	Very low	27.8	Very low	149 Å²	149	121 Å²	121	80%	0.797	72%	0.724	S	S	*	*			trans	-115	111.7	154	-161.3	-22.6	0	0	0	107.7	S884	D882-S884 PolarHBondContact OD1-OG 3.39Å
883	A	27.8	Very low	27.6	Very low	99 Å²	99	118.1 Å²	118.1	82%	0.818	72%	0.721	S	S	*	*			trans	-106.3	87.3	-175.7	0	0	0	0	0	109
884	S	30.1	Very low	27.5	Very low	109 Å²	109	119.7 Å²	119.7	76%	0.762	73%	0.728	S	S	*	*			trans	-121.8	113.1	172.3	-70.4	0	0	0	0	108.4	D882	D882-S884 PolarHBondContact OD1-OG 3.39Å
885	G	26.7	Very low	27.6	Very low	76 Å²	76	118.2 Å²	118.2	78%	0.784	73%	0.728	S	S	*	*			cis	109.2	52.3	10.6	0	0	0	0	0	112
886	L	25.7	Very low	27.8	Very low	168 Å²	168	117 Å²	117	88%	0.88	73%	0.726	S	S	*	*			trans	-135.4	131.7	163	-149.8	74.9	0	0	0	111.4
887	V	24.6	Very low	28.2	Very low	110 Å²	110	119.3 Å²	119.3	67%	0.667	74%	0.741	S	S	*	*			trans	-62.1	127.7	-179.4	175.1	0	0	0	0	110.9	N889	V887-N889 HydrophobicContact CG1-CB 4.31Å; V887-N889 WeakPolarHBondContact CG1-OD1 3.44Å
888	I	26.2	Very low	28.3	Very low	166 Å²	166	117.9 Å²	117.9	85%	0.851	75%	0.752	S	S	*	*			trans	-119.4	93.2	151.3	-59.4	-176.2	0	0	0	107.5
889	N	27.3	Very low	28.8	Very low	134 Å²	134	119.4 Å²	119.4	72%	0.717	76%	0.764	S	S	*	*			trans	-66.7	144.5	161.6	-71.4	-18.7	0	0	0	108.6	V887	V887-N889 HydrophobicContact CG1-CB 4.31Å; V887-N889 WeakPolarHBondContact CG1-OD1 3.44Å
890	T	24.2	Very low	28.9	Very low	132 Å²	132	118 Å²	118	81%	0.81	77%	0.77	S	S	*	*			trans	-60.2	160.1	154.4	47.2	0	0	0	0	110
891	P	33.4	Very low	29.6	Very low	120 Å²	120	118.7 Å²	118.7	78%	0.779	77%	0.772	S	S	*	*			cis	-138.1	-167.7	17.7	41.1	-21.8	0	0	0	115.8
892	A	27.7	Very low	30.1	Very low	85 Å²	85	118.3 Å²	118.3	70%	0.702	78%	0.775	S	S	*	*			trans	96.1	108.3	145.1	0	0	0	0	0	121.2
893	S	27.3	Very low	30.5	Very low	103 Å²	103	115.5 Å²	115.5	72%	0.72	77%	0.772	S	S	*	*				87.7	118.2	122.3	-68.6	0	0	0	0	123
894	I	27.9	Very low	30.8	Very low	163 Å²	163	116.7 Å²	116.7	84%	0.836	77%	0.769	S	S	*	*			trans	74.7	138.4	133.9	-60.3	167.3	0	0	0	117.5
895	A	28.3	Very low	31	Very low	91 Å²	91	118.1 Å²	118.1	75%	0.752	77%	0.769	S	S	*	*			cis	-168.5	167.4	-25.4	0	0	0	0	0	110.1
896	S	31.9	Very low	31.3	Very low	113 Å²	113	120.8 Å²	120.8	79%	0.79	77%	0.769	S	S	*	*			trans	-91.9	-164.3	176.5	-28.8	0	0	0	0	112.3
897	P	36.3	Very low	31.8	Very low	125 Å²	125	117.2 Å²	117.2	81%	0.812	76%	0.764	S	S	*	*			cis	-139.6	-165.9	-19.4	37.9	-15.7	0	0	0	116.1
898	S	32.6	Very low	32.2	Very low	109 Å²	109	116.8 Å²	116.8	76%	0.762	77%	0.766	S	S	*	*			trans	-36.8	-169.5	163.1	-135.2	0	0	0	0	119.8
899	P	37.1	Very low	32.5	Very low	108 Å²	108	115.3 Å²	115.3	70%	0.701	77%	0.765	S	S	*	*			cis	-148.1	170.9	-1.1	43.2	-22.5	0	0	0	121.2
900	A	33.8	Very low	32.9	Very low	93 Å²	93	115.5 Å²	115.5	77%	0.769	77%	0.771	S	S	*	*			trans	60.3	178.9	139.3	0	0	0	0	0	123.4
901	P	39.9	Very low	33.3	Very low	116 Å²	116	113.3 Å²	113.3	75%	0.753	77%	0.767	S	S	*	*				-137.4	170.6	-65.2	40.4	-25	0	0	0	117.6
902	S	35.6	Very low	33.7	Very low	116 Å²	116	113.2 Å²	113.2	81%	0.811	77%	0.766	S	S	*	*			trans	133.7	130.4	137.1	-55.8	0	0	0	0	121.5
903	A	35.3	Very low	34.1	Very low	90 Å²	90	115.5 Å²	115.5	74%	0.744	77%	0.771	S	S	*	*			trans	79.2	128.5	138.4	0	0	0	0	0	127.6
904	T	35.7	Very low	34.4	Very low	123 Å²	123	116.8 Å²	116.8	76%	0.755	77%	0.774	S	S	*	*			trans	76	114.7	138.2	45.2	0	0	0	0	127.3
905	D	33.4	Very low	35	Very low	140 Å²	140	114.2 Å²	114.2	75%	0.749	77%	0.768	S	S	*	*				100.5	132.7	121.6	-84.7	-45.4	0	0	0	128.9
906	V	33.7	Very low	35.3	Very low	132 Å²	132	114.2 Å²	114.2	80%	0.8	77%	0.769	S	S	*	*			trans	59	141.6	153.3	-60.2	0	0	0	0	128.3
907	A	35.2	Very low	35.8	Very low	93 Å²	93	114.2 Å²	114.2	77%	0.769	77%	0.766	S	S	*	*			trans	85.2	157.8	153.4	0	0	0	0	0	121.7
908	S	32.7	Very low	35.8	Very low	101 Å²	101	115.2 Å²	115.2	71%	0.706	77%	0.77	S	S	*	*			cis	-173.3	151.7	-28.8	-89.2	0	0	0	0	115.1
909	T	32.5	Very low	36.1	Very low	134 Å²	134	115.4 Å²	115.4	82%	0.822	77%	0.768	S	S	*	*			trans	65.2	170.4	158.3	47.1	0	0	0	0	119.4
910	T	36.4	Very low	35.9	Very low	138 Å²	138	117 Å²	117	85%	0.847	78%	0.776	S	S	*	*			cis	-151.7	-151.9	18.8	-28.1	0	0	0	0	114.2
911	A	33.3	Very low	35.9	Very low	87 Å²	87	118.8 Å²	118.8	72%	0.719	78%	0.778	S	S	*	*			trans	-155.3	-163.6	-175.1	0	0	0	0	0	111.6
912	P	40.6	Very low	35.3	Very low	117 Å²	117	119.1 Å²	119.1	76%	0.76	78%	0.778	S	S	*	*			cis	-146.2	-162.4	-1.7	34.2	-7.3	0	0	0	118.3
913	V	37.3	Very low	35.2	Very low	134 Å²	134	120 Å²	120	81%	0.812	78%	0.779	S	S	*	*			trans	111.7	147.2	152.8	-166.2	0	0	0	0	120.3
914	T	33.8	Very low	34.8	Very low	129 Å²	129	123.3 Å²	123.3	79%	0.791	78%	0.784	S	S	*	*			trans	-137	-160.6	-161.4	-3	0	0	0	0	111.1
915	P	40.3	Very low	34.6	Very low	109 Å²	109	121.4 Å²	121.4	71%	0.708	79%	0.788	S	S	*	*			cis	-141.4	158.8	-20.3	35.1	-13.9	0	0	0	119.3
916	A	33.8	Very low	34.3	Very low	92 Å²	92	118.4 Å²	118.4	76%	0.76	79%	0.791	S	S	*	*			trans	54.7	-178.9	131.7	0	0	0	0	0	123.5
917	P	43.1	Very low	34.1	Very low	112 Å²	112	117.1 Å²	117.1	73%	0.727	79%	0.794	S	S	*	*				-138.4	166.5	-68.7	41	-25.8	0	0	0	116.9
918	T	36.1	Very low	33.9	Very low	146 Å²	146	117.7 Å²	117.7	90%	0.896	80%	0.798	S	S	*	*			trans	179.5	155.6	135.5	19.4	0	0	0	0	113.3
919	P	38	Very low	33.7	Very low	113 Å²	113	117.4 Å²	117.4	73%	0.734	80%	0.803	S	S	*	*			trans	-123.9	158.5	-175.6	41.3	-29.4	0	0	0	116.5
920	T	32.8	Very low	33.5	Very low	141 Å²	141	115.5 Å²	115.5	87%	0.865	80%	0.8	S	S	*	*			trans	-166.5	144.9	157.1	-4.5	0	0	0	0	115.8
921	T	33.8	Very low	33	Very low	132 Å²	132	114 Å²	114	81%	0.81	80%	0.796	S	S	*	*			trans	68.2	131.1	149.4	-32.8	0	0	0	0	123.4
922	T	28.2	Very low	32.6	Very low	122 Å²	122	116.3 Å²	116.3	75%	0.748	80%	0.801	S	S	*	*			trans	-64.4	154.7	168.9	-38.7	0	0	0	0	115.5
923	T	33.3	Very low	32	Very low	136 Å²	136	117.3 Å²	117.3	83%	0.834	81%	0.805	S	S	*	*			trans	-171.4	151	137.8	-70.4	0	0	0	0	110.4
924	D	27.3	Very low	31.6	Very low	159 Å²	159	117 Å²	117	85%	0.85	80%	0.804	S	S	*	*			trans	-72.1	163.8	178.7	-57.1	-90.7	0	0	0	115.6
925	G	30.4	Very low	31.3	Very low	82 Å²	82	120.1 Å²	120.1	85%	0.845	81%	0.809	S	S	*	*			trans	170.2	105	169.5	0	0	0	0	0	115.4
926	G	27.8	Very low	30.6	Very low	78 Å²	78	122.4 Å²	122.4	80%	0.804	82%	0.815	S	S	*	*			trans	-87.5	156.6	-163.7	0	0	0	0	0	120.5
927	A	29.8	Very low	30.4	Very low	105 Å²	105	127.9 Å²	127.9	87%	0.868	82%	0.822	S	S	*	*			trans	85.8	150.6	135.9	0	0	0	0	0	122.1
928	A	29.5	Very low	29.7	Very low	104 Å²	104	129.8 Å²	129.8	86%	0.86	82%	0.821	S	S	*	*			trans	71.9	136.2	170	0	0	0	0	0	118
929	A	29.4	Very low	29.4	Very low	96 Å²	96	131.5 Å²	131.5	79%	0.793	82%	0.819	S	S	*	*			cis	-163.4	172.9	-12.1	0	0	0	0	0	112.5
930	A	27.5	Very low	29.1	Very low	94 Å²	94	133 Å²	133	78%	0.777	81%	0.814	S	S	*	*			trans	89.1	142.4	157	0	0	0	0	0	121.6
931	S	26.2	Very low	28.9	Very low	107 Å²	107	138 Å²	138	75%	0.748	82%	0.817	S	S	*	*			trans	80	134.8	166.9	74.4	0	0	0	0	120.4
932	T	25.7	Very low	29	Very low	135 Å²	135	140.6 Å²	140.6	83%	0.828	82%	0.817	S	S	*	*			trans	47.3	97	165.8	44.1	0	0	0	0	119.1
933	T	28.2	Very low	29	Very low	137 Å²	137	140.6 Å²	140.6	84%	0.84	82%	0.822	S	S	*	*			trans	-152.8	147.8	150.9	-24.4	0	0	0	0	111.9
934	T	28.6	Very low	29.2	Very low	129 Å²	129	140.2 Å²	140.2	79%	0.791	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.1	123.7	176.8	49.2	0	0	0	0	111.5
935	E	26.5	Very low	30	Very low	194 Å²	194	139 Å²	139	91%	0.907	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-98.6	139.5	179.8	-67.1	-152.9	125.6	0	0	114.3
936	N	26.7	Very low	31.5	Very low	156 Å²	156	140.4 Å²	140.4	83%	0.834	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-93.2	158.1	-174.3	-63.8	-84.5	0	0	0	111.6
937	K	30	Very low	34	Very low	207 Å²	207	142.3 Å²	142.3	90%	0.9	77%	0.768	S	S	*	*			trans	-129.9	68.5	175	-145.7	163.1	-169.4	168.6	0	115.6
938	E	28.7	Very low	36.7	Very low	152 Å²	152	137.4 Å²	137.4	71%	0.71	73%	0.727	S	S	*	*			trans	59.7	75.9	138.7	-153.2	-177.2	163.7	0	0	118.8	K940	E938-K940 PolarHBondContact O-N 3.21Å
939	E	28.1	Very low	39.7	Very low	183 Å²	183	133.5 Å²	133.5	86%	0.855	69%	0.693	S	S	*	*			trans	-65.4	109.9	159.8	-78.3	-162.3	117.7	0	0	111.5	R941	E939-R941 PolarHBondContact O-N 2.85Å
940	K	32.5	Very low	42.7	Very low	144 Å²	144	129 Å²	129	63%	0.626	66%	0.655	S	S	*	*			trans	-83.2	78.6	-177.5	-160.7	154.2	-169.1	154.5	0	113.9	E938	E938-K940 PolarHBondContact O-N 3.21Å
941	R	28.8	Very low	45.9	Very low	245 Å²	245	125.9 Å²	125.9	93%	0.925	63%	0.625	S	S	*	*			trans	28	96.7	155.5	-67.6	-176.3	173.4	-171.3	-3.2	116.8	E939	E939-R941 PolarHBondContact O-N 2.85Å
942	K	35	Very low	49	Very low	188 Å²	188	120.9 Å²	120.9	82%	0.817	59%	0.589	S	S	*	*			trans	-121	130.5	157	-162.3	170.3	-174.1	175.5	0	108.9	N944	K942-N944 VanDerWaalsContact C-N 3.27Å; K942-N944 PolarHBondContact O-N 2.8Å
943	S	30.2	Very low	52.1	Low	122 Å²	122	118.1 Å²	118.1	85%	0.853	57%	0.569	S	S	*	*			trans	-78.8	63.8	-166.3	58.5	0	0	0	0	113.8	K945	S943-K945 PolarHBondContact O-N 2.92Å
944	N	36.6	Very low	54.9	Low	127 Å²	127	112.4 Å²	112.4	68%	0.679	54%	0.538	S	S	*	.			trans	-73.4	113.9	169.1	-71.2	1.7	0	0	0	109.2	K942 R946	K942-N944 VanDerWaalsContact C-N 3.27Å; K942-N944 PolarHBondContact O-N 2.8Å; N944-R946 PolarHBondContact O-N 2.73Å; N944-R946 VanDerWaalsContact O-N 3.17Å
945	K	43.8	Very low	57.5	Low	134 Å²	134	107.9 Å²	107.9	58%	0.583	51%	0.511	S	S	*	.			trans	-57.7	117.8	170.5	-65.7	-163.1	174	-138.1	0	109.1	S943 K947 V1033 D1035	S943-K945 PolarHBondContact O-N 2.92Å; K945-K947 PolarHBondContact O-N 2.85Å; K945-V1033 HydrophobicContact CB-CG1 4.16Å; K945-V1033 HydrophobicContact CD-CG1 4.32Å; K945-D1035 WeakPolarHBondContact CE-OD1 3.4Å; K945-D1035 IonicContact NZ-OD1 2.64Å; K945-D1035 PolarHBondContact NZ-OD1 3.43Å; K945-D1035 IonicContact NZ-OD2 2.92Å; K945-D1035 PolarHBondContact NZ-OD2 3.3Å
946	R	62.4	Low	59.9	Low	111 Å²	111	100.7 Å²	100.7	42%	0.419	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	112.1	-172.5	-59.6	-179.6	-179.8	-165.1	-4.5	108.7	N944 L1034	N944-R946 PolarHBondContact O-N 2.73Å; N944-R946 VanDerWaalsContact O-N 3.17Å; R946-L1034 HydrophobicContact CB-CB 4.16Å; R946-L1034 HydrophobicContact CB-CD1 4.04Å; R946-L1034 WeakPolarHBondContact O-CB 3.25Å; R946-L1034 PolarHBondContact O-N 3.41Å
947	K	79.9	Confident	62	Low	119 Å²	119	98.3 Å²	98.3	52%	0.517	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.2	176.2	-163.3	-177.1	-175.6	-173.3	0	109.9	K945 V949 T1032 V1033	K945-K947 PolarHBondContact O-N 2.85Å; K947-V949 HydrophobicContact CD-CG2 3.78Å; K947-V949 HydrophobicContact CG-CG2 3.86Å; K947-T1032 WeakPolarHBondContact CA-O 3.09Å; K947-V1033 HydrophobicContact CG-CG2 4.31Å
948	V	87.5	Confident	63.4	Low	1 Å²	1	93.3 Å²	93.3	1%	0.006	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.4	169.3	-179.4	0	0	0	0	107.4	L968 I1006 V1007 Q1010 A1031 T1032	V948-L968 HydrophobicContact CG1-CD1 3.72Å; V948-I1006 HydrophobicContact CB-CG2 4.21Å; V948-I1006 HydrophobicContact CG1-CG2 4.31Å; V948-I1006 HydrophobicContact CG2-CD1 4.23Å; V948-V1007 HydrophobicContact CG1-CG2 4.28Å; V948-Q1010 PolarHBondContact O-NE2 3.22Å; V948-A1031 WeakPolarHBondContact O-CA 3.31Å; V948-T1032 PolarHBondContact N-O 2.75Å; V948-T1032 PolarHBondContact O-N 3.11Å
949	V	91.8	Very high	64.9	Low	23 Å²	23	93 Å²	93	14%	0.139	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137	-176.4	-175.3	0	0	0	0	109.9	K947 L968 D969 L1030 A1031	K947-V949 HydrophobicContact CD-CG2 3.78Å; K947-V949 HydrophobicContact CG-CG2 3.86Å; V949-L968 CarbonylContact O-C 3.53Å; V949-L968 WeakPolarHBondContact O-CA 3.29Å; V949-D969 HydrophobicContact CB-CB 4.39Å; V949-D969 PolarHBondContact N-O 3.03Å; V949-D969 PolarHBondContact O-N 2.96Å; V949-L1030 CarbonylContact C-O 3.52Å; V949-L1030 VanDerWaalsContact CA-O 3.31Å; V949-L1030 WeakPolarHBondContact CA-O 3.36Å; V949-L1030 WeakPolarHBondContact CG1-O 3.49Å; V949-A1031 HydrophobicContact CG2-CB 4.2Å
950	M	93	Very high	66.4	Low	1 Å²	1	92 Å²	92	1%	0.005	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	138.5	173.3	-166.7	179.2	-59	0	0	110	C966 R967 L968 F977 V1007 Q1010 L1011 V1014 K1029 L1030	M950-C966 HydrophobicContact CG-CB 4.35Å; M950-R967 CarbonylContact C-O 3.53Å; M950-R967 VanDerWaalsContact CA-O 3.25Å; M950-R967 WeakPolarHBondContact CA-O 3.21Å; M950-L968 HydrophobicContact CE-CD1 4.22Å; M950-F977 HydrophobicContact SD-CZ 4.41Å; M950-V1007 HydrophobicContact CE-CB 4.44Å; M950-V1007 HydrophobicContact CE-CG1 3.89Å; M950-V1007 HydrophobicContact CE-CG2 4.42Å; M950-Q1010 HydrophobicContact CE-CB 3.73Å; M950-Q1010 HydrophobicContact SD-CB 4.2Å; M950-L1011 HydrophobicContact CE-CD2 4.41Å; M950-L1011 HydrophobicContact CE-CG 4.03Å; M950-L1011 HydrophobicContact SD-CD2 4.06Å; M950-L1011 HydrophobicContact SD-CG 4.21Å; M950-V1014 HydrophobicContact SD-CG2 3.99Å; M950-K1029 CarbonylContact O-C 3.54Å; M950-K1029 WeakPolarHBondContact O-CA 3.46Å; M950-L1030 HydrophobicContact CB-CB 4.49Å; M950-L1030 PolarHBondContact N-O 3.29Å; M950-L1030 PolarHBondContact O-N 2.86Å
951	E	93.2	Very high	67.8	Low	28 Å²	28	91.6 Å²	91.6	13%	0.131	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	122.4	-173.7	179	172.9	-168.3	0	0	110.1	L953 C966 R967 T1028 K1029	E951-L953 HydrophobicContact CG-CD2 4.31Å; E951-L953 PolarHBondContact O-N 2.76Å; E951-C966 CarbonylContact O-C 3.59Å; E951-C966 VanDerWaalsContact O-CA 3.3Å; E951-C966 WeakPolarHBondContact O-CA 3.37Å; E951-R967 HydrophobicContact CB-CB 4.43Å; E951-R967 PolarHBondContact N-O 3.49Å; E951-R967 PolarHBondContact O-N 3.42Å; E951-R967 IonicContact OE1-NH2 2.71Å; E951-R967 IonicContact OE2-CZ 2.76Å; E951-R967 IonicContact OE2-NE 2.7Å; E951-R967 PolarHBondContact OE2-NE 3.26Å; E951-R967 IonicContact OE2-NH2 2.91Å; E951-R967 PolarHBondContact OE2-NH2 2.69Å; E951-T1028 WeakPolarHBondContact CA-O 3.04Å; E951-K1029 HydrophobicContact CB-CG 4.01Å; E951-K1029 HydrophobicContact CG-CG 3.94Å; E951-K1029 WeakPolarHBondContact OE1-CE 3.43Å; E951-K1029 IonicContact OE1-NZ 2.72Å; E951-K1029 PolarHBondContact OE1-NZ 2.64Å; E951-K1029 VanDerWaalsContact OE1-NZ 3.11Å; E951-K1029 WeakPolarHBondContact OE2-CE 3.4Å; E951-K1029 IonicContact OE2-NZ 2.77Å; E951-K1029 PolarHBondContact OE2-NZ 3Å
952	I	92.8	Very high	69.9	Low	2 Å²	2	82 Å²	82	1%	0.01	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	116.4	177.7	-56.4	172.7	0	0	0	108	V964 V1014 L1017 I1018 G1025 G1027 T1028	I952-V964 HydrophobicContact CG2-CG1 4.41Å; I952-V1014 HydrophobicContact CD1-CB 4.37Å; I952-V1014 HydrophobicContact CD1-CG1 3.84Å; I952-V1014 HydrophobicContact CD1-CG2 4.07Å; I952-V1014 HydrophobicContact CG1-CG1 3.97Å; I952-V1014 HydrophobicContact CG1-CG2 4.03Å; I952-L1017 HydrophobicContact CD1-CD2 3.92Å; I952-I1018 HydrophobicContact CD1-CD1 4.18Å; I952-I1018 HydrophobicContact CD1-CG1 4.49Å; I952-I1018 HydrophobicContact CG2-CD1 4.12Å; I952-G1025 WeakPolarHBondContact CB-O 3.25Å; I952-G1025 WeakPolarHBondContact CD1-O 3.25Å; I952-G1027 WeakPolarHBondContact O-CA 3.43Å; I952-G1027 PolarHBondContact O-N 3.18Å; I952-T1028 PolarHBondContact N-O 2.81Å
953	L	90.6	Very high	72.3	Confident	77 Å²	77	74.7 Å²	74.7	40%	0.403	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-26.2	-176.8	-59.6	178.3	0	0	0	113.4	E951 S965 R967 T976	E951-L953 HydrophobicContact CG-CD2 4.31Å; E951-L953 PolarHBondContact O-N 2.76Å; L953-S965 PolarHBondContact N-O 2.87Å; L953-R967 HydrophobicContact CD1-CB 4.14Å; L953-R967 HydrophobicContact CD2-CB 4.11Å; L953-R967 HydrophobicContact CG-CB 4.25Å; L953-T976 HydrophobicContact CD1-CG2 3.91Å
954	G	86.6	Confident	75.1	Confident	18 Å²	18	68.9 Å²	68.9	19%	0.186	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.8	159.4	-177.2	0	0	0	0	0	113.2	S965	G954-S965 PolarHBondContact O-N 3.16Å
955	C	83.3	Confident	77.8	Confident	34 Å²	34	63.9 Å²	63.9	23%	0.23	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.7	172.3	-168.5	0	0	0	0	108.7	L963	C955-L963 WeakPolarHBondContact CA-O 3.31Å
956	D	77.6	Confident	80.1	Confident	42 Å²	42	57.5 Å²	57.5	23%	0.225	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	102.3	176.8	179.3	15.5	0	0	0	109.6	S958 R959 A962 L963	D956-S958 VanDerWaalsContact C-N 3.33Å; D956-S958 VanDerWaalsContact OD1-CB 3.23Å; D956-S958 WeakPolarHBondContact OD1-CB 3.33Å; D956-S958 PolarHBondContact OD1-N 2.92Å; D956-S958 PolarHBondContact OD1-OG 2.76Å; D956-S958 PolarHBondContact OD2-OG 3.5Å; D956-R959 IonicContact OD2-CZ 2.66Å; D956-R959 IonicContact OD2-NE 3.39Å; D956-R959 PolarHBondContact OD2-NE 2.83Å; D956-R959 IonicContact OD2-NH2 2.71Å; D956-R959 PolarHBondContact OD2-NH2 3.02Å; D956-A962 WeakPolarHBondContact O-CA 3.4Å; D956-L963 HydrophobicContact CB-CB 4.31Å; D956-L963 PolarHBondContact N-O 2.83Å; D956-L963 PolarHBondContact O-N 3.39Å
957	E	70.6	Confident	81.7	Confident	107 Å²	107	56.4 Å²	56.4	50%	0.5	29%	0.29	S	S	.	.			trans	-83.9	-2.4	175.6	-64.9	175.9	170.6	0	0	113	R959 K1023	E957-R959 PolarHBondContact O-N 2.63Å; E957-R959 VanDerWaalsContact O-N 3.12Å; E957-K1023 IonicContact OE1-NZ 2.75Å; E957-K1023 PolarHBondContact OE1-NZ 3.39Å; E957-K1023 WeakPolarHBondContact OE2-CE 3.48Å; E957-K1023 IonicContact OE2-NZ 3.5Å; E957-K1023 PolarHBondContact OE2-NZ 2.94Å
958	S	58.5	Low	82.3	Confident	101 Å²	101	50.7 Å²	50.7	71%	0.706	27%	0.266	S	S	*	.	S	Bend	trans	-77.3	6	-172.1	72.5	0	0	0	0	115	D956	D956-S958 VanDerWaalsContact C-N 3.33Å; D956-S958 VanDerWaalsContact OD1-CB 3.23Å; D956-S958 WeakPolarHBondContact OD1-CB 3.33Å; D956-S958 PolarHBondContact OD1-N 2.92Å; D956-S958 PolarHBondContact OD1-OG 2.76Å; D956-S958 PolarHBondContact OD2-OG 3.5Å
959	R	60.4	Low	82.5	Confident	147 Å²	147	52.7 Å²	52.7	56%	0.555	28%	0.276	S	S	*	.	S	Bend	trans	-130	159.9	-176.2	-48.3	-172.7	-160.3	-153.7	-2	110.5	D956 E957 F961	D956-R959 IonicContact OD2-CZ 2.66Å; D956-R959 IonicContact OD2-NE 3.39Å; D956-R959 PolarHBondContact OD2-NE 2.83Å; D956-R959 IonicContact OD2-NH2 2.71Å; D956-R959 PolarHBondContact OD2-NH2 3.02Å; E957-R959 PolarHBondContact O-N 2.63Å; E957-R959 VanDerWaalsContact O-N 3.12Å; R959-F961 CarbonylContact O-C 3.55Å; R959-F961 PolarHBondContact O-N 3.43Å
960	N	59.2	Low	82.3	Confident	162 Å²	162	52.4 Å²	52.4	87%	0.866	28%	0.275	S	S	*	.	S	Bend	trans	-56.9	-13.8	-177.6	-66.3	13	0	0	0	115.2
961	F	62.6	Low	81.5	Confident	135 Å²	135	55.8 Å²	55.8	59%	0.592	30%	0.298	S	S	*	.	S	Bend	trans	-130.7	131.2	168.3	-54.2	-81.7	0	0	0	108	R959 L963 A980 T983	R959-F961 CarbonylContact O-C 3.55Å; R959-F961 PolarHBondContact O-N 3.43Å; F961-L963 PolarHBondContact O-N 3.47Å; F961-A980 HydrophobicContact CB-CB 4.16Å; F961-T983 HydrophobicContact CD1-CG2 4.32Å; F961-T983 HydrophobicContact CE1-CG2 4.3Å
962	A	72.6	Confident	80.8	Confident	44 Å²	44	58.8 Å²	58.8	36%	0.364	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-63.4	121.1	176	0	0	0	0	0	110.1	D956 P981	D956-A962 WeakPolarHBondContact O-CA 3.4Å; A962-P981 VanDerWaalsContact O-CD 3.28Å; A962-P981 WeakPolarHBondContact O-CD 3.15Å
963	L	85.6	Confident	80.3	Confident	33 Å²	33	62.3 Å²	62.3	17%	0.173	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	120.2	-178.4	-74.2	176	0	0	0	111.1	C955 D956 F961 A980	C955-L963 WeakPolarHBondContact CA-O 3.31Å; D956-L963 HydrophobicContact CB-CB 4.31Å; D956-L963 PolarHBondContact N-O 2.83Å; D956-L963 PolarHBondContact O-N 3.39Å; F961-L963 PolarHBondContact O-N 3.47Å; L963-A980 HydrophobicContact CD2-CB 4.25Å
964	V	89.7	Confident	80.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	120.3	177.9	176.6	0	0	0	0	109.3	I952 Q978 F979 P981 V1014 I1018	I952-V964 HydrophobicContact CG2-CG1 4.41Å; V964-Q978 VanDerWaalsContact O-CA 3.26Å; V964-Q978 WeakPolarHBondContact O-CA 3.46Å; V964-F979 HydrophobicContact CB-CD1 4.32Å; V964-F979 HydrophobicContact CB-CE1 3.99Å; V964-F979 HydrophobicContact CB-CE2 4.48Å; V964-F979 HydrophobicContact CB-CZ 4.08Å; V964-F979 HydrophobicContact CG1-CD1 4.47Å; V964-F979 HydrophobicContact CG1-CE1 3.74Å; V964-F979 HydrophobicContact CG1-CZ 3.91Å; V964-F979 PolarHBondContact N-O 3.49Å; V964-F979 PolarHBondContact O-N 2.93Å; V964-F979 VanDerWaalsContact O-N 3.08Å; V964-P981 HydrophobicContact CB-CG 4.31Å; V964-P981 HydrophobicContact CG2-CG 3.37Å; V964-V1014 HydrophobicContact CG1-CG1 3.96Å; V964-I1018 HydrophobicContact CB-CD1 4.05Å; V964-I1018 HydrophobicContact CG1-CD1 3.37Å; V964-I1018 HydrophobicContact CG2-CD1 3.43Å; V964-I1018 VanDerWaalsContact CG2-CD1 3.43Å; V964-I1018 HydrophobicContact CG2-CG2 3.96Å
965	S	91.3	Very high	80.4	Confident	22 Å²	22	62.8 Å²	62.8	15%	0.154	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.9	172.9	-56.6	0	0	0	0	109.9	L953 G954 Q978	L953-S965 PolarHBondContact N-O 2.87Å; G954-S965 PolarHBondContact O-N 3.16Å; S965-Q978 WeakPolarHBondContact OG-CG 3.21Å; S965-Q978 PolarHBondContact OG-NE2 3.27Å
966	C	94	Very high	80.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.6	174.9	-74.9	0	0	0	0	111.7	M950 E951 T976 F977	M950-C966 HydrophobicContact CG-CB 4.35Å; E951-C966 CarbonylContact O-C 3.59Å; E951-C966 VanDerWaalsContact O-CA 3.3Å; E951-C966 WeakPolarHBondContact O-CA 3.37Å; C966-T976 CarbonylContact O-C 3.49Å; C966-T976 VanDerWaalsContact O-CA 3.28Å; C966-T976 WeakPolarHBondContact O-CA 3.26Å; C966-F977 HydrophobicContact CB-CE1 4.04Å; C966-F977 HydrophobicContact CB-CE2 4.17Å; C966-F977 HydrophobicContact CB-CZ 3.79Å; C966-F977 PolarHBondContact N-O 3.44Å; C966-F977 PolarHBondContact O-N 2.93Å
967	R	94.5	Very high	81.7	Confident	88 Å²	88	65.1 Å²	65.1	33%	0.332	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.3	159.1	177.7	164.9	64.3	-150.1	-2.2	109.1	M950 E951 L953 D969 V975 T976	M950-R967 CarbonylContact C-O 3.53Å; M950-R967 VanDerWaalsContact CA-O 3.25Å; M950-R967 WeakPolarHBondContact CA-O 3.21Å; E951-R967 HydrophobicContact CB-CB 4.43Å; E951-R967 PolarHBondContact N-O 3.49Å; E951-R967 PolarHBondContact O-N 3.42Å; E951-R967 IonicContact OE1-NH2 2.71Å; E951-R967 IonicContact OE2-CZ 2.76Å; E951-R967 IonicContact OE2-NE 2.7Å; E951-R967 PolarHBondContact OE2-NE 3.26Å; E951-R967 IonicContact OE2-NH2 2.91Å; E951-R967 PolarHBondContact OE2-NH2 2.69Å; L953-R967 HydrophobicContact CD1-CB 4.14Å; L953-R967 HydrophobicContact CD2-CB 4.11Å; L953-R967 HydrophobicContact CG-CB 4.25Å; R967-D969 WeakPolarHBondContact CD-OD1 3.18Å; R967-D969 IonicContact NE-OD1 2.64Å; R967-D969 IonicContact NE-OD2 3.17Å; R967-D969 PolarHBondContact NE-OD2 3.29Å; R967-V975 CarbonylContact C-O 3.47Å; R967-V975 WeakPolarHBondContact CA-O 3.28Å; R967-T976 HydrophobicContact CB-CG2 4.07Å; R967-T976 HydrophobicContact CG-CG2 4.29Å
968	L	94	Very high	82.7	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.8	172.2	164.5	64.2	0	0	0	108.4	V948 V949 M950 T970 S974 V975 F977 L993 L999 V1007	V948-L968 HydrophobicContact CG1-CD1 3.72Å; V949-L968 CarbonylContact O-C 3.53Å; V949-L968 WeakPolarHBondContact O-CA 3.29Å; M950-L968 HydrophobicContact CE-CD1 4.22Å; L968-T970 HydrophobicContact CD1-CG2 4.21Å; L968-T970 HydrophobicContact CG-CG2 4.17Å; L968-S974 CarbonylContact O-C 3.57Å; L968-S974 WeakPolarHBondContact O-CA 3.38Å; L968-V975 HydrophobicContact CB-CG1 3.88Å; L968-V975 HydrophobicContact CD2-CG1 4.04Å; L968-V975 HydrophobicContact CG-CG1 4.15Å; L968-V975 PolarHBondContact N-O 3.41Å; L968-V975 PolarHBondContact O-N 3.36Å; L968-F977 HydrophobicContact CB-CE1 3.86Å; L968-F977 HydrophobicContact CD2-CE1 4.33Å; L968-L993 HydrophobicContact CD2-CD1 3.85Å; L968-L999 HydrophobicContact CD2-CD1 4.32Å; L968-L999 HydrophobicContact CD2-CD2 4.15Å; L968-L999 HydrophobicContact CD2-CG 4.31Å; L968-V1007 HydrophobicContact CD1-CG2 3.87Å; L968-V1007 HydrophobicContact CD2-CG1 4.21Å; L968-V1007 HydrophobicContact CD2-CG2 3.91Å
969	D	90.9	Very high	84.3	Confident	42 Å²	42	60.6 Å²	60.6	23%	0.225	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	119.6	179.7	-63.2	-49.2	0	0	0	109.4	V949 R967 S974	V949-D969 HydrophobicContact CB-CB 4.39Å; V949-D969 PolarHBondContact N-O 3.03Å; V949-D969 PolarHBondContact O-N 2.96Å; R967-D969 WeakPolarHBondContact CD-OD1 3.18Å; R967-D969 IonicContact NE-OD1 2.64Å; R967-D969 IonicContact NE-OD2 3.17Å; R967-D969 PolarHBondContact NE-OD2 3.29Å; D969-S974 WeakPolarHBondContact OD1-CB 3.42Å; D969-S974 PolarHBondContact OD1-OG 3.03Å
970	T	86.8	Confident	85.7	Confident	18 Å²	18	54 Å²	54	11%	0.11	29%	0.29	C	S	.	.			trans	-116.7	177.3	178.5	74.8	0	0	0	0	111.1	L968 H972 K973 L999	L968-T970 HydrophobicContact CD1-CG2 4.21Å; L968-T970 HydrophobicContact CG-CG2 4.17Å; T970-H972 PolarHBondContact O-N 2.79Å; T970-H972 PolarHBondContact OG1-CE1 2.8Å; T970-H972 VanDerWaalsContact OG1-CE1 3.24Å; T970-H972 PolarHBondContact OG1-N 3.07Å; T970-H972 PolarHBondContact OG1-ND1 2.75Å; T970-K973 WeakPolarHBondContact CB-O 3.26Å; T970-K973 PolarHBondContact N-O 2.86Å; T970-K973 PolarHBondContact OG1-N 2.99Å; T970-K973 VanDerWaalsContact OG1-N 3.08Å; T970-K973 PolarHBondContact OG1-O 3.41Å; T970-L999 HydrophobicContact CG2-CD2 3.81Å
971	S	77.1	Confident	86.9	Confident	72 Å²	72	47 Å²	47	50%	0.503	25%	0.254	S	S	.	.	S	Bend	trans	-62.5	-9.7	177.7	67.8	0	0	0	0	116.1
972	H	77.8	Confident	87.7	Confident	90 Å²	90	44.3 Å²	44.3	42%	0.417	26%	0.263	S	S	.	.	S	Bend	trans	-142	-20.8	-169.5	55.8	-73.8	0	0	0	113.9	T970 H1003	T970-H972 PolarHBondContact O-N 2.79Å; T970-H972 PolarHBondContact OG1-CE1 2.8Å; T970-H972 VanDerWaalsContact OG1-CE1 3.24Å; T970-H972 PolarHBondContact OG1-N 3.07Å; T970-H972 PolarHBondContact OG1-ND1 2.75Å; H972-H1003 AromaticContact CE1-CE1 3.88Å; H972-H1003 AromaticContact CE1-ND1 3.86Å
973	K	83.4	Confident	88.3	Confident	77 Å²	77	46.3 Å²	46.3	34%	0.335	27%	0.271	S	S	.	.			trans	-153.2	140.6	-177.7	-169.3	156.9	156.4	-166.6	0	111.2	T970 E996 D997 C998	T970-K973 WeakPolarHBondContact CB-O 3.26Å; T970-K973 PolarHBondContact N-O 2.86Å; T970-K973 PolarHBondContact OG1-N 2.99Å; T970-K973 VanDerWaalsContact OG1-N 3.08Å; T970-K973 PolarHBondContact OG1-O 3.41Å; K973-E996 PolarHBondContact NZ-O 2.87Å; K973-D997 VanDerWaalsContact CD-O 3.29Å; K973-D997 WeakPolarHBondContact CD-O 3.46Å; K973-D997 PolarHBondContact NZ-O 3.28Å; K973-C998 WeakPolarHBondContact CE-SG 3.43Å; K973-C998 PolarHBondContact NZ-SG 3.44Å; K973-C998 VanDerWaalsContact NZ-SG 3.36Å
974	S	88.5	Confident	88.4	Confident	81 Å²	81	46.5 Å²	46.5	57%	0.566	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.3	168.2	-69.6	0	0	0	0	108.7	L968 D969	L968-S974 CarbonylContact O-C 3.57Å; L968-S974 WeakPolarHBondContact O-CA 3.38Å; D969-S974 WeakPolarHBondContact OD1-CB 3.42Å; D969-S974 PolarHBondContact OD1-OG 3.03Å
975	V	91.3	Very high	88.4	Confident	24 Å²	24	53.2 Å²	53.2	15%	0.145	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	137.7	-178.3	61.9	0	0	0	0	110.5	R967 L968 F977 L993 C998	R967-V975 CarbonylContact C-O 3.47Å; R967-V975 WeakPolarHBondContact CA-O 3.28Å; L968-V975 HydrophobicContact CB-CG1 3.88Å; L968-V975 HydrophobicContact CD2-CG1 4.04Å; L968-V975 HydrophobicContact CG-CG1 4.15Å; L968-V975 PolarHBondContact N-O 3.41Å; L968-V975 PolarHBondContact O-N 3.36Å; V975-F977 HydrophobicContact CG1-CD1 4.4Å; V975-L993 HydrophobicContact CG1-CD2 4.12Å; V975-L993 HydrophobicContact CG2-CD2 4.19Å; V975-C998 HydrophobicContact CB-CB 4.4Å; V975-C998 HydrophobicContact CG1-CB 4.18Å
976	T	93.3	Very high	88.5	Confident	98 Å²	98	53.6 Å²	53.6	60%	0.601	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109	124.7	169.8	52.8	0	0	0	0	109.2	L953 C966 R967	L953-T976 HydrophobicContact CD1-CG2 3.91Å; C966-T976 CarbonylContact O-C 3.49Å; C966-T976 VanDerWaalsContact O-CA 3.28Å; C966-T976 WeakPolarHBondContact O-CA 3.26Å; R967-T976 HydrophobicContact CB-CG2 4.07Å; R967-T976 HydrophobicContact CG-CG2 4.29Å
977	F	93.3	Very high	88.3	Confident	26 Å²	26	56.2 Å²	56.2	11%	0.114	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	159.7	-178	63.7	-85.4	0	0	0	111.2	M950 C966 L968 V975 F979 I989 L993 L1011	M950-F977 HydrophobicContact SD-CZ 4.41Å; C966-F977 HydrophobicContact CB-CE1 4.04Å; C966-F977 HydrophobicContact CB-CE2 4.17Å; C966-F977 HydrophobicContact CB-CZ 3.79Å; C966-F977 PolarHBondContact N-O 3.44Å; C966-F977 PolarHBondContact O-N 2.93Å; L968-F977 HydrophobicContact CB-CE1 3.86Å; L968-F977 HydrophobicContact CD2-CE1 4.33Å; V975-F977 HydrophobicContact CG1-CD1 4.4Å; F977-F979 AromaticContact CD2-CD1 3.99Å; F977-F979 HydrophobicContact CD2-CD1 3.99Å; F977-F979 AromaticContact CE2-CD1 3.62Å; F977-F979 HydrophobicContact CE2-CD1 3.62Å; F977-F979 AromaticContact CE2-CE1 3.97Å; F977-F979 HydrophobicContact CE2-CE1 3.97Å; F977-I989 HydrophobicContact CD2-CG2 4.06Å; F977-I989 HydrophobicContact CE2-CG2 3.72Å; F977-I989 HydrophobicContact CZ-CG2 4.37Å; F977-L993 HydrophobicContact CD1-CD1 4.26Å; F977-L993 HydrophobicContact CD1-CD2 4.38Å; F977-L993 HydrophobicContact CE1-CD1 4.07Å; F977-L993 HydrophobicContact CZ-CD1 4.32Å; F977-L1011 HydrophobicContact CE2-CD2 3.93Å; F977-L1011 HydrophobicContact CZ-CD2 3.97Å
978	Q	92.1	Very high	88.2	Confident	111 Å²	111	54.9 Å²	54.9	52%	0.519	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	144.6	173.2	-72.6	-177.1	-16.3	0	0	110.1	V964 S965	V964-Q978 VanDerWaalsContact O-CA 3.26Å; V964-Q978 WeakPolarHBondContact O-CA 3.46Å; S965-Q978 WeakPolarHBondContact OG-CG 3.21Å; S965-Q978 PolarHBondContact OG-NE2 3.27Å
979	F	92.7	Very high	88.1	Confident	3 Å²	3	55.3 Å²	55.3	1%	0.013	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	158.9	174.3	71	-83.7	0	0	0	110.6	V964 F977 P981 D984 I989 L1011 V1014 I1015	V964-F979 HydrophobicContact CB-CD1 4.32Å; V964-F979 HydrophobicContact CB-CE1 3.99Å; V964-F979 HydrophobicContact CB-CE2 4.48Å; V964-F979 HydrophobicContact CB-CZ 4.08Å; V964-F979 HydrophobicContact CG1-CD1 4.47Å; V964-F979 HydrophobicContact CG1-CE1 3.74Å; V964-F979 HydrophobicContact CG1-CZ 3.91Å; V964-F979 PolarHBondContact N-O 3.49Å; V964-F979 PolarHBondContact O-N 2.93Å; V964-F979 VanDerWaalsContact O-N 3.08Å; F977-F979 AromaticContact CD2-CD1 3.99Å; F977-F979 HydrophobicContact CD2-CD1 3.99Å; F977-F979 AromaticContact CE2-CD1 3.62Å; F977-F979 HydrophobicContact CE2-CD1 3.62Å; F977-F979 AromaticContact CE2-CE1 3.97Å; F977-F979 HydrophobicContact CE2-CE1 3.97Å; F979-P981 HydrophobicContact CD2-CG 4.49Å; F979-P981 HydrophobicContact CE2-CG 4.06Å; F979-D984 HydrophobicContact CB-CB 3.96Å; F979-D984 HydrophobicContact CD2-CB 4.37Å; F979-I989 HydrophobicContact CB-CD1 3.75Å; F979-I989 HydrophobicContact CB-CG1 4.31Å; F979-I989 HydrophobicContact CD1-CD1 4.21Å; F979-I989 HydrophobicContact CD2-CD1 3.6Å; F979-I989 HydrophobicContact CE2-CD1 4.2Å; F979-I989 HydrophobicContact CG-CD1 3.6Å; F979-L1011 HydrophobicContact CD1-CD2 4.36Å; F979-L1011 HydrophobicContact CE1-CD2 3.76Å; F979-L1011 HydrophobicContact CZ-CD2 3.84Å; F979-V1014 HydrophobicContact CE1-CG1 4.31Å; F979-V1014 HydrophobicContact CZ-CB 4.44Å; F979-V1014 HydrophobicContact CZ-CG1 3.76Å; F979-I1015 HydrophobicContact CE2-CD1 4.14Å; F979-I1015 HydrophobicContact CE2-CG1 3.71Å; F979-I1015 HydrophobicContact CZ-CG1 4.31Å
980	A	89	Confident	88.2	Confident	7 Å²	7	53.3 Å²	53.3	6%	0.058	32%	0.315	C	S	.	.			trans	-103.6	114.1	175.7	0	0	0	0	0	110.2	F961 L963 G982 T983 D984	F961-A980 HydrophobicContact CB-CB 4.16Å; L963-A980 HydrophobicContact CD2-CB 4.25Å; A980-G982 PolarHBondContact O-N 2.96Å; A980-T983 WeakPolarHBondContact CB-OG1 3.42Å; A980-T983 PolarHBondContact O-N 2.76Å; A980-T983 PolarHBondContact O-OG1 2.98Å; A980-D984 PolarHBondContact N-OD2 3.31Å; A980-D984 PolarHBondContact O-N 2.8Å
981	P	85.1	Confident	88.3	Confident	17 Å²	17	56.3 Å²	56.3	11%	0.11	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.7	-174.3	-28.9	36.5	0	0	0	115.5	A962 V964 F979 I1015 I1018	A962-P981 VanDerWaalsContact O-CD 3.28Å; A962-P981 WeakPolarHBondContact O-CD 3.15Å; V964-P981 HydrophobicContact CB-CG 4.31Å; V964-P981 HydrophobicContact CG2-CG 3.37Å; F979-P981 HydrophobicContact CD2-CG 4.49Å; F979-P981 HydrophobicContact CE2-CG 4.06Å; P981-I1015 HydrophobicContact CB-CG1 4.21Å; P981-I1015 HydrophobicContact CB-CG2 4.38Å; P981-I1018 HydrophobicContact CG-CG2 4.45Å
982	G	79.3	Confident	88.9	Confident	77 Å²	77	57.8 Å²	57.8	79%	0.794	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-10	177.2	0	0	0	0	0	115.3	A980	A980-G982 PolarHBondContact O-N 2.96Å
983	T	84	Confident	89.6	Confident	86 Å²	86	53.8 Å²	53.8	53%	0.528	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133	-37.3	-174.7	57.9	0	0	0	0	114	F961 A980	F961-T983 HydrophobicContact CD1-CG2 4.32Å; F961-T983 HydrophobicContact CE1-CG2 4.3Å; A980-T983 WeakPolarHBondContact CB-OG1 3.42Å; A980-T983 PolarHBondContact O-N 2.76Å; A980-T983 PolarHBondContact O-OG1 2.98Å
984	D	88.9	Confident	90	Very high	38 Å²	38	52.5 Å²	52.5	20%	0.203	31%	0.309	C	S	.	.			trans	-87.5	114.5	179.7	-73.8	-67.4	0	0	0	111.5	F979 A980 I989 K992	F979-D984 HydrophobicContact CB-CB 3.96Å; F979-D984 HydrophobicContact CD2-CB 4.37Å; A980-D984 PolarHBondContact N-OD2 3.31Å; A980-D984 PolarHBondContact O-N 2.8Å; D984-I989 HydrophobicContact CB-CD1 3.9Å; D984-I989 HydrophobicContact CB-CG1 3.98Å; D984-K992 IonicContact OD1-NZ 3.29Å; D984-K992 PolarHBondContact OD1-NZ 2.72Å
985	K	90.1	Very high	90.1	Very high	140 Å²	140	51.6 Å²	51.6	61%	0.609	31%	0.306	S	S	*	.			trans	-76.9	143.6	175.4	-61.9	-178.7	179.8	-179.7	0	111.2	C987 T988 I989	K985-C987 VanDerWaalsContact C-N 3.31Å; K985-C987 PolarHBondContact O-N 3.36Å; K985-T988 WeakPolarHBondContact O-CB 3.38Å; K985-T988 PolarHBondContact O-N 3.01Å; K985-I989 PolarHBondContact O-N 2.84Å; K985-I989 VanDerWaalsContact O-N 3.13Å
986	P	91.7	Very high	90	Very high	31 Å²	31	55.9 Å²	55.9	20%	0.201	32%	0.324	C	S	.	.	H	α-helix	trans	-48.2	-45.9	176.9	-33.7	38.2	0	0	0	114.9	T988 I989 A990 E1008 L1011 I1015	P986-T988 PolarHBondContact O-N 3.21Å; P986-I989 PolarHBondContact O-N 3.22Å; P986-A990 WeakPolarHBondContact O-CB 3.4Å; P986-A990 PolarHBondContact O-N 2.92Å; P986-E1008 WeakPolarHBondContact CB-O 3.15Å; P986-L1011 HydrophobicContact CB-CB 3.8Å; P986-L1011 HydrophobicContact CB-CD1 4.45Å; P986-L1011 HydrophobicContact CG-CB 4.1Å; P986-I1015 HydrophobicContact CG-CD1 3.74Å
987	C	91.6	Very high	89.7	Confident	55 Å²	55	57.4 Å²	57.4	37%	0.372	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-37.3	178.1	55.6	0	0	0	0	113.3	K985 T991 E1008	K985-C987 VanDerWaalsContact C-N 3.31Å; K985-C987 PolarHBondContact O-N 3.36Å; C987-T991 WeakPolarHBondContact O-CB 3.32Å; C987-T991 PolarHBondContact O-N 3.19Å; C987-T991 PolarHBondContact O-OG1 2.78Å; C987-E1008 WeakPolarHBondContact CA-OE1 3.43Å; C987-E1008 WeakPolarHBondContact CB-OE1 3.18Å
988	T	91.2	Very high	89.3	Confident	60 Å²	60	56.5 Å²	56.5	37%	0.368	33%	0.325	S	S	.	.	H	α-helix	trans	-64.5	-42.4	174.7	-53.2	0	0	0	0	111.1	K985 P986 K992	K985-T988 WeakPolarHBondContact O-CB 3.38Å; K985-T988 PolarHBondContact O-N 3.01Å; P986-T988 PolarHBondContact O-N 3.21Å; T988-K992 VanDerWaalsContact O-CG 3.32Å; T988-K992 WeakPolarHBondContact O-CG 3.31Å; T988-K992 PolarHBondContact O-N 2.86Å
989	I	91.8	Very high	89.1	Confident	9 Å²	9	51.4 Å²	51.4	5%	0.046	30%	0.302	C	S	.	.	H	α-helix	trans	-67.6	-49.2	178.6	-57.9	162.7	0	0	0	110.2	F977 F979 D984 K985 P986 T991 K992 L993 L1011	F977-I989 HydrophobicContact CD2-CG2 4.06Å; F977-I989 HydrophobicContact CE2-CG2 3.72Å; F977-I989 HydrophobicContact CZ-CG2 4.37Å; F979-I989 HydrophobicContact CB-CD1 3.75Å; F979-I989 HydrophobicContact CB-CG1 4.31Å; F979-I989 HydrophobicContact CD1-CD1 4.21Å; F979-I989 HydrophobicContact CD2-CD1 3.6Å; F979-I989 HydrophobicContact CE2-CD1 4.2Å; F979-I989 HydrophobicContact CG-CD1 3.6Å; D984-I989 HydrophobicContact CB-CD1 3.9Å; D984-I989 HydrophobicContact CB-CG1 3.98Å; K985-I989 PolarHBondContact O-N 2.84Å; K985-I989 VanDerWaalsContact O-N 3.13Å; P986-I989 PolarHBondContact O-N 3.22Å; I989-T991 VanDerWaalsContact C-N 3.29Å; I989-T991 PolarHBondContact O-N 2.91Å; I989-K992 PolarHBondContact O-N 3.26Å; I989-L993 HydrophobicContact CG2-CD1 3.95Å; I989-L993 HydrophobicContact CG2-CG 4.46Å; I989-L993 WeakPolarHBondContact O-CG 3.5Å; I989-L993 PolarHBondContact O-N 2.78Å; I989-L1011 HydrophobicContact CB-CD1 3.67Å; I989-L1011 HydrophobicContact CD1-CD1 4.05Å; I989-L1011 HydrophobicContact CD1-CD2 4.07Å; I989-L1011 HydrophobicContact CG1-CD1 4.49Å; I989-L1011 HydrophobicContact CG2-CD1 3.64Å; I989-L1011 HydrophobicContact CG2-CD2 4.43Å
990	A	92.6	Very high	88.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-61.2	-37	178.3	0	0	0	0	0	112.3	P986 L993 L994 V1004 V1007 E1008	P986-A990 WeakPolarHBondContact O-CB 3.4Å; P986-A990 PolarHBondContact O-N 2.92Å; A990-L993 PolarHBondContact O-N 3.46Å; A990-L994 WeakPolarHBondContact O-CB 3.27Å; A990-L994 PolarHBondContact O-N 2.9Å; A990-V1004 HydrophobicContact CB-CG1 4.15Å; A990-V1007 HydrophobicContact CB-CG1 4.13Å; A990-E1008 HydrophobicContact CB-CG 3.57Å
991	T	89.7	Confident	88.6	Confident	80 Å²	80	63 Å²	63	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-69.4	-40.3	175	-57	0	0	0	0	112.3	C987 I989 L994 A995	C987-T991 WeakPolarHBondContact O-CB 3.32Å; C987-T991 PolarHBondContact O-N 3.19Å; C987-T991 PolarHBondContact O-OG1 2.78Å; I989-T991 VanDerWaalsContact C-N 3.29Å; I989-T991 PolarHBondContact O-N 2.91Å; T991-L994 PolarHBondContact O-N 2.82Å; T991-A995 WeakPolarHBondContact O-CB 3.32Å; T991-A995 PolarHBondContact O-N 3.05Å
992	K	90.2	Very high	88.6	Confident	104 Å²	104	66.3 Å²	66.3	45%	0.452	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-48.7	171.7	-76.6	170.8	178.5	174.1	0	110.9	D984 T988 I989 L994 A995 E996	D984-K992 IonicContact OD1-NZ 3.29Å; D984-K992 PolarHBondContact OD1-NZ 2.72Å; T988-K992 VanDerWaalsContact O-CG 3.32Å; T988-K992 WeakPolarHBondContact O-CG 3.31Å; T988-K992 PolarHBondContact O-N 2.86Å; I989-K992 PolarHBondContact O-N 3.26Å; K992-L994 VanDerWaalsContact C-N 3.33Å; K992-L994 PolarHBondContact O-N 3.03Å; K992-A995 CarbonylContact O-C 3.54Å; K992-A995 WeakPolarHBondContact O-CA 3.41Å; K992-A995 PolarHBondContact O-N 2.73Å; K992-E996 PolarHBondContact O-N 3.41Å; K992-E996 VanDerWaalsContact O-N 3.14Å
993	L	92.5	Very high	89	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	34%	0.336	C	S	.	.	H	α-helix	trans	-64.1	-33.7	179.1	-69.5	171.2	0	0	0	112.9	L968 V975 F977 I989 A990 C998 L999 V1007	L968-L993 HydrophobicContact CD2-CD1 3.85Å; V975-L993 HydrophobicContact CG1-CD2 4.12Å; V975-L993 HydrophobicContact CG2-CD2 4.19Å; F977-L993 HydrophobicContact CD1-CD1 4.26Å; F977-L993 HydrophobicContact CD1-CD2 4.38Å; F977-L993 HydrophobicContact CE1-CD1 4.07Å; F977-L993 HydrophobicContact CZ-CD1 4.32Å; I989-L993 HydrophobicContact CG2-CD1 3.95Å; I989-L993 HydrophobicContact CG2-CG 4.46Å; I989-L993 WeakPolarHBondContact O-CG 3.5Å; I989-L993 PolarHBondContact O-N 2.78Å; A990-L993 PolarHBondContact O-N 3.46Å; L993-C998 HydrophobicContact CB-CB 4.17Å; L993-C998 HydrophobicContact CD2-CB 3.93Å; L993-C998 WeakPolarHBondContact O-CA 3.4Å; L993-C998 VanDerWaalsContact O-CB 3.26Å; L993-C998 WeakPolarHBondContact O-CB 3.39Å; L993-C998 PolarHBondContact O-N 3.23Å; L993-L999 HydrophobicContact CB-CD1 3.64Å; L993-L999 HydrophobicContact CB-CG 4.22Å; L993-L999 HydrophobicContact CD1-CD1 4.23Å; L993-L999 PolarHBondContact O-N 2.81Å; L993-V1007 HydrophobicContact CD1-CG1 4.35Å
994	L	91.8	Very high	89.3	Confident	50 Å²	50	59.4 Å²	59.4	26%	0.262	32%	0.316	S	S	.	.	H	α-helix	trans	-66.1	-39.4	169.6	179.6	66.2	0	0	0	111.9	A990 T991 K992 E996 D997 L999 K1001 V1004	A990-L994 WeakPolarHBondContact O-CB 3.27Å; A990-L994 PolarHBondContact O-N 2.9Å; T991-L994 PolarHBondContact O-N 2.82Å; K992-L994 VanDerWaalsContact C-N 3.33Å; K992-L994 PolarHBondContact O-N 3.03Å; L994-E996 PolarHBondContact O-N 3.49Å; L994-D997 PolarHBondContact O-N 3.36Å; L994-L999 WeakPolarHBondContact CD1-O 3.48Å; L994-K1001 HydrophobicContact CD1-CG 3.95Å; L994-K1001 HydrophobicContact CD2-CG 4.34Å; L994-V1004 HydrophobicContact CB-CG2 4.49Å; L994-V1004 HydrophobicContact CD1-CG2 4.41Å; L994-V1004 HydrophobicContact CD2-CG2 4Å
995	A	89.5	Confident	89.2	Confident	61 Å²	61	64.4 Å²	64.4	50%	0.504	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	3.1	-178.8	0	0	0	0	0	115	T991 K992	T991-A995 WeakPolarHBondContact O-CB 3.32Å; T991-A995 PolarHBondContact O-N 3.05Å; K992-A995 CarbonylContact O-C 3.54Å; K992-A995 WeakPolarHBondContact O-CA 3.41Å; K992-A995 PolarHBondContact O-N 2.73Å
996	E	88.9	Confident	89.2	Confident	115 Å²	115	58 Å²	58	54%	0.537	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	17.2	174.5	-68.8	173.7	-171.5	0	0	111.4	K973 K992 L994 C998	K973-E996 PolarHBondContact NZ-O 2.87Å; K992-E996 PolarHBondContact O-N 3.41Å; K992-E996 VanDerWaalsContact O-N 3.14Å; L994-E996 PolarHBondContact O-N 3.49Å; E996-C998 PolarHBondContact O-N 3.12Å; E996-C998 VanDerWaalsContact O-N 3.09Å; E996-C998 PolarHBondContact O-SG 3.04Å; E996-C998 VanDerWaalsContact O-SG 3.4Å
997	D	87	Confident	89.2	Confident	130 Å²	130	56.6 Å²	56.6	70%	0.695	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	32.5	-175	-63.3	-47.3	0	0	0	113.1	K973 L994	K973-D997 VanDerWaalsContact CD-O 3.29Å; K973-D997 WeakPolarHBondContact CD-O 3.46Å; K973-D997 PolarHBondContact NZ-O 3.28Å; L994-D997 PolarHBondContact O-N 3.36Å
998	C	84.7	Confident	89.2	Confident	6 Å²	6	56.1 Å²	56.1	4%	0.041	29%	0.293	C	S	.	.	S	Bend	trans	-89.7	-11.8	175.5	-62.6	0	0	0	0	112.3	K973 V975 L993 E996	K973-C998 WeakPolarHBondContact CE-SG 3.43Å; K973-C998 PolarHBondContact NZ-SG 3.44Å; K973-C998 VanDerWaalsContact NZ-SG 3.36Å; V975-C998 HydrophobicContact CB-CB 4.4Å; V975-C998 HydrophobicContact CG1-CB 4.18Å; L993-C998 HydrophobicContact CB-CB 4.17Å; L993-C998 HydrophobicContact CD2-CB 3.93Å; L993-C998 WeakPolarHBondContact O-CA 3.4Å; L993-C998 VanDerWaalsContact O-CB 3.26Å; L993-C998 WeakPolarHBondContact O-CB 3.39Å; L993-C998 PolarHBondContact O-N 3.23Å; E996-C998 PolarHBondContact O-N 3.12Å; E996-C998 VanDerWaalsContact O-N 3.09Å; E996-C998 PolarHBondContact O-SG 3.04Å; E996-C998 VanDerWaalsContact O-SG 3.4Å
999	L	88.3	Confident	89.1	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.026	29%	0.294	C	S	.	.	S	Bend	trans	-140.7	151.7	178.2	-77.2	166.8	0	0	0	111.5	L968 T970 L993 L994 H1003 V1007	L968-L999 HydrophobicContact CD2-CD1 4.32Å; L968-L999 HydrophobicContact CD2-CD2 4.15Å; L968-L999 HydrophobicContact CD2-CG 4.31Å; T970-L999 HydrophobicContact CG2-CD2 3.81Å; L993-L999 HydrophobicContact CB-CD1 3.64Å; L993-L999 HydrophobicContact CB-CG 4.22Å; L993-L999 HydrophobicContact CD1-CD1 4.23Å; L993-L999 PolarHBondContact O-N 2.81Å; L994-L999 WeakPolarHBondContact CD1-O 3.48Å; L999-H1003 HydrophobicContact CD2-CB 3.54Å; L999-V1007 HydrophobicContact CD1-CB 4.01Å; L999-V1007 HydrophobicContact CD1-CG1 3.99Å; L999-V1007 HydrophobicContact CD1-CG2 3.83Å; L999-V1007 HydrophobicContact CD2-CG2 3.66Å; L999-V1007 HydrophobicContact CG-CG2 4.39Å
1000	L	87.2	Confident	89.1	Confident	74 Å²	74	55 Å²	55	39%	0.387	29%	0.291	S	S	.	.			trans	-86.5	152.8	162.8	-66.4	171.4	0	0	0	109.7	V1002 H1003	L1000-V1002 HydrophobicContact CB-CG1 4.05Å; L1000-V1002 PolarHBondContact O-N 2.86Å; L1000-H1003 PolarHBondContact O-N 3.02Å
1001	K	85.5	Confident	89.2	Confident	179 Å²	179	55 Å²	55	78%	0.778	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-50.1	-36.3	176.7	-67.2	-173.6	177.6	-175.2	0	113.3	L994 H1003 V1004	L994-K1001 HydrophobicContact CD1-CG 3.95Å; L994-K1001 HydrophobicContact CD2-CG 4.34Å; K1001-H1003 VanDerWaalsContact C-N 3.26Å; K1001-H1003 PolarHBondContact O-N 3.35Å; K1001-V1004 WeakPolarHBondContact O-CG2 3.29Å; K1001-V1004 PolarHBondContact O-N 3.17Å
1002	V	84.8	Confident	89.2	Confident	87 Å²	87	52.6 Å²	52.6	53%	0.527	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-70	-13.4	178.1	67.5	0	0	0	0	114.5	L1000	L1000-V1002 HydrophobicContact CB-CG1 4.05Å; L1000-V1002 PolarHBondContact O-N 2.86Å
1003	H	87.9	Confident	89.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-97.2	-8.3	178.2	-59.1	164.9	0	0	0	113.8	H972 L999 L1000 K1001 I1006 V1007	H972-H1003 AromaticContact CE1-CE1 3.88Å; H972-H1003 AromaticContact CE1-ND1 3.86Å; L999-H1003 HydrophobicContact CD2-CB 3.54Å; L1000-H1003 PolarHBondContact O-N 3.02Å; K1001-H1003 VanDerWaalsContact C-N 3.26Å; K1001-H1003 PolarHBondContact O-N 3.35Å; H1003-I1006 WeakPolarHBondContact O-CB 3.44Å; H1003-I1006 PolarHBondContact O-N 3.24Å; H1003-V1007 PolarHBondContact O-N 3.28Å; H1003-V1007 VanDerWaalsContact O-N 3.13Å
1004	V	89	Confident	88.9	Confident	17 Å²	17	50.9 Å²	50.9	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-57.3	-58.8	-171.1	175.3	0	0	0	0	111.6	A990 L994 K1001 I1006 V1007 E1008	A990-V1004 HydrophobicContact CB-CG1 4.15Å; L994-V1004 HydrophobicContact CB-CG2 4.49Å; L994-V1004 HydrophobicContact CD1-CG2 4.41Å; L994-V1004 HydrophobicContact CD2-CG2 4Å; K1001-V1004 WeakPolarHBondContact O-CG2 3.29Å; K1001-V1004 PolarHBondContact O-N 3.17Å; V1004-I1006 PolarHBondContact O-N 3.05Å; V1004-I1006 VanDerWaalsContact O-N 3.14Å; V1004-V1007 PolarHBondContact O-N 2.81Å; V1004-E1008 HydrophobicContact CG1-CG 4.3Å; V1004-E1008 WeakPolarHBondContact O-CG 3.36Å; V1004-E1008 PolarHBondContact O-N 3.09Å
1005	H	87.7	Confident	88.7	Confident	144 Å²	144	49.7 Å²	49.7	67%	0.667	27%	0.27	S	S	*	.	H	α-helix	trans	-62.1	-24.9	-178.4	-59.9	-40.3	0	0	0	114.1	E1008 A1009	H1005-E1008 WeakPolarHBondContact CA-OE2 3.29Å; H1005-E1008 IonicContact CE1-OE2 2.72Å; H1005-E1008 IonicContact CG-OE2 3.86Å; H1005-E1008 IonicContact ND1-OE2 3.06Å; H1005-E1008 PolarHBondContact ND1-OE2 2.82Å; H1005-A1009 WeakPolarHBondContact O-CB 3.5Å; H1005-A1009 PolarHBondContact O-N 3.4Å; H1005-A1009 VanDerWaalsContact O-N 3.1Å
1006	I	88.8	Confident	88.5	Confident	6 Å²	6	53.2 Å²	53.2	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-69.9	-46.2	174.8	-51.5	169.4	0	0	0	109.9	V948 H1003 V1004 A1009 Q1010 T1032 L1034	V948-I1006 HydrophobicContact CB-CG2 4.21Å; V948-I1006 HydrophobicContact CG1-CG2 4.31Å; V948-I1006 HydrophobicContact CG2-CD1 4.23Å; H1003-I1006 WeakPolarHBondContact O-CB 3.44Å; H1003-I1006 PolarHBondContact O-N 3.24Å; V1004-I1006 PolarHBondContact O-N 3.05Å; V1004-I1006 VanDerWaalsContact O-N 3.14Å; I1006-A1009 PolarHBondContact O-N 3.43Å; I1006-Q1010 WeakPolarHBondContact O-CB 3.37Å; I1006-Q1010 WeakPolarHBondContact O-CG 3.41Å; I1006-Q1010 PolarHBondContact O-N 2.57Å; I1006-T1032 HydrophobicContact CG2-CG2 3.74Å; I1006-L1034 HydrophobicContact CD1-CD1 3.64Å; I1006-L1034 HydrophobicContact CD1-CD2 3.71Å; I1006-L1034 HydrophobicContact CD1-CG 3.79Å
1007	V	91.8	Very high	88.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-70.6	-36.1	179	169.6	0	0	0	0	111.2	V948 M950 L968 A990 L993 L999 H1003 V1004 L1011	V948-V1007 HydrophobicContact CG1-CG2 4.28Å; M950-V1007 HydrophobicContact CE-CB 4.44Å; M950-V1007 HydrophobicContact CE-CG1 3.89Å; M950-V1007 HydrophobicContact CE-CG2 4.42Å; L968-V1007 HydrophobicContact CD1-CG2 3.87Å; L968-V1007 HydrophobicContact CD2-CG1 4.21Å; L968-V1007 HydrophobicContact CD2-CG2 3.91Å; A990-V1007 HydrophobicContact CB-CG1 4.13Å; L993-V1007 HydrophobicContact CD1-CG1 4.35Å; L999-V1007 HydrophobicContact CD1-CB 4.01Å; L999-V1007 HydrophobicContact CD1-CG1 3.99Å; L999-V1007 HydrophobicContact CD1-CG2 3.83Å; L999-V1007 HydrophobicContact CD2-CG2 3.66Å; L999-V1007 HydrophobicContact CG-CG2 4.39Å; H1003-V1007 PolarHBondContact O-N 3.28Å; H1003-V1007 VanDerWaalsContact O-N 3.13Å; V1004-V1007 PolarHBondContact O-N 2.81Å; V1007-L1011 HydrophobicContact CG1-CD1 3.79Å; V1007-L1011 HydrophobicContact CG1-CG 4.32Å; V1007-L1011 VanDerWaalsContact O-CB 3.26Å; V1007-L1011 WeakPolarHBondContact O-CB 3.38Å; V1007-L1011 WeakPolarHBondContact O-CD1 3.38Å; V1007-L1011 VanDerWaalsContact O-CG 3.25Å; V1007-L1011 WeakPolarHBondContact O-CG 3.26Å; V1007-L1011 PolarHBondContact O-N 2.72Å
1008	E	92.4	Very high	88.1	Confident	46 Å²	46	44 Å²	44	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-58.9	-45.8	171.2	-69.2	179.3	130.5	0	0	111.8	P986 C987 A990 V1004 H1005 G1012	P986-E1008 WeakPolarHBondContact CB-O 3.15Å; C987-E1008 WeakPolarHBondContact CA-OE1 3.43Å; C987-E1008 WeakPolarHBondContact CB-OE1 3.18Å; A990-E1008 HydrophobicContact CB-CG 3.57Å; V1004-E1008 HydrophobicContact CG1-CG 4.3Å; V1004-E1008 WeakPolarHBondContact O-CG 3.36Å; V1004-E1008 PolarHBondContact O-N 3.09Å; H1005-E1008 WeakPolarHBondContact CA-OE2 3.29Å; H1005-E1008 IonicContact CE1-OE2 2.72Å; H1005-E1008 IonicContact CG-OE2 3.86Å; H1005-E1008 IonicContact ND1-OE2 3.06Å; H1005-E1008 PolarHBondContact ND1-OE2 2.82Å; E1008-G1012 PolarHBondContact O-N 2.92Å
1009	A	90	Very high	87.9	Confident	45 Å²	45	49 Å²	49	37%	0.372	26%	0.256	S	S	.	.	H	α-helix	trans	-69	-43.6	178.6	0	0	0	0	0	112.5	H1005 I1006 L1011 G1012 E1013 I1044	H1005-A1009 WeakPolarHBondContact O-CB 3.5Å; H1005-A1009 PolarHBondContact O-N 3.4Å; H1005-A1009 VanDerWaalsContact O-N 3.1Å; I1006-A1009 PolarHBondContact O-N 3.43Å; A1009-L1011 PolarHBondContact O-N 3.01Å; A1009-G1012 WeakPolarHBondContact O-CA 3.42Å; A1009-G1012 PolarHBondContact O-N 3.08Å; A1009-G1012 VanDerWaalsContact O-N 3.13Å; A1009-E1013 PolarHBondContact O-N 3.36Å; A1009-E1013 VanDerWaalsContact O-N 3.14Å; A1009-I1044 HydrophobicContact CB-CD1 3.81Å
1010	Q	91.7	Very high	87.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-41.6	174.8	-73.3	179.3	-0.3	0	0	111.7	V948 M950 I1006 G1012 E1013 V1014 L1030 T1032 I1044	V948-Q1010 PolarHBondContact O-NE2 3.22Å; M950-Q1010 HydrophobicContact CE-CB 3.73Å; M950-Q1010 HydrophobicContact SD-CB 4.2Å; I1006-Q1010 WeakPolarHBondContact O-CB 3.37Å; I1006-Q1010 WeakPolarHBondContact O-CG 3.41Å; I1006-Q1010 PolarHBondContact O-N 2.57Å; Q1010-G1012 VanDerWaalsContact C-N 3.3Å; Q1010-G1012 PolarHBondContact O-N 3.01Å; Q1010-E1013 PolarHBondContact O-N 3.16Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.45Å; Q1010-V1014 PolarHBondContact O-N 3.29Å; Q1010-L1030 HydrophobicContact CB-CD1 3.97Å; Q1010-L1030 HydrophobicContact CG-CB 4.12Å; Q1010-L1030 HydrophobicContact CG-CD1 4.34Å; Q1010-L1030 WeakPolarHBondContact O-CD1 3.49Å; Q1010-T1032 PolarHBondContact NE2-OG1 3.29Å; Q1010-I1044 HydrophobicContact CG-CD1 4.04Å; Q1010-I1044 HydrophobicContact CG-CG1 4.35Å; Q1010-I1044 HydrophobicContact CG-CG2 4.4Å
1011	L	93.2	Very high	86.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-33.7	173.4	-78	166.7	0	0	0	112.9	M950 F977 F979 P986 I989 V1007 A1009 V1014 I1015	M950-L1011 HydrophobicContact CE-CD2 4.41Å; M950-L1011 HydrophobicContact CE-CG 4.03Å; M950-L1011 HydrophobicContact SD-CD2 4.06Å; M950-L1011 HydrophobicContact SD-CG 4.21Å; F977-L1011 HydrophobicContact CE2-CD2 3.93Å; F977-L1011 HydrophobicContact CZ-CD2 3.97Å; F979-L1011 HydrophobicContact CD1-CD2 4.36Å; F979-L1011 HydrophobicContact CE1-CD2 3.76Å; F979-L1011 HydrophobicContact CZ-CD2 3.84Å; P986-L1011 HydrophobicContact CB-CB 3.8Å; P986-L1011 HydrophobicContact CB-CD1 4.45Å; P986-L1011 HydrophobicContact CG-CB 4.1Å; I989-L1011 HydrophobicContact CB-CD1 3.67Å; I989-L1011 HydrophobicContact CD1-CD1 4.05Å; I989-L1011 HydrophobicContact CD1-CD2 4.07Å; I989-L1011 HydrophobicContact CG1-CD1 4.49Å; I989-L1011 HydrophobicContact CG2-CD1 3.64Å; I989-L1011 HydrophobicContact CG2-CD2 4.43Å; V1007-L1011 HydrophobicContact CG1-CD1 3.79Å; V1007-L1011 HydrophobicContact CG1-CG 4.32Å; V1007-L1011 VanDerWaalsContact O-CB 3.26Å; V1007-L1011 WeakPolarHBondContact O-CB 3.38Å; V1007-L1011 WeakPolarHBondContact O-CD1 3.38Å; V1007-L1011 VanDerWaalsContact O-CG 3.25Å; V1007-L1011 WeakPolarHBondContact O-CG 3.26Å; V1007-L1011 PolarHBondContact O-N 2.72Å; A1009-L1011 PolarHBondContact O-N 3.01Å; L1011-V1014 PolarHBondContact O-N 3.08Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.4Å; L1011-I1015 PolarHBondContact O-N 3.17Å
1012	G	90.7	Very high	85.2	Confident	29 Å²	29	45.4 Å²	45.4	30%	0.299	26%	0.258	S	S	.	.	H	α-helix	trans	-57.1	-49.1	171.1	0	0	0	0	0	112.1	E1008 A1009 Q1010 I1015 Q1016	E1008-G1012 PolarHBondContact O-N 2.92Å; A1009-G1012 WeakPolarHBondContact O-CA 3.42Å; A1009-G1012 PolarHBondContact O-N 3.08Å; A1009-G1012 VanDerWaalsContact O-N 3.13Å; Q1010-G1012 VanDerWaalsContact C-N 3.3Å; Q1010-G1012 PolarHBondContact O-N 3.01Å; G1012-I1015 PolarHBondContact O-N 2.84Å; G1012-Q1016 WeakPolarHBondContact O-CB 3.37Å; G1012-Q1016 PolarHBondContact O-N 2.67Å
1013	E	88.1	Confident	84.1	Confident	74 Å²	74	47.7 Å²	47.7	35%	0.346	26%	0.261	S	S	.	.	H	α-helix	trans	-64.5	-40.2	175.2	-74.4	-169.4	-176.6	0	0	112.7	A1009 Q1010 I1015 Q1016 L1017 L1030 I1044	A1009-E1013 PolarHBondContact O-N 3.36Å; A1009-E1013 VanDerWaalsContact O-N 3.14Å; Q1010-E1013 PolarHBondContact O-N 3.16Å; E1013-I1015 PolarHBondContact O-N 3.25Å; E1013-Q1016 PolarHBondContact O-N 3.15Å; E1013-L1017 VanDerWaalsContact O-CB 3.25Å; E1013-L1017 WeakPolarHBondContact O-CB 3.48Å; E1013-L1017 PolarHBondContact O-N 3.39Å; E1013-L1030 HydrophobicContact CB-CD1 3.8Å; E1013-L1030 WeakPolarHBondContact OE2-CD2 3.38Å; E1013-I1044 WeakPolarHBondContact OE2-CG2 3.33Å
1014	V	88.6	Confident	82.8	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-45.2	175.8	175.8	0	0	0	0	111.4	M950 I952 V964 F979 Q1010 L1011 L1017 I1018 L1030	M950-V1014 HydrophobicContact SD-CG2 3.99Å; I952-V1014 HydrophobicContact CD1-CB 4.37Å; I952-V1014 HydrophobicContact CD1-CG1 3.84Å; I952-V1014 HydrophobicContact CD1-CG2 4.07Å; I952-V1014 HydrophobicContact CG1-CG1 3.97Å; I952-V1014 HydrophobicContact CG1-CG2 4.03Å; V964-V1014 HydrophobicContact CG1-CG1 3.96Å; F979-V1014 HydrophobicContact CE1-CG1 4.31Å; F979-V1014 HydrophobicContact CZ-CB 4.44Å; F979-V1014 HydrophobicContact CZ-CG1 3.76Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.45Å; Q1010-V1014 PolarHBondContact O-N 3.29Å; L1011-V1014 PolarHBondContact O-N 3.08Å; V1014-L1017 PolarHBondContact O-N 2.91Å; V1014-I1018 HydrophobicContact CG1-CD1 3.78Å; V1014-I1018 WeakPolarHBondContact O-CB 2.89Å; V1014-I1018 WeakPolarHBondContact O-CG1 3.28Å; V1014-I1018 PolarHBondContact O-N 2.8Å; V1014-I1018 VanDerWaalsContact O-N 3.07Å; V1014-L1030 HydrophobicContact CG2-CD1 3.8Å
1015	I	88.1	Confident	81.9	Confident	25 Å²	25	52.6 Å²	52.6	13%	0.128	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-45.6	176.6	-71.3	174.3	0	0	0	110.4	F979 P981 P986 L1011 G1012 E1013 L1017 I1018 N1019	F979-I1015 HydrophobicContact CE2-CD1 4.14Å; F979-I1015 HydrophobicContact CE2-CG1 3.71Å; F979-I1015 HydrophobicContact CZ-CG1 4.31Å; P981-I1015 HydrophobicContact CB-CG1 4.21Å; P981-I1015 HydrophobicContact CB-CG2 4.38Å; P986-I1015 HydrophobicContact CG-CD1 3.74Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.4Å; L1011-I1015 PolarHBondContact O-N 3.17Å; G1012-I1015 PolarHBondContact O-N 2.84Å; E1013-I1015 PolarHBondContact O-N 3.25Å; I1015-L1017 PolarHBondContact O-N 3.36Å; I1015-I1018 PolarHBondContact O-N 3.18Å; I1015-N1019 WeakPolarHBondContact CG2-ND2 3.39Å; I1015-N1019 VanDerWaalsContact O-CB 3.23Å; I1015-N1019 WeakPolarHBondContact O-CB 3.36Å; I1015-N1019 PolarHBondContact O-N 2.76Å; I1015-N1019 PolarHBondContact O-ND2 2.85Å
1016	Q	84.9	Confident	81.5	Confident	134 Å²	134	48.3 Å²	48.3	63%	0.626	27%	0.265	S	S	*	.	H	α-helix	trans	-62.4	-42.3	179.1	-173.7	172.9	0.5	0	0	112	G1012 E1013 S1020	G1012-Q1016 WeakPolarHBondContact O-CB 3.37Å; G1012-Q1016 PolarHBondContact O-N 2.67Å; E1013-Q1016 PolarHBondContact O-N 3.15Å; Q1016-S1020 WeakPolarHBondContact O-CB 3.43Å; Q1016-S1020 PolarHBondContact O-N 3.34Å; Q1016-S1020 VanDerWaalsContact O-N 3.1Å; Q1016-S1020 PolarHBondContact O-OG 3.45Å
1017	L	84.5	Confident	81.1	Confident	37 Å²	37	49.3 Å²	49.3	19%	0.194	28%	0.277	C	S	.	.	H	α-helix	trans	-65.2	-44.2	-179.7	-175.9	60.2	0	0	0	111.8	I952 E1013 V1014 I1015 S1020 D1021 T1028 M1048	I952-L1017 HydrophobicContact CD1-CD2 3.92Å; E1013-L1017 VanDerWaalsContact O-CB 3.25Å; E1013-L1017 WeakPolarHBondContact O-CB 3.48Å; E1013-L1017 PolarHBondContact O-N 3.39Å; V1014-L1017 PolarHBondContact O-N 2.91Å; I1015-L1017 PolarHBondContact O-N 3.36Å; L1017-S1020 WeakPolarHBondContact O-CB 3.42Å; L1017-S1020 PolarHBondContact O-N 2.87Å; L1017-D1021 PolarHBondContact O-N 3.35Å; L1017-T1028 HydrophobicContact CD2-CG2 4Å; L1017-M1048 HydrophobicContact CD1-CE 3.55Å; L1017-M1048 HydrophobicContact CD2-CE 4.13Å
1018	I	81.3	Confident	80.8	Confident	14 Å²	14	49.3 Å²	49.3	7%	0.072	28%	0.277	C	S	.	.	H	α-helix	trans	-78.7	-31.7	-176.7	-65.3	175.3	0	0	0	111.9	I952 V964 P981 V1014 I1015 S1020 G1022	I952-I1018 HydrophobicContact CD1-CD1 4.18Å; I952-I1018 HydrophobicContact CD1-CG1 4.49Å; I952-I1018 HydrophobicContact CG2-CD1 4.12Å; V964-I1018 HydrophobicContact CB-CD1 4.05Å; V964-I1018 HydrophobicContact CG1-CD1 3.37Å; V964-I1018 HydrophobicContact CG2-CD1 3.43Å; V964-I1018 VanDerWaalsContact CG2-CD1 3.43Å; V964-I1018 HydrophobicContact CG2-CG2 3.96Å; P981-I1018 HydrophobicContact CG-CG2 4.45Å; V1014-I1018 HydrophobicContact CG1-CD1 3.78Å; V1014-I1018 WeakPolarHBondContact O-CB 2.89Å; V1014-I1018 WeakPolarHBondContact O-CG1 3.28Å; V1014-I1018 PolarHBondContact O-N 2.8Å; V1014-I1018 VanDerWaalsContact O-N 3.07Å; I1015-I1018 PolarHBondContact O-N 3.18Å; I1018-S1020 PolarHBondContact O-N 3.41Å; I1018-G1022 WeakPolarHBondContact O-CA 3.4Å; I1018-G1022 PolarHBondContact O-N 3.02Å
1019	N	80.7	Confident	80.6	Confident	113 Å²	113	51.2 Å²	51.2	60%	0.604	29%	0.285	S	S	*	.	H	α-helix	trans	-69.8	-18.5	168.8	-70	-9.4	0	0	0	112.8	I1015	I1015-N1019 WeakPolarHBondContact CG2-ND2 3.39Å; I1015-N1019 VanDerWaalsContact O-CB 3.23Å; I1015-N1019 WeakPolarHBondContact O-CB 3.36Å; I1015-N1019 PolarHBondContact O-N 2.76Å; I1015-N1019 PolarHBondContact O-ND2 2.85Å
1020	S	75	Confident	80.6	Confident	92 Å²	92	49.3 Å²	49.3	64%	0.643	27%	0.268	S	S	*	.	H	α-helix	trans	-86.2	-46	176.6	-59.5	0	0	0	0	112.4	Q1016 L1017 I1018	Q1016-S1020 WeakPolarHBondContact O-CB 3.43Å; Q1016-S1020 PolarHBondContact O-N 3.34Å; Q1016-S1020 VanDerWaalsContact O-N 3.1Å; Q1016-S1020 PolarHBondContact O-OG 3.45Å; L1017-S1020 WeakPolarHBondContact O-CB 3.42Å; L1017-S1020 PolarHBondContact O-N 2.87Å; I1018-S1020 PolarHBondContact O-N 3.41Å
1021	D	68.2	Low	80.4	Confident	67 Å²	67	50 Å²	50	36%	0.358	27%	0.274	S	S	.	.			trans	-155.3	92.9	178.8	-156.7	-37.2	0	0	0	111.1	L1017 K1023 K1024	L1017-D1021 PolarHBondContact O-N 3.35Å; D1021-K1023 PolarHBondContact O-N 3.14Å; D1021-K1024 HydrophobicContact CB-CB 4.32Å; D1021-K1024 HydrophobicContact CB-CD 4.16Å; D1021-K1024 HydrophobicContact CB-CG 4.37Å; D1021-K1024 PolarHBondContact O-N 2.99Å; D1021-K1024 VanDerWaalsContact O-N 3.1Å; D1021-K1024 VanDerWaalsContact OD2-CD 3.29Å; D1021-K1024 WeakPolarHBondContact OD2-CD 3.38Å; D1021-K1024 WeakPolarHBondContact OD2-CE 3.45Å; D1021-K1024 IonicContact OD2-NZ 3.6Å; D1021-K1024 PolarHBondContact OD2-NZ 2.96Å
1022	G	61.2	Low	80	Confident	23 Å²	23	50.1 Å²	50.1	24%	0.237	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-8	-162.2	0	0	0	0	0	117.5	I1018	I1018-G1022 WeakPolarHBondContact O-CA 3.4Å; I1018-G1022 PolarHBondContact O-N 3.02Å
1023	K	61.7	Low	79.2	Confident	135 Å²	135	52.4 Å²	52.4	59%	0.587	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-22.8	177.5	-67.7	-177	174.6	75.3	0	114.5	E957 D1021	E957-K1023 IonicContact OE1-NZ 2.75Å; E957-K1023 PolarHBondContact OE1-NZ 3.39Å; E957-K1023 WeakPolarHBondContact OE2-CE 3.48Å; E957-K1023 IonicContact OE2-NZ 3.5Å; E957-K1023 PolarHBondContact OE2-NZ 2.94Å; D1021-K1023 PolarHBondContact O-N 3.14Å
1024	K	61.9	Low	78.1	Confident	118 Å²	118	50.7 Å²	50.7	51%	0.513	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-14.2	-179.7	-65.9	-178.7	-173.7	151.3	0	114.3	D1021 V1026	D1021-K1024 HydrophobicContact CB-CB 4.32Å; D1021-K1024 HydrophobicContact CB-CD 4.16Å; D1021-K1024 HydrophobicContact CB-CG 4.37Å; D1021-K1024 PolarHBondContact O-N 2.99Å; D1021-K1024 VanDerWaalsContact O-N 3.1Å; D1021-K1024 VanDerWaalsContact OD2-CD 3.29Å; D1021-K1024 WeakPolarHBondContact OD2-CD 3.38Å; D1021-K1024 WeakPolarHBondContact OD2-CE 3.45Å; D1021-K1024 IonicContact OD2-NZ 3.6Å; D1021-K1024 PolarHBondContact OD2-NZ 2.96Å; K1024-V1026 VanDerWaalsContact C-N 3.33Å
1025	G	68.8	Low	76.7	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.01	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.7	178.3	0	0	0	0	0	114.2	I952 G1027 T1028	I952-G1025 WeakPolarHBondContact CB-O 3.25Å; I952-G1025 WeakPolarHBondContact CD1-O 3.25Å; G1025-G1027 PolarHBondContact O-N 2.98Å; G1025-T1028 VanDerWaalsContact O-CB 3.23Å; G1025-T1028 WeakPolarHBondContact O-CB 3.42Å; G1025-T1028 PolarHBondContact O-N 2.8Å; G1025-T1028 VanDerWaalsContact O-N 3.08Å; G1025-T1028 PolarHBondContact O-OG1 2.9Å
1026	V	79.5	Confident	74.9	Confident	55 Å²	55	58.8 Å²	58.8	33%	0.333	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	130.4	-171.4	-177.5	0	0	0	0	111.1	K1024 P1049	K1024-V1026 VanDerWaalsContact C-N 3.33Å; V1026-P1049 WeakPolarHBondContact O-CG 3.26Å
1027	G	80.1	Confident	73.1	Confident	26 Å²	26	59.9 Å²	59.9	27%	0.268	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	-3.7	-175.5	0	0	0	0	0	115.2	I952 G1025 K1029	I952-G1027 WeakPolarHBondContact O-CA 3.43Å; I952-G1027 PolarHBondContact O-N 3.18Å; G1025-G1027 PolarHBondContact O-N 2.98Å; G1027-K1029 PolarHBondContact O-N 3.31Å
1028	T	85.6	Confident	71.3	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.006	35%	0.348	C	S	.	.			trans	-67.2	131.7	177.6	-56.1	0	0	0	0	111.3	E951 I952 L1017 G1025 L1030 V1047 M1048	E951-T1028 WeakPolarHBondContact CA-O 3.04Å; I952-T1028 PolarHBondContact N-O 2.81Å; L1017-T1028 HydrophobicContact CD2-CG2 4Å; G1025-T1028 VanDerWaalsContact O-CB 3.23Å; G1025-T1028 WeakPolarHBondContact O-CB 3.42Å; G1025-T1028 PolarHBondContact O-N 2.8Å; G1025-T1028 VanDerWaalsContact O-N 3.08Å; G1025-T1028 PolarHBondContact O-OG1 2.9Å; T1028-L1030 HydrophobicContact CG2-CD2 4.25Å; T1028-V1047 WeakPolarHBondContact CA-O 3.44Å; T1028-M1048 HydrophobicContact CG2-CG 3.87Å
1029	K	89.2	Confident	69.7	Low	86 Å²	86	67.7 Å²	67.7	37%	0.374	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.2	174.6	-80	177.4	175.7	166.7	0	111.7	M950 E951 G1027 A1046 V1047	M950-K1029 CarbonylContact O-C 3.54Å; M950-K1029 WeakPolarHBondContact O-CA 3.46Å; E951-K1029 HydrophobicContact CB-CG 4.01Å; E951-K1029 HydrophobicContact CG-CG 3.94Å; E951-K1029 WeakPolarHBondContact OE1-CE 3.43Å; E951-K1029 IonicContact OE1-NZ 2.72Å; E951-K1029 PolarHBondContact OE1-NZ 2.64Å; E951-K1029 VanDerWaalsContact OE1-NZ 3.11Å; E951-K1029 WeakPolarHBondContact OE2-CE 3.4Å; E951-K1029 IonicContact OE2-NZ 2.77Å; E951-K1029 PolarHBondContact OE2-NZ 3Å; G1027-K1029 PolarHBondContact O-N 3.31Å; K1029-A1046 CarbonylContact O-C 3.47Å; K1029-A1046 WeakPolarHBondContact O-CA 3.3Å; K1029-V1047 HydrophobicContact CB-CB 4.41Å; K1029-V1047 PolarHBondContact N-O 3.48Å; K1029-V1047 PolarHBondContact O-N 3.42Å
1030	L	89.4	Confident	68.1	Low	5 Å²	5	69.9 Å²	69.9	3%	0.026	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	134.1	166.1	-52.4	-175.7	0	0	0	108.7	V949 M950 Q1010 E1013 V1014 T1028 I1044 T1045 A1046	V949-L1030 CarbonylContact C-O 3.52Å; V949-L1030 VanDerWaalsContact CA-O 3.31Å; V949-L1030 WeakPolarHBondContact CA-O 3.36Å; V949-L1030 WeakPolarHBondContact CG1-O 3.49Å; M950-L1030 HydrophobicContact CB-CB 4.49Å; M950-L1030 PolarHBondContact N-O 3.29Å; M950-L1030 PolarHBondContact O-N 2.86Å; Q1010-L1030 HydrophobicContact CB-CD1 3.97Å; Q1010-L1030 HydrophobicContact CG-CB 4.12Å; Q1010-L1030 HydrophobicContact CG-CD1 4.34Å; Q1010-L1030 WeakPolarHBondContact O-CD1 3.49Å; E1013-L1030 HydrophobicContact CB-CD1 3.8Å; E1013-L1030 WeakPolarHBondContact OE2-CD2 3.38Å; V1014-L1030 HydrophobicContact CG2-CD1 3.8Å; T1028-L1030 HydrophobicContact CG2-CD2 4.25Å; L1030-I1044 HydrophobicContact CB-CG2 4.06Å; L1030-I1044 HydrophobicContact CD2-CG2 4.38Å; L1030-T1045 CarbonylContact C-O 3.52Å; L1030-A1046 HydrophobicContact CD2-CB 3.61Å
1031	A	87.5	Confident	67	Low	15 Å²	15	70.8 Å²	70.8	12%	0.124	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.9	179.2	0	0	0	0	0	112	V948 V949 T1045	V948-A1031 WeakPolarHBondContact O-CA 3.31Å; V949-A1031 HydrophobicContact CG2-CB 4.2Å; A1031-T1045 PolarHBondContact N-O 3.06Å; A1031-T1045 PolarHBondContact O-N 3.02Å
1032	T	84.4	Confident	66.5	Low	1 Å²	1	70.7 Å²	70.7	1%	0.006	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	140.4	176.5	-58.5	0	0	0	0	109.4	K947 V948 I1006 Q1010 P1042	K947-T1032 WeakPolarHBondContact CA-O 3.09Å; V948-T1032 PolarHBondContact N-O 2.75Å; V948-T1032 PolarHBondContact O-N 3.11Å; I1006-T1032 HydrophobicContact CG2-CG2 3.74Å; Q1010-T1032 PolarHBondContact NE2-OG1 3.29Å; T1032-P1042 HydrophobicContact CG2-CB 3.67Å
1033	V	74.1	Confident	66.7	Low	77 Å²	77	74.7 Å²	74.7	47%	0.467	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.8	175.4	-179.3	0	0	0	0	108.9	K945 K947	K945-V1033 HydrophobicContact CB-CG1 4.16Å; K945-V1033 HydrophobicContact CD-CG1 4.32Å; K947-V1033 HydrophobicContact CG-CG2 4.31Å
1034	L	64.6	Low	67.3	Low	38 Å²	38	70 Å²	70	20%	0.199	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	117.8	173.8	-71.6	163.1	0	0	0	110.6	R946 I1006	R946-L1034 HydrophobicContact CB-CB 4.16Å; R946-L1034 HydrophobicContact CB-CD1 4.04Å; R946-L1034 WeakPolarHBondContact O-CB 3.25Å; R946-L1034 PolarHBondContact O-N 3.41Å; I1006-L1034 HydrophobicContact CD1-CD1 3.64Å; I1006-L1034 HydrophobicContact CD1-CD2 3.71Å; I1006-L1034 HydrophobicContact CD1-CG 3.79Å
1035	D	60.8	Low	68.1	Low	78 Å²	78	68.1 Å²	68.1	42%	0.417	40%	0.401	S	S	.	.			trans	-97.1	117.3	157.7	-91.9	-51.5	0	0	0	108.6	K945 N1037 S1038	K945-D1035 WeakPolarHBondContact CE-OD1 3.4Å; K945-D1035 IonicContact NZ-OD1 2.64Å; K945-D1035 PolarHBondContact NZ-OD1 3.43Å; K945-D1035 IonicContact NZ-OD2 2.92Å; K945-D1035 PolarHBondContact NZ-OD2 3.3Å; D1035-N1037 PolarHBondContact O-N 3.05Å; D1035-S1038 PolarHBondContact O-N 2.87Å
1036	P	49.4	Very low	68.5	Low	119 Å²	119	70.7 Å²	70.7	77%	0.773	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	0.5	-168	30.5	-37.6	0	0	0	115.1
1037	N	47.1	Very low	68.2	Low	156 Å²	156	72.3 Å²	72.3	83%	0.834	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	2.9	178.5	-71.5	26.8	0	0	0	112.6	D1035	D1035-N1037 PolarHBondContact O-N 3.05Å
1038	S	47.3	Very low	67.4	Low	65 Å²	65	76.4 Å²	76.4	46%	0.455	45%	0.446	S	S	.	.			trans	-87.5	137.3	179	-169.6	0	0	0	0	111.9	D1035 E1040	D1035-S1038 PolarHBondContact O-N 2.87Å; S1038-E1040 WeakPolarHBondContact OG-CB 3.36Å; S1038-E1040 PolarHBondContact OG-N 2.86Å; S1038-E1040 VanDerWaalsContact OG-N 3.15Å
1039	T	47.7	Very low	65.7	Low	151 Å²	151	79.1 Å²	79.1	93%	0.926	46%	0.464	S	S	*	.			trans	-92.5	-1.2	169.9	-12.9	0	0	0	0	112.5
1040	E	46.8	Very low	63.2	Low	158 Å²	158	84.8 Å²	84.8	74%	0.738	49%	0.488	S	S	*	.	S	Bend	trans	-80	149.9	179.3	-62.3	-172.9	145.2	0	0	112.2	S1038	S1038-E1040 WeakPolarHBondContact OG-CB 3.36Å; S1038-E1040 PolarHBondContact OG-N 2.86Å; S1038-E1040 VanDerWaalsContact OG-N 3.15Å
1041	P	51.6	Low	60.8	Low	111 Å²	111	89.7 Å²	89.7	72%	0.721	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-63.8	144.6	176.3	26.8	-34.7	0	0	0	112.1	T1043	P1041-T1043 PolarHBondContact O-N 3.06Å
1042	P	58.5	Low	58.1	Low	66 Å²	66	94.5 Å²	94.5	43%	0.429	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-64.7	116.5	-175.7	24.6	-33.6	0	0	0	112.1	T1032 I1044	T1032-P1042 HydrophobicContact CG2-CB 3.67Å; P1042-I1044 PolarHBondContact O-N 3.18Å
1043	T	64.9	Low	55.5	Low	107 Å²	107	100.3 Å²	100.3	66%	0.656	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-71	124.5	174.9	-61.5	0	0	0	0	110.7	P1041	P1041-T1043 PolarHBondContact O-N 3.06Å
1044	I	74.5	Confident	53.4	Low	37 Å²	37	101.5 Å²	101.5	19%	0.19	61%	0.606	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.4	137.8	169	-56.7	175	0	0	0	108.7	A1009 Q1010 E1013 L1030 P1042	A1009-I1044 HydrophobicContact CB-CD1 3.81Å; Q1010-I1044 HydrophobicContact CG-CD1 4.04Å; Q1010-I1044 HydrophobicContact CG-CG1 4.35Å; Q1010-I1044 HydrophobicContact CG-CG2 4.4Å; E1013-I1044 WeakPolarHBondContact OE2-CG2 3.33Å; L1030-I1044 HydrophobicContact CB-CG2 4.06Å; L1030-I1044 HydrophobicContact CD2-CG2 4.38Å; P1042-I1044 PolarHBondContact O-N 3.18Å
1045	T	78.6	Confident	51.8	Low	78 Å²	78	104.3 Å²	104.3	48%	0.479	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.3	111.9	172.8	-55.5	0	0	0	0	109.1	L1030 A1031	L1030-T1045 CarbonylContact C-O 3.52Å; A1031-T1045 PolarHBondContact N-O 3.06Å; A1031-T1045 PolarHBondContact O-N 3.02Å
1046	A	76.4	Confident	50.3	Low	55 Å²	55	107.4 Å²	107.4	46%	0.455	66%	0.656	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.8	139.7	174.1	0	0	0	0	0	111.7	K1029 L1030	K1029-A1046 CarbonylContact O-C 3.47Å; K1029-A1046 WeakPolarHBondContact O-CA 3.3Å; L1030-A1046 HydrophobicContact CD2-CB 3.61Å
1047	V	74.6	Confident	49.4	Very low	88 Å²	88	105.6 Å²	105.6	53%	0.533	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-134.5	109.1	174.4	-177	0	0	0	0	108.4	T1028 K1029	T1028-V1047 WeakPolarHBondContact CA-O 3.44Å; K1029-V1047 HydrophobicContact CB-CB 4.41Å; K1029-V1047 PolarHBondContact N-O 3.48Å; K1029-V1047 PolarHBondContact O-N 3.42Å
1048	M	61.7	Low	48.7	Very low	112 Å²	112	103.7 Å²	103.7	55%	0.552	65%	0.651	S	S	*	*			trans	-88.7	154.1	178.9	-65.3	-179.8	176.2	0	0	111.8	L1017 T1028	L1017-M1048 HydrophobicContact CD1-CE 3.55Å; L1017-M1048 HydrophobicContact CD2-CE 4.13Å; T1028-M1048 HydrophobicContact CG2-CG 3.87Å
1049	P	50.5	Low	47.8	Very low	59 Å²	59	107.5 Å²	107.5	38%	0.383	67%	0.666	S	S	.	*			trans	-64.2	165.3	163.6	-19	34.2	0	0	0	111.9	V1026	V1026-P1049 WeakPolarHBondContact O-CG 3.26Å
1050	K	36.8	Very low	47.1	Very low	205 Å²	205	106.3 Å²	106.3	89%	0.891	66%	0.658	S	S	*	*			trans	-101.8	85.9	179	-164.3	172.7	-174.7	176.7	0	109.8
1051	D	38.3	Very low	46.3	Very low	108 Å²	108	106.7 Å²	106.7	58%	0.578	66%	0.657	S	S	*	*			trans	-64.3	157.6	-170.3	-92.8	-13.4	0	0	0	115.3
1052	S	30.5	Very low	45.6	Very low	116 Å²	116	106.4 Å²	106.4	81%	0.811	66%	0.656	S	S	*	*			trans	-121.9	135.7	172.3	-61	0	0	0	0	109.5
1053	S	30.9	Very low	44.4	Very low	122 Å²	122	110.8 Å²	110.8	85%	0.853	67%	0.668	S	S	*	*			trans	-138	115.9	-173.4	62.2	0	0	0	0	113.9
1054	A	30.4	Very low	42.9	Very low	103 Å²	103	112.2 Å²	112.2	85%	0.851	67%	0.67	S	S	*	*			trans	-161	108.8	157.1	0	0	0	0	0	111
1055	A	30.3	Very low	40.7	Very low	97 Å²	97	115.6 Å²	115.6	80%	0.802	69%	0.685	S	S	*	*			trans	-163.8	142.5	167.7	0	0	0	0	0	110.4
1056	T	30.2	Very low	38.4	Very low	142 Å²	142	117.6 Å²	117.6	87%	0.871	69%	0.692	S	S	*	*			trans	161.2	141.6	145.6	-75.8	0	0	0	0	113.4
1057	A	30.9	Very low	36.2	Very low	82 Å²	82	119.8 Å²	119.8	68%	0.678	69%	0.693	S	S	*	*			trans	66	105.9	155.3	0	0	0	0	0	123.4
1058	S	30.5	Very low	34.1	Very low	116 Å²	116	121.8 Å²	121.8	81%	0.811	69%	0.694	S	S	*	*				106.5	133.2	109.6	76.2	0	0	0	0	123
1059	N	28.6	Very low	32.6	Very low	145 Å²	145	119.7 Å²	119.7	78%	0.775	69%	0.688	S	S	*	*			trans	87.3	126.9	144.9	-111.7	-3.1	0	0	0	124.6
1060	T	34	Very low	32.3	Very low	125 Å²	125	122 Å²	122	77%	0.767	70%	0.703	S	S	*	*			trans	68.8	118.6	149.3	40.8	0	0	0	0	124.1
1061	K	30.2	Very low	32.1	Very low	166 Å²	166	118.2 Å²	118.2	72%	0.722	70%	0.699	S	S	*	*			trans	-58	178.7	156.8	-115.1	175.8	178.5	173.3	0	113
1062	P	36.6	Very low	31.8	Very low	106 Å²	106	119.5 Å²	119.5	69%	0.688	71%	0.711	S	S	*	*			cis	-142.1	171.7	4.6	40.3	-20.9	0	0	0	118.9
1063	K	33	Very low	31.7	Very low	158 Å²	158	124.4 Å²	124.4	69%	0.687	71%	0.712	S	S	*	*			trans	45.8	133.2	134.7	-164.1	163.7	-174.6	-176.2	0	120.1	E1065	K1063-E1065 WeakPolarHBondContact CE-OE2 2.98Å; K1063-E1065 IonicContact NZ-OE1 2.66Å; K1063-E1065 PolarHBondContact NZ-OE1 3.31Å; K1063-E1065 IonicContact NZ-OE2 2.83Å; K1063-E1065 PolarHBondContact NZ-OE2 2.88Å
1064	I	33.1	Very low	31.5	Very low	136 Å²	136	125.1 Å²	125.1	70%	0.697	71%	0.706	S	S	*	*				-160.7	146.7	89.5	-85.6	165.7	0	0	0	111.5	R1220	I1064-R1220 PolarHBondContact O-NH2 3.24Å
1065	E	29	Very low	31.4	Very low	108 Å²	108	124.3 Å²	124.3	51%	0.505	70%	0.699	S	S	.	*			trans	-33.4	168.5	169.9	-83.2	97.1	145.3	0	0	117	K1063	K1063-E1065 WeakPolarHBondContact CE-OE2 2.98Å; K1063-E1065 IonicContact NZ-OE1 2.66Å; K1063-E1065 PolarHBondContact NZ-OE1 3.31Å; K1063-E1065 IonicContact NZ-OE2 2.83Å; K1063-E1065 PolarHBondContact NZ-OE2 2.88Å
1066	I	30.9	Very low	31.2	Very low	121 Å²	121	124.6 Å²	124.6	62%	0.621	70%	0.696	S	S	*	*			cis	-155.7	173.5	37.8	-134.5	134.8	0	0	0	113.2
1067	E	28.9	Very low	31	Very low	100 Å²	100	126.6 Å²	126.6	47%	0.467	70%	0.695	S	S	.	*			trans	-26.3	175.8	161.4	-66.2	-172.2	113.2	0	0	120.8	F1222	E1067-F1222 HydrophobicContact CG-CE1 4.22Å; E1067-F1222 HydrophobicContact CG-CZ 4.07Å
1068	K	30.1	Very low	31	Very low	131 Å²	131	131.2 Å²	131.2	57%	0.57	70%	0.703	S	S	*	*			cis	-161.3	155.9	6	-136.3	170.5	-176.5	130.8	0	113.5
1069	T	31.1	Very low	31.2	Very low	67 Å²	67	130.1 Å²	130.1	41%	0.411	69%	0.693	S	S	.	*			trans	35.4	137	149.6	44.4	0	0	0	0	125.2	V1224	T1069-V1224 HydrophobicContact CG2-CB 3.76Å; T1069-V1224 HydrophobicContact CG2-CG1 3.39Å
1070	P	43.4	Very low	31.3	Very low	108 Å²	108	129.9 Å²	129.9	70%	0.701	69%	0.691	S	S	*	*			trans	-91.6	174.3	153.9	39.8	-34.2	0	0	0	112.8
1071	P	34.1	Very low	31.2	Very low	125 Å²	125	129.7 Å²	129.7	81%	0.812	69%	0.686	S	S	*	*				-148.6	176.7	121.1	40.4	-25.1	0	0	0	116.6
1072	T	31.6	Very low	31.2	Very low	136 Å²	136	126.6 Å²	126.6	83%	0.834	68%	0.681	S	S	*	*			trans	-59	152.3	170.6	-14.5	0	0	0	0	114.1
1073	R	28.5	Very low	31	Very low	218 Å²	218	125.2 Å²	125.2	82%	0.823	67%	0.665	S	S	*	*				171.7	155.3	101.1	-130	-178.7	156.3	124.9	1.6	115
1074	D	26.6	Very low	30.9	Very low	137 Å²	137	122.2 Å²	122.2	73%	0.733	66%	0.66	S	S	*	*			trans	60.9	154	151.9	-80	-55.5	0	0	0	122.6
1075	A	26.8	Very low	31	Very low	86 Å²	86	119.3 Å²	119.3	71%	0.711	65%	0.649	S	S	*	*			trans	-90.5	159.1	-170.3	0	0	0	0	0	113.5
1076	S	27.3	Very low	31.2	Very low	104 Å²	104	120.4 Å²	120.4	73%	0.727	66%	0.658	S	S	*	*				-176.1	149	120.5	-82.5	0	0	0	0	113.6
1077	Q	26.1	Very low	31.2	Very low	184 Å²	184	120.2 Å²	120.2	86%	0.86	66%	0.662	S	S	*	*			trans	53.9	111.5	141.7	-71.4	175.5	-27.4	0	0	120.8
1078	E	30.4	Very low	31.5	Very low	178 Å²	178	126.3 Å²	126.3	83%	0.832	68%	0.681	S	S	*	*			trans	-42.8	161.7	133.3	-94.6	-155	134.2	0	0	113.2
1079	P	35.2	Very low	31.6	Very low	94 Å²	94	127.4 Å²	127.4	61%	0.61	69%	0.686	S	S	*	*			cis	-145.1	-174	30.6	42	-22.2	0	0	0	116.6
1080	N	30.8	Very low	31.6	Very low	139 Å²	139	129.8 Å²	129.8	74%	0.743	70%	0.7	S	S	*	*			trans	45	149.1	138.9	-72.4	-33.5	0	0	0	122.3
1081	N	32	Very low	31	Very low	121 Å²	121	128.3 Å²	128.3	65%	0.647	69%	0.692	S	S	*	*			cis	-177.9	-168.1	-14.1	-175.7	12.8	0	0	0	106.8
1082	V	29.4	Very low	30.7	Very low	102 Å²	102	128.4 Å²	128.4	62%	0.618	68%	0.681	S	S	*	*			trans	100	99.5	152.3	-171.7	0	0	0	0	118.6
1083	Q	32.1	Very low	30.6	Very low	77 Å²	77	129.4 Å²	129.4	36%	0.36	68%	0.676	S	S	.	*				55.9	161	125.1	-52.3	-174.7	13.9	0	0	120	T26 G27 N28	T26-Q1083 PolarHBondContact O-NE2 2.91Å; T26-Q1083 PolarHBondContact O-OE1 2.94Å; G27-Q1083 VanDerWaalsContact CA-NE2 3.34Å; G27-Q1083 PolarHBondContact O-NE2 2.76Å; G27-Q1083 VanDerWaalsContact O-NE2 3.12Å; N28-Q1083 HydrophobicContact CB-CB 4.43Å; N28-Q1083 HydrophobicContact CB-CG 4.11Å; N28-Q1083 WeakPolarHBondContact O-CG 3.32Å; N28-Q1083 PolarHBondContact O-N 3.19Å; N28-Q1083 VanDerWaalsContact O-N 3.08Å
1084	V	30.7	Very low	30.6	Very low	95 Å²	95	123.2 Å²	123.2	58%	0.576	67%	0.667	S	S	*	*			cis	-152.1	119	40.5	161.6	0	0	0	0	114.8	F29	F29-V1084 VanDerWaalsContact CE2-N 3.35Å
1085	T	35.1	Very low	30.5	Very low	75 Å²	75	123.8 Å²	123.8	46%	0.46	67%	0.67	S	S	.	*			trans	61	176.6	148	74.9	0	0	0	0	121.5
1086	N	33.4	Very low	30.8	Very low	130 Å²	130	123.7 Å²	123.7	70%	0.695	67%	0.669	S	S	*	*			cis	-151.4	133.5	4.4	-122.7	-17.5	0	0	0	110.9
1087	V	32.2	Very low	30.8	Very low	117 Å²	117	127 Å²	127	71%	0.709	67%	0.673	S	S	*	*				67.7	130.8	101.9	171.6	0	0	0	0	115.8
1088	R	34.1	Very low	30.8	Very low	229 Å²	229	122.6 Å²	122.6	86%	0.864	66%	0.663	S	S	*	*			cis	-145	148.9	45.2	-124.7	146.4	-172.1	150.2	1.3	110.6
1089	K	32.4	Very low	30.6	Very low	154 Å²	154	119.3 Å²	119.3	67%	0.67	66%	0.655	S	S	*	*				67.3	136.2	54.6	-124.4	-162.4	168.4	-167.6	0	112.5
1090	V	32	Very low	30.2	Very low	117 Å²	117	123.3 Å²	123.3	71%	0.709	67%	0.665	S	S	*	*			cis	-145.2	150	31.2	174.1	0	0	0	0	109.8
1091	S	30.1	Very low	30	Very low	76 Å²	76	120.8 Å²	120.8	53%	0.531	66%	0.658	S	S	.	*			cis	108.1	143.4	2.5	-50.6	0	0	0	0	117.6
1092	Q	27.6	Very low	29.8	Very low	128 Å²	128	122.8 Å²	122.8	60%	0.598	67%	0.667	S	S	*	*			trans	73.7	162.7	161.4	-63.2	168.7	-94.4	0	0	116.5
1093	E	29.1	Very low	30	Very low	156 Å²	156	123.6 Å²	123.6	73%	0.729	67%	0.674	S	S	*	*			cis	-169.4	176.3	-11.5	-111.8	160.6	-163.2	0	0	109.5
1094	S	29.1	Very low	30.1	Very low	88 Å²	88	131.2 Å²	131.2	62%	0.615	70%	0.7	S	S	*	*			cis	-161.7	174.9	-6	55.2	0	0	0	0	111.2
1095	N	25.7	Very low	30.4	Very low	149 Å²	149	133 Å²	133	80%	0.797	71%	0.713	S	S	*	*			trans	37.1	133.3	142.9	-58.5	-10.1	0	0	0	124.1
1096	A	31.1	Very low	30.1	Very low	85 Å²	85	132.8 Å²	132.8	70%	0.702	73%	0.726	S	S	*	*				173.1	139.4	124.8	0	0	0	0	0	107.5
1097	E	27.3	Very low	29.9	Very low	174 Å²	174	130.3 Å²	130.3	81%	0.813	73%	0.731	S	S	*	*				59.6	132.4	54.8	-60.6	-174.8	95.5	0	0	112.2
1098	S	27	Very low	29.8	Very low	91 Å²	91	131.7 Å²	131.7	64%	0.636	73%	0.733	S	S	*	*			cis	-159.1	150.2	5.9	-132.9	0	0	0	0	111.3
1099	V	26.3	Very low	29.6	Very low	109 Å²	109	128.1 Å²	128.1	66%	0.661	73%	0.73	S	S	*	*				51.8	144.6	122.3	173.2	0	0	0	0	121.4
1100	Q	26.9	Very low	29.5	Very low	177 Å²	177	126.1 Å²	126.1	83%	0.827	73%	0.73	S	S	*	*			trans	69.8	162.7	167.6	-74.7	150.8	16.3	0	0	117.6
1101	S	26	Very low	29.5	Very low	86 Å²	86	128.3 Å²	128.3	60%	0.601	73%	0.734	S	S	*	*				174.6	139.6	-66.3	51.4	0	0	0	0	110.1
1102	I	28.1	Very low	29.6	Very low	164 Å²	164	130 Å²	130	84%	0.841	75%	0.746	S	S	*	*			trans	69.1	157.4	158	-70.7	163.9	0	0	0	113
1103	P	33.2	Very low	30.2	Very low	118 Å²	118	128.9 Å²	128.9	77%	0.766	75%	0.75	S	S	*	*			cis	-123.4	171.6	11.8	18.7	6.9	0	0	0	117.8
1104	R	33.9	Very low	30.4	Very low	238 Å²	238	127.2 Å²	127.2	90%	0.898	75%	0.751	S	S	*	*			trans	-81.8	153.6	155.5	-62.3	172.3	165.5	-173.4	-6.1	109.6
1105	P	37.6	Very low	30.6	Very low	132 Å²	132	129 Å²	129	86%	0.857	75%	0.753	S	S	*	*				-142.4	172.9	93.2	34.9	-18.9	0	0	0	113.1
1106	G	28.8	Very low	30.8	Very low	70 Å²	70	128.4 Å²	128.4	72%	0.722	75%	0.746	S	S	*	*			cis	150.4	94.9	-8	0	0	0	0	0	113.6
1107	G	30.4	Very low	30.9	Very low	78 Å²	78	129.2 Å²	129.2	80%	0.804	74%	0.742	S	S	*	*			trans	78.9	-177	177.7	0	0	0	0	0	114.5
1108	I	30.1	Very low	31.2	Very low	146 Å²	146	127.8 Å²	127.8	75%	0.749	74%	0.74	S	S	*	*			cis	-150.8	138.8	10.8	-71.9	-174.7	0	0	0	109.9
1109	I	29.8	Very low	31.4	Very low	155 Å²	155	128.3 Å²	128.3	80%	0.795	74%	0.744	S	S	*	*			trans	68.5	146	159.3	-77.1	169	0	0	0	118.9
1110	V	28.6	Very low	31.8	Very low	111 Å²	111	126.6 Å²	126.6	67%	0.673	74%	0.741	S	S	*	*			cis	-168.3	163.7	-24.3	81.9	0	0	0	0	111.2
1111	M	32.6	Very low	32.3	Very low	163 Å²	163	124.3 Å²	124.3	80%	0.803	74%	0.741	S	S	*	*			trans	58	119.5	165.2	-73.6	164.6	164.9	0	0	118.4
1112	S	33.3	Very low	33.2	Very low	112 Å²	112	125.5 Å²	125.5	78%	0.783	75%	0.747	S	S	*	*				60.5	147	61.4	-49.2	0	0	0	0	113.9
1113	P	40.4	Very low	33.8	Very low	105 Å²	105	123.6 Å²	123.6	68%	0.682	75%	0.745	S	S	*	*			cis	-144.5	169.4	20.3	42.6	-23.8	0	0	0	118.5
1114	T	32.2	Very low	33.9	Very low	120 Å²	120	124.6 Å²	124.6	74%	0.736	75%	0.75	S	S	*	*			trans	60.7	152.6	149	51.2	0	0	0	0	119.4
1115	N	32.8	Very low	33.9	Very low	125 Å²	125	116.7 Å²	116.7	67%	0.668	74%	0.742	S	S	*	*			cis	-162	166.1	4.9	-122.5	15.9	0	0	0	109.1
1116	Q	31.4	Very low	33.5	Very low	137 Å²	137	115 Å²	115	64%	0.64	74%	0.739	S	S	*	*			cis	-167	162.8	-11.3	-146.1	-173.2	-107	0	0	110.7
1117	T	32	Very low	33.5	Very low	103 Å²	103	116.3 Å²	116.3	63%	0.632	74%	0.743	S	S	*	*			trans	42.2	130.9	149	44.4	0	0	0	0	122.5
1118	D	33	Very low	33.6	Very low	143 Å²	143	117.5 Å²	117.5	77%	0.765	75%	0.745	S	S	*	*			cis	-158.9	-117	-9.2	-150.7	77.6	0	0	0	115.7
1119	S	32.5	Very low	33.7	Very low	102 Å²	102	120 Å²	120	71%	0.713	75%	0.751	S	S	*	*			trans	-147	-174.4	-165.3	67.2	0	0	0	0	109.8
1120	A	34.7	Very low	34	Very low	74 Å²	74	118.9 Å²	118.9	61%	0.612	75%	0.753	S	S	*	*			cis	-146.3	172.4	10	0	0	0	0	0	111
1121	P	35.9	Very low	34.2	Very low	128 Å²	128	118.9 Å²	118.9	83%	0.831	76%	0.758	S	S	*	*				-138.5	155.1	87.7	39.9	-29.2	0	0	0	114
1122	P	46.7	Very low	34	Very low	112 Å²	112	121.3 Å²	121.3	73%	0.727	76%	0.759	S	S	*	*			trans	-149.7	-163.9	138.8	44	-27.2	0	0	0	111.1
1123	P	40.1	Very low	33.8	Very low	123 Å²	123	123.6 Å²	123.6	80%	0.799	76%	0.755	S	S	*	*			cis	-133.5	174	-2.5	41.2	-23.7	0	0	0	117.3
1124	T	34.3	Very low	33.2	Very low	140 Å²	140	126.1 Å²	126.1	86%	0.859	76%	0.757	S	S	*	*			trans	-110.2	157.9	176.1	53.8	0	0	0	0	113.2
1125	G	33.7	Very low	32.9	Very low	71 Å²	71	124.7 Å²	124.7	73%	0.732	75%	0.748	S	S	*	*			trans	-147.7	129.3	150	0	0	0	0	0	109
1126	A	30.1	Very low	32.6	Very low	97 Å²	97	122 Å²	122	80%	0.802	74%	0.737	S	S	*	*			cis	72.6	134.6	29	0	0	0	0	0	114
1127	A	29.6	Very low	32.5	Very low	97 Å²	97	122.3 Å²	122.3	80%	0.802	74%	0.736	S	S	*	*			cis	-169.1	-173.7	-13.2	0	0	0	0	0	110.2
1128	A	31.5	Very low	32.3	Very low	103 Å²	103	122.5 Å²	122.5	85%	0.851	74%	0.741	S	S	*	*			trans	115.7	147	150	0	0	0	0	0	119.6
1129	K	31.6	Very low	32	Very low	200 Å²	200	119.5 Å²	119.5	87%	0.87	74%	0.736	S	S	*	*			trans	-111.6	-178.8	178.2	-70.2	177.7	-179.8	175.8	0	106.8
1130	P	36.4	Very low	32	Very low	130 Å²	130	121.8 Å²	121.8	84%	0.844	74%	0.74	S	S	*	*			cis	-150	-170.2	26.1	44	-21	0	0	0	118.3
1131	S	33.6	Very low	32	Very low	111 Å²	111	123.6 Å²	123.6	78%	0.776	75%	0.746	S	S	*	*			trans	-95.2	151	178.6	161.2	0	0	0	0	113.5
1132	R	28.5	Very low	31.5	Very low	215 Å²	215	124.8 Å²	124.8	81%	0.811	74%	0.744	S	S	*	*			trans	-157.6	125.8	146.3	-162.5	150	-164.6	142.5	6.7	113.9
1133	F	28.4	Very low	30.6	Very low	160 Å²	160	123 Å²	123	70%	0.702	74%	0.739	S	S	*	*			trans	13.2	142.3	144.8	-68.2	-110.2	0	0	0	119.5
1134	Q	27.8	Very low	30.2	Very low	157 Å²	157	123.7 Å²	123.7	73%	0.734	74%	0.741	S	S	*	*				177.4	163.8	59.9	-116.5	138.6	-112.6	0	0	109
1135	V	27.2	Very low	30.3	Very low	90 Å²	90	121.8 Å²	121.8	55%	0.545	73%	0.731	S	S	.	*			cis	-173.7	138.9	-24.1	65.1	0	0	0	0	113.6	P1253	V1135-P1253 CarbonylContact C-O 3.52Å; V1135-P1253 VanDerWaalsContact O-O 3.05Å
1136	T	26.6	Very low	29.8	Very low	69 Å²	69	126.1 Å²	126.1	42%	0.423	74%	0.736	S	S	.	*			trans	68.8	128.3	154.4	45.4	0	0	0	0	125.7	C1252 P1253	T1136-C1252 CarbonylContact O-C 3.45Å; T1136-P1253 CarbonylContact C-O 3.6Å; T1136-P1253 PolarHBondContact N-O 3.39Å; T1136-P1253 CarbonylContact O-C 3.59Å; T1136-P1253 WeakPolarHBondContact O-CA 3.16Å
1137	K	27.5	Very low	30	Very low	144 Å²	144	126.4 Å²	126.4	63%	0.626	73%	0.732	S	S	*	*			trans	78.5	166.4	132.1	-69.1	175.5	-179.5	-175.7	0	120.9	P1253 P1254	K1137-P1253 VanDerWaalsContact O-CA 3.32Å; K1137-P1253 WeakPolarHBondContact O-CA 3.47Å; K1137-P1254 WeakPolarHBondContact O-CD 3.47Å
1138	S	28.1	Very low	29.9	Very low	106 Å²	106	126.3 Å²	126.3	74%	0.741	73%	0.725	S	S	*	*			cis	-165.2	168	-36.8	-94.9	0	0	0	0	111.4
1139	A	28.3	Very low	30	Very low	80 Å²	80	125.9 Å²	125.9	66%	0.661	72%	0.716	S	S	*	*			trans	74.4	117.5	166.8	0	0	0	0	0	116.7
1140	D	31.9	Very low	29.9	Very low	150 Å²	150	123.1 Å²	123.1	80%	0.802	71%	0.709	S	S	*	*				70	141.4	63.5	-61.7	-49.7	0	0	0	112.4
1141	P	33.4	Very low	29.5	Very low	112 Å²	112	121.8 Å²	121.8	73%	0.727	70%	0.703	S	S	*	*			cis	-148.7	159.7	38.8	43.7	-23.9	0	0	0	120.4
1142	I	25.9	Very low	29.1	Very low	153 Å²	153	121.9 Å²	121.9	79%	0.785	70%	0.699	S	S	*	*				37	97	126.8	-48.8	177.4	0	0	0	119.7
1143	A	27.3	Very low	29.1	Very low	76 Å²	76	115.9 Å²	115.9	63%	0.628	70%	0.695	S	S	*	*				66.6	147.5	118.6	0	0	0	0	0	125.2
1144	T	33.4	Very low	29.1	Very low	136 Å²	136	114.5 Å²	114.5	83%	0.834	70%	0.7	S	S	*	*			trans	71.3	167.6	151.6	55.1	0	0	0	0	119.2
1145	P	34.7	Very low	29.2	Very low	101 Å²	101	112.6 Å²	112.6	66%	0.656	70%	0.699	S	S	*	*				-140.8	-169.8	-55	43.3	-27.5	0	0	0	114.2
1146	I	24.5	Very low	29.4	Very low	161 Å²	161	115.6 Å²	115.6	83%	0.826	71%	0.711	S	S	*	*			trans	76.7	152.5	158.7	-64.8	166.5	0	0	0	118
1147	S	33.2	Very low	29.9	Very low	104 Å²	104	117.2 Å²	117.2	73%	0.727	72%	0.722	S	S	*	*			trans	-80.9	161.1	-174.8	-33.7	0	0	0	0	115.4
1148	S	28.8	Very low	30	Very low	95 Å²	95	117.6 Å²	117.6	66%	0.664	73%	0.73	S	S	*	*				168	120.5	113.2	48.6	0	0	0	0	116.6
1149	S	32.6	Very low	30.2	Very low	93 Å²	93	118.9 Å²	118.9	65%	0.65	73%	0.732	S	S	*	*			trans	20.7	163.4	133.3	65.6	0	0	0	0	125.2
1150	I	29.4	Very low	30.3	Very low	142 Å²	142	119 Å²	119	73%	0.728	73%	0.734	S	S	*	*			trans	85.1	138.2	165.2	-56.5	160.7	0	0	0	112.4
1151	S	28	Very low	30.4	Very low	103 Å²	103	116.1 Å²	116.1	72%	0.72	73%	0.731	S	S	*	*			cis	-152.2	177.9	19.1	-127.5	0	0	0	0	111.2
1152	T	26.8	Very low	30.4	Very low	113 Å²	113	117.1 Å²	117.1	69%	0.693	74%	0.735	S	S	*	*			cis	-175.4	132.7	-39.4	-79.2	0	0	0	0	111
1153	A	27.3	Very low	31	Very low	88 Å²	88	115.5 Å²	115.5	73%	0.727	73%	0.734	S	S	*	*			trans	67.7	159.9	156.5	0	0	0	0	0	123.3
1154	T	28.8	Very low	31.1	Very low	132 Å²	132	118.1 Å²	118.1	81%	0.81	74%	0.743	S	S	*	*			trans	104.1	124.9	154.9	-46.1	0	0	0	0	117
1155	V	28.9	Very low	30.8	Very low	117 Å²	117	117.8 Å²	117.8	71%	0.709	74%	0.736	S	S	*	*			cis	-169.1	170.6	-20.6	75	0	0	0	0	111
1156	I	31.8	Very low	30.5	Very low	153 Å²	153	119.8 Å²	119.8	79%	0.785	74%	0.74	S	S	*	*			trans	84.8	144	158.7	-85.9	169.2	0	0	0	118.4
1157	P	37	Very low	30.6	Very low	102 Å²	102	117.2 Å²	117.2	66%	0.662	73%	0.731	S	S	*	*				-141.5	-133.8	-125.5	38.7	-14.2	0	0	0	114.2
1158	I	29.9	Very low	30.4	Very low	153 Å²	153	117.3 Å²	117.3	79%	0.785	73%	0.732	S	S	*	*			trans	78.9	132	162.9	-74.8	158.7	0	0	0	115
1159	V	33.4	Very low	30.3	Very low	132 Å²	132	121.2 Å²	121.2	80%	0.8	74%	0.74	S	S	*	*			cis	-150.4	174.4	3.2	102.4	0	0	0	0	114.1
1160	A	30.3	Very low	30.5	Very low	84 Å²	84	121.7 Å²	121.7	69%	0.694	74%	0.741	S	S	*	*			trans	-58.4	-172.7	177.2	0	0	0	0	0	115.8
1161	A	34.2	Very low	30.3	Very low	89 Å²	89	120.4 Å²	120.4	74%	0.736	74%	0.739	S	S	*	*			cis	-167.1	166.8	24.6	0	0	0	0	0	110.3
1162	T	32.4	Very low	30.1	Very low	132 Å²	132	122.3 Å²	122.3	81%	0.81	74%	0.74	S	S	*	*			cis	-164.4	158.7	-12.9	16.8	0	0	0	0	109.3
1163	P	38.4	Very low	30.2	Very low	119 Å²	119	123.3 Å²	123.3	77%	0.773	75%	0.745	S	S	*	*			trans	-99.9	157.9	-176.6	38.8	-34.8	0	0	0	115.5
1164	T	29.3	Very low	30.4	Very low	131 Å²	131	126.9 Å²	126.9	80%	0.804	75%	0.747	S	S	*	*			trans	-157	131.1	159.2	36.3	0	0	0	0	107.8
1165	N	26.3	Very low	30.7	Very low	129 Å²	129	125.8 Å²	125.8	69%	0.69	74%	0.743	S	S	*	*				68.7	117.7	59.4	-157.2	28.4	0	0	0	110.7
1166	I	29.8	Very low	30.7	Very low	144 Å²	144	126.7 Å²	126.7	74%	0.738	74%	0.742	S	S	*	*				-163.2	127.5	83.4	-81.9	147.1	0	0	0	107.8
1167	T	26.7	Very low	30.7	Very low	106 Å²	106	125.3 Å²	125.3	65%	0.65	74%	0.741	S	S	*	*				54.6	139.9	94.3	-3	0	0	0	0	114.5
1168	S	29.4	Very low	30.4	Very low	107 Å²	107	124.3 Å²	124.3	75%	0.748	74%	0.741	S	S	*	*			cis	-155.7	162	19.2	-46.8	0	0	0	0	112.6
1169	E	26.4	Very low	30.5	Very low	176 Å²	176	125.7 Å²	125.7	82%	0.822	74%	0.744	S	S	*	*			trans	-81.5	-161.1	151.8	-37.3	-176.2	125.4	0	0	110.4
1170	P	35.8	Very low	30.3	Very low	104 Å²	104	125.3 Å²	125.3	68%	0.675	74%	0.742	S	S	*	*			cis	-134.4	-150.8	-20.8	23.6	3.1	0	0	0	111.8
1171	V	25.5	Very low	30.4	Very low	115 Å²	115	127.9 Å²	127.9	70%	0.697	74%	0.743	S	S	*	*			trans	109.2	102.8	136.1	156.7	0	0	0	0	121.3
1172	I	24.5	Very low	30.3	Very low	143 Å²	143	128.6 Å²	128.6	73%	0.733	74%	0.738	S	S	*	*				44.2	129	128.6	-42	164.5	0	0	0	120.4
1173	V	27.6	Very low	30.4	Very low	133 Å²	133	129.5 Å²	129.5	81%	0.806	73%	0.733	S	S	*	*				176.2	135.5	116.2	155.7	0	0	0	0	111.2
1174	Q	31.2	Very low	30.2	Very low	163 Å²	163	131.4 Å²	131.4	76%	0.762	74%	0.735	S	S	*	*			trans	-97.1	168.2	174.5	-45.4	174.9	-14	0	0	110.4
1175	P	35	Very low	30.3	Very low	110 Å²	110	129.4 Å²	129.4	71%	0.714	73%	0.732	S	S	*	*				-153.7	148.1	76.4	36.4	-14.7	0	0	0	119.6
1176	I	29.2	Very low	30.6	Very low	135 Å²	135	129.5 Å²	129.5	69%	0.692	74%	0.738	S	S	*	*				39.2	129.7	119.5	-33.6	163.1	0	0	0	117.4
1177	T	31.8	Very low	30.8	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	74%	0.741	S	S	*	*				-177.7	147.5	67.2	-36.6	0	0	0	0	114.9
1178	A	31.2	Very low	31.2	Very low	80 Å²	80	129.2 Å²	129.2	66%	0.661	75%	0.75	S	S	*	*			trans	62.7	148.7	148.1	0	0	0	0	0	122.8
1179	Q	32.2	Very low	31.4	Very low	182 Å²	182	130 Å²	130	85%	0.85	75%	0.752	S	S	*	*			cis	-161.4	145.9	-6.7	-117.8	169	-6.1	0	0	115
1180	V	29.1	Very low	31.5	Very low	124 Å²	124	128.3 Å²	128.3	75%	0.752	75%	0.753	S	S	*	*			trans	26.1	130.6	143	169.7	0	0	0	0	119.4
1181	I	31.7	Very low	31.3	Very low	139 Å²	139	129 Å²	129	71%	0.713	76%	0.76	S	S	*	*				-140	172.1	51.3	-13.1	177.6	0	0	0	109.2
1182	T	33.7	Very low	31.5	Very low	104 Å²	104	132.4 Å²	132.4	64%	0.638	77%	0.769	S	S	*	*			cis	68.6	145	18.2	59	0	0	0	0	117.5
1183	H	34.3	Very low	31.7	Very low	151 Å²	151	130.9 Å²	130.9	70%	0.699	77%	0.771	S	S	*	*			cis	-135.1	169.4	24.5	-69.5	-92.2	0	0	0	111.5
1184	L	33	Very low	31.8	Very low	159 Å²	159	132.5 Å²	132.5	83%	0.832	77%	0.774	S	S	*	*			cis	78.6	141.1	43.5	-111	71	0	0	0	114.7
1185	A	31	Very low	31.7	Very low	88 Å²	88	129.7 Å²	129.7	73%	0.727	77%	0.772	S	S	*	*			cis	-160.5	170.9	15.1	0	0	0	0	0	116.8
1186	T	34.3	Very low	31.6	Very low	132 Å²	132	129.1 Å²	129.1	81%	0.81	77%	0.771	S	S	*	*			trans	-92.7	174.4	164.4	48.8	0	0	0	0	112.7
1187	P	33.7	Very low	31.5	Very low	126 Å²	126	129.9 Å²	129.9	82%	0.818	78%	0.776	S	S	*	*			trans	-136.8	138.8	148.7	37.2	-23.2	0	0	0	115.8
1188	S	33.8	Very low	31.5	Very low	118 Å²	118	129.1 Å²	129.1	83%	0.825	78%	0.776	S	S	*	*			trans	-108.7	157.8	152.9	-52.2	0	0	0	0	108.7
1189	P	34.7	Very low	31.5	Very low	123 Å²	123	130.7 Å²	130.7	80%	0.799	78%	0.782	S	S	*	*			trans	-128	127.2	157.3	34.6	-21.7	0	0	0	113.2
1190	V	27.8	Very low	31.8	Very low	140 Å²	140	127.4 Å²	127.4	85%	0.848	78%	0.777	S	S	*	*			trans	-97.9	139.9	151.5	-80.8	0	0	0	0	108.4
1191	S	31.4	Very low	31.9	Very low	118 Å²	118	127 Å²	127	83%	0.825	78%	0.779	S	S	*	*			trans	-158.1	155.2	171.3	-82.4	0	0	0	0	110.6
1192	H	29.5	Very low	31.8	Very low	187 Å²	187	124.6 Å²	124.6	87%	0.866	78%	0.78	S	S	*	*			trans	-105.3	145.5	-158	-58.6	-100.1	0	0	0	114
1193	S	29.5	Very low	31.5	Very low	112 Å²	112	125.8 Å²	125.8	78%	0.783	79%	0.788	S	S	*	*			trans	-154.3	111.5	151.5	47.2	0	0	0	0	111.8
1194	L	28.7	Very low	31.1	Very low	167 Å²	167	124.3 Å²	124.3	87%	0.874	79%	0.79	S	S	*	*			trans	18.7	127.7	145.6	-49.7	172.6	0	0	0	117.3
1195	S	29.4	Very low	30.9	Very low	103 Å²	103	125 Å²	125	72%	0.72	79%	0.788	S	S	*	*			cis	-156.5	138	39.8	-56	0	0	0	0	115.5
1196	S	32.7	Very low	30.8	Very low	98 Å²	98	126.2 Å²	126.2	69%	0.685	79%	0.791	S	S	*	*			trans	50	112.8	143.4	62.8	0	0	0	0	123.1
1197	N	28.5	Very low	30.5	Very low	151 Å²	151	127 Å²	127	81%	0.807	79%	0.79	S	S	*	*				57.9	148.1	121.5	-59.2	10.7	0	0	0	121.4
1198	S	30.9	Very low	30.3	Very low	109 Å²	109	128.2 Å²	128.2	76%	0.762	79%	0.787	S	S	*	*			cis	-166.9	167.8	-13.7	-92.2	0	0	0	0	110.4
1199	S	32.2	Very low	30.2	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	78%	0.775	S	S	*	*			trans	-80.7	-168.5	178.1	-16	0	0	0	0	113.3
1200	P	38.8	Very low	30.3	Very low	113 Å²	113	124.8 Å²	124.8	73%	0.734	77%	0.766	S	S	*	*			cis	-135.6	-177.2	-39.4	37.9	-20.2	0	0	0	114.2
1201	S	29.6	Very low	30.3	Very low	116 Å²	116	125.6 Å²	125.6	81%	0.811	76%	0.764	S	S	*	*			trans	62.2	133.3	147.1	-63.8	0	0	0	0	124.5
1202	A	29.7	Very low	30.3	Very low	88 Å²	88	127.6 Å²	127.6	73%	0.727	76%	0.76	S	S	*	*			trans	81.7	106.9	139.4	0	0	0	0	0	123.3
1203	T	28	Very low	30.3	Very low	130 Å²	130	123.3 Å²	123.3	80%	0.798	75%	0.751	S	S	*	*			trans	83	141.3	134.8	-36.3	0	0	0	0	122
1204	T	26	Very low	30.3	Very low	120 Å²	120	123.8 Å²	123.8	74%	0.736	75%	0.75	S	S	*	*			trans	86.1	106.8	156	6.6	0	0	0	0	122.1
1205	H	29.4	Very low	30.4	Very low	173 Å²	173	121.5 Å²	121.5	80%	0.801	74%	0.743	S	S	*	*			trans	7.7	153.5	145	-63.4	-84.7	0	0	0	124.2
1206	S	27.7	Very low	30.6	Very low	114 Å²	114	121.3 Å²	121.3	80%	0.797	74%	0.742	S	S	*	*			trans	92.7	104.6	162.7	-39.9	0	0	0	0	113.9
1207	N	29.2	Very low	30.7	Very low	147 Å²	147	121.3 Å²	121.3	79%	0.786	74%	0.737	S	S	*	*			cis	87	133.7	42.6	-168.6	27.6	0	0	0	113.6
1208	M	29.4	Very low	31.4	Very low	152 Å²	152	120.2 Å²	120.2	75%	0.749	74%	0.739	S	S	*	*			trans	68.8	151	177	-56.7	-131.9	105.2	0	0	115.4
1209	S	32	Very low	31.6	Very low	82 Å²	82	118.6 Å²	118.6	57%	0.573	74%	0.739	S	S	*	*			cis	-156.9	149	-2.4	-128.9	0	0	0	0	114.6
1210	S	35.6	Very low	31.9	Very low	88 Å²	88	120.7 Å²	120.7	62%	0.615	73%	0.73	S	S	*	*				37.6	124.9	124.9	-43.1	0	0	0	0	121.9
1211	I	28.2	Very low	31.7	Very low	156 Å²	156	124.4 Å²	124.4	80%	0.8	73%	0.729	S	S	*	*			trans	-118.8	99.4	141.8	-66	-178	0	0	0	104.9
1212	Q	31	Very low	31.9	Very low	160 Å²	160	122.4 Å²	122.4	75%	0.748	71%	0.706	S	S	*	*				68.3	131.1	95.1	-66	170.8	32.7	0	0	112.3
1213	S	30.6	Very low	32	Very low	97 Å²	97	122.5 Å²	122.5	68%	0.678	70%	0.698	S	S	*	*				-152.4	145.2	63.1	-62.5	0	0	0	0	115.3
1214	T	29.2	Very low	32.1	Very low	123 Å²	123	121 Å²	121	76%	0.755	69%	0.688	S	S	*	*			trans	54.4	131.2	140.3	58	0	0	0	0	120.2
1215	T	30.7	Very low	32.4	Very low	118 Å²	118	123.5 Å²	123.5	72%	0.724	69%	0.691	S	S	*	*			cis	-164.6	139.5	8	-1.1	0	0	0	0	113.1
1216	S	33.4	Very low	32.9	Very low	100 Å²	100	120.5 Å²	120.5	70%	0.699	69%	0.687	S	S	*	*			trans	37.5	140.6	138.8	70.7	0	0	0	0	121.3
1217	V	34	Very low	33	Very low	97 Å²	97	121.1 Å²	121.1	59%	0.588	69%	0.686	S	S	*	*				-155.8	154.2	51.6	164.9	0	0	0	0	111.5
1218	P	43.2	Very low	33.2	Very low	129 Å²	129	118.6 Å²	118.6	84%	0.838	68%	0.68	S	S	*	*			trans	-134.2	-178.5	-161.2	44.3	-27.9	0	0	0	118.6
1219	G	36.5	Very low	33.2	Very low	75 Å²	75	120.1 Å²	120.1	77%	0.773	69%	0.685	S	S	*	*			trans	139.3	142.7	158.3	0	0	0	0	0	114
1220	R	37.9	Very low	33.1	Very low	157 Å²	157	120.6 Å²	120.6	59%	0.592	69%	0.694	S	S	*	*			cis	-141.8	162.4	3.2	-66.7	-178.1	171.1	174.6	2	110	I1064	I1064-R1220 PolarHBondContact O-NH2 3.24Å
1221	R	34.1	Very low	32.9	Very low	190 Å²	190	124.8 Å²	124.8	72%	0.717	70%	0.704	S	S	*	*			cis	85.8	139.7	24	-141.2	-176.8	-172.5	-172.4	6.3	114.5
1222	F	33.8	Very low	33	Very low	74 Å²	74	123.3 Å²	123.3	33%	0.325	71%	0.708	S	S	.	*			cis	-135.6	162.2	18.4	-60.1	-110.8	0	0	0	112.4	E1067	E1067-F1222 HydrophobicContact CG-CE1 4.22Å; E1067-F1222 HydrophobicContact CG-CZ 4.07Å
1223	T	33.1	Very low	32.9	Very low	91 Å²	91	118.6 Å²	118.6	56%	0.558	70%	0.702	S	S	*	*			cis	89.2	103.3	3.3	80	0	0	0	0	120.9
1224	V	30.3	Very low	32.7	Very low	98 Å²	98	121.9 Å²	121.9	59%	0.594	71%	0.71	S	S	*	*			trans	-169.7	178	159.2	127.1	0	0	0	0	110.4	T1069	T1069-V1224 HydrophobicContact CG2-CB 3.76Å; T1069-V1224 HydrophobicContact CG2-CG1 3.39Å
1225	Q	31	Very low	32.7	Very low	172 Å²	172	121 Å²	121	80%	0.804	71%	0.709	S	S	*	*				-137.1	-110.8	-105.5	-84	163.1	-112.1	0	0	116
1226	P	39.6	Very low	32.6	Very low	111 Å²	111	120.4 Å²	120.4	72%	0.721	71%	0.709	S	S	*	*			trans	-135.5	-170.2	-142.1	37.5	-13.5	0	0	0	118.7
1227	V	29.7	Very low	32.4	Very low	126 Å²	126	121 Å²	121	76%	0.764	71%	0.713	S	S	*	*			trans	142.4	116.9	133.1	175.3	0	0	0	0	118.4
1228	S	33.7	Very low	32	Very low	94 Å²	94	123.9 Å²	123.9	66%	0.657	72%	0.724	S	S	*	*			trans	45.2	128.1	141.1	-56	0	0	0	0	129.5
1229	Q	30.1	Very low	31.3	Very low	184 Å²	184	122.1 Å²	122.1	86%	0.86	72%	0.715	S	S	*	*				63.2	144	120.9	-63.5	-178.9	-56.1	0	0	126.3
1230	A	29.5	Very low	31.1	Very low	92 Å²	92	123.5 Å²	123.5	76%	0.76	71%	0.708	S	S	*	*			trans	72.5	158.4	149.9	0	0	0	0	0	118.2
1231	E	30.7	Very low	31.1	Very low	176 Å²	176	121.1 Å²	121.1	82%	0.822	71%	0.713	S	S	*	*			cis	-159.4	158.6	-1.2	-144.1	171.7	176.9	0	0	112
1232	S	31.6	Very low	31.2	Very low	126 Å²	126	120.7 Å²	120.7	88%	0.881	72%	0.719	S	S	*	*			trans	61.8	170.7	165.8	78.7	0	0	0	0	117.6
1233	G	27.9	Very low	31.4	Very low	61 Å²	61	122.6 Å²	122.6	63%	0.629	74%	0.739	S	S	*	*			cis	159.9	147.3	-12.1	0	0	0	0	0	113.9
1234	I	27.9	Very low	31.6	Very low	166 Å²	166	125.2 Å²	125.2	85%	0.851	75%	0.745	S	S	*	*			trans	58	111.9	159.7	60.2	166.6	0	0	0	123.3
1235	S	27.8	Very low	32	Very low	105 Å²	105	126.2 Å²	126.2	73%	0.734	75%	0.753	S	S	*	*				92	125.6	123	-61.7	0	0	0	0	125.2
1236	S	28.8	Very low	32.2	Very low	104 Å²	104	123.2 Å²	123.2	73%	0.727	75%	0.746	S	S	*	*			trans	73.1	105.1	133.7	61.1	0	0	0	0	124.7
1237	S	28.8	Very low	32.5	Very low	112 Å²	112	123.5 Å²	123.5	78%	0.783	75%	0.748	S	S	*	*				78.2	137.5	113.7	-54.5	0	0	0	0	124.6
1238	I	26.6	Very low	32.5	Very low	158 Å²	158	121.7 Å²	121.7	81%	0.81	75%	0.747	S	S	*	*			trans	92.3	101.8	143.9	-79.1	171.5	0	0	0	121.9
1239	S	28.9	Very low	32.4	Very low	92 Å²	92	124.3 Å²	124.3	64%	0.643	75%	0.752	S	S	*	*				66.1	111.4	125.2	-46.1	0	0	0	0	126.4
1240	T	31.7	Very low	32.4	Very low	105 Å²	105	121.4 Å²	121.4	64%	0.644	75%	0.747	S	S	*	*				57.1	167.5	124.3	61.2	0	0	0	0	123.4
1241	P	38.6	Very low	32.4	Very low	106 Å²	106	121.5 Å²	121.5	69%	0.688	74%	0.742	S	S	*	*			cis	-144.3	166.2	-44.3	40.7	-23.7	0	0	0	117.2
1242	H	35.9	Very low	32.3	Very low	182 Å²	182	117.9 Å²	117.9	84%	0.843	74%	0.735	S	S	*	*			trans	57.2	176.1	156	-106.7	-110.7	0	0	0	119.4
1243	P	37.5	Very low	32.5	Very low	113 Å²	113	115.5 Å²	115.5	73%	0.734	72%	0.716	S	S	*	*			cis	-123.5	-173.7	-16.9	21.9	2.9	0	0	0	115.8
1244	E	37.4	Very low	33.6	Very low	147 Å²	147	116 Å²	116	69%	0.687	71%	0.709	S	S	*	*			trans	-52.7	175.9	166.1	-111.9	-157	99.8	0	0	116.7	T1246	E1244-T1246 WeakPolarHBondContact OE1-CG2 3.32Å; E1244-T1246 PolarHBondContact OE1-OG1 3.13Å
1245	P	38.3	Very low	34.1	Very low	118 Å²	118	113.3 Å²	113.3	77%	0.766	70%	0.702	S	S	*	*			cis	-144.8	174.2	34.3	41.3	-19.2	0	0	0	121.5
1246	T	35.9	Very low	34.6	Very low	109 Å²	109	114.1 Å²	114.1	67%	0.669	70%	0.702	S	S	*	*			trans	-54.4	-173.7	165.3	46.5	0	0	0	0	118.2	E1244	E1244-T1246 WeakPolarHBondContact OE1-CG2 3.32Å; E1244-T1246 PolarHBondContact OE1-OG1 3.13Å
1247	P	44.8	Very low	35.1	Very low	117 Å²	117	114.4 Å²	114.4	76%	0.76	70%	0.701	S	S	*	*			cis	-137.7	-159.5	-20.5	27.4	-1.9	0	0	0	115.1
1248	A	30.3	Very low	35.3	Very low	88 Å²	88	114.7 Å²	114.7	73%	0.727	70%	0.703	S	S	*	*			trans	103.8	145.2	146.3	0	0	0	0	0	117.5
1249	I	31	Very low	35.8	Very low	150 Å²	150	113.5 Å²	113.5	77%	0.769	70%	0.703	S	S	*	*			cis	-161.4	151.4	-0.9	-135.1	169	0	0	0	112.3
1250	T	30.4	Very low	36.1	Very low	123 Å²	123	114.4 Å²	114.4	76%	0.755	71%	0.707	S	S	*	*			trans	65	135.6	152.4	-66.7	0	0	0	0	120.2
1251	S	30.4	Very low	36.5	Very low	94 Å²	94	115.1 Å²	115.1	66%	0.657	71%	0.713	S	S	*	*			cis	-172.4	160.1	-5.6	55.3	0	0	0	0	115.7
1252	C	28.8	Very low	36.1	Very low	99 Å²	99	117 Å²	117	67%	0.669	72%	0.723	S	S	*	*			trans	85.3	148.9	149.3	-74	0	0	0	0	120.8	T1136	T1136-C1252 CarbonylContact O-C 3.45Å
1253	P	36	Very low	35.7	Very low	77 Å²	77	113.9 Å²	113.9	50%	0.5	72%	0.716	S	S	.	*			trans	-137.7	168.3	-135.5	38.7	-17.1	0	0	0	119.8	V1135 T1136 K1137	V1135-P1253 CarbonylContact C-O 3.52Å; V1135-P1253 VanDerWaalsContact O-O 3.05Å; T1136-P1253 CarbonylContact C-O 3.6Å; T1136-P1253 PolarHBondContact N-O 3.39Å; T1136-P1253 CarbonylContact O-C 3.59Å; T1136-P1253 WeakPolarHBondContact O-CA 3.16Å; K1137-P1253 VanDerWaalsContact O-CA 3.32Å; K1137-P1253 WeakPolarHBondContact O-CA 3.47Å
1254	P	50.4	Low	35.4	Very low	71 Å²	71	114.3 Å²	114.3	46%	0.461	72%	0.722	S	S	.	*			trans	-83.8	-177.4	172.2	38.3	-37.9	0	0	0	113.6	K1137	K1137-P1254 WeakPolarHBondContact O-CD 3.47Å
1255	P	38.2	Very low	34.9	Very low	109 Å²	109	114.9 Å²	114.9	71%	0.708	73%	0.73	S	S	*	*				-136.8	174	105.6	41.5	-32.3	0	0	0	113
1256	V	37.1	Very low	34.6	Very low	122 Å²	122	113 Å²	113	74%	0.739	73%	0.731	S	S	*	*			cis	79.2	171	8.6	-47.1	0	0	0	0	117.2
1257	P	39.3	Very low	34.3	Very low	110 Å²	110	113.3 Å²	113.3	71%	0.714	73%	0.733	S	S	*	*				-137.4	-159.1	-83.2	44.9	-27.4	0	0	0	114.9
1258	S	34.9	Very low	33.6	Very low	118 Å²	118	115.9 Å²	115.9	83%	0.825	74%	0.74	S	S	*	*			trans	-66.6	158.7	168.1	-40.3	0	0	0	0	114.4
1259	V	35.5	Very low	33.5	Very low	133 Å²	133	117.5 Å²	117.5	81%	0.806	74%	0.736	S	S	*	*			trans	-139.6	140.6	170.3	-175.8	0	0	0	0	110.9
1260	P	36.1	Very low	33.5	Very low	112 Å²	112	119.1 Å²	119.1	73%	0.727	75%	0.745	S	S	*	*			trans	-99.5	-174.8	-179.3	42.7	-37.8	0	0	0	112.6
1261	P	39.3	Very low	33.3	Very low	119 Å²	119	120.5 Å²	120.5	77%	0.773	74%	0.743	S	S	*	*			trans	-92.7	155	-173.4	36.2	-33.9	0	0	0	114.3
1262	V	29.7	Very low	33.4	Very low	147 Å²	147	122.7 Å²	122.7	89%	0.891	75%	0.752	S	S	*	*			trans	-167.7	156.1	143.4	130.8	0	0	0	0	112.2
1263	V	29.4	Very low	33.4	Very low	116 Å²	116	121.5 Å²	121.5	70%	0.703	75%	0.75	S	S	*	*			trans	-61.5	145.8	-174.8	-173.4	0	0	0	0	115.1
1264	S	30.1	Very low	33.5	Very low	121 Å²	121	123.6 Å²	123.6	85%	0.846	76%	0.763	S	S	*	*			trans	-160.5	147.2	144.5	-83.1	0	0	0	0	111.8
1265	N	27.8	Very low	32.6	Very low	160 Å²	160	129.5 Å²	129.5	86%	0.856	78%	0.781	S	S	*	*			trans	-82.8	149.7	-175.9	-70.3	-21.4	0	0	0	112.9
1266	G	31.5	Very low	32.2	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	79%	0.785	S	S	*	*			trans	-157.4	84	175	0	0	0	0	0	112
1267	T	28.7	Very low	31.8	Very low	116 Å²	116	132.4 Å²	132.4	71%	0.712	79%	0.786	S	S	*	*			trans	-71.2	133.8	-174.3	-48.6	0	0	0	0	112.8
1268	L	30.8	Very low	31.6	Very low	172 Å²	172	132.2 Å²	132.2	90%	0.901	79%	0.785	S	S	*	*			trans	-133.9	98.2	158.7	-73.8	177.9	0	0	0	109.7
1269	N	28.8	Very low	31.2	Very low	122 Å²	122	131.9 Å²	131.9	65%	0.652	78%	0.783	S	S	*	*			trans	-73.3	147.4	164.3	-82.5	22	0	0	0	109.7
1270	L	29.6	Very low	31.1	Very low	184 Å²	184	130 Å²	130	96%	0.963	78%	0.781	S	S	*	*			trans	-135.6	122.6	143.5	-148.9	74.8	0	0	0	108.9
1271	E	27.9	Very low	30.7	Very low	152 Å²	152	130.3 Å²	130.3	71%	0.71	78%	0.781	S	S	*	*			trans	-125.1	125.3	-166.5	178.3	-170.6	126.4	0	0	110.1
1272	V	30.7	Very low	30.2	Very low	140 Å²	140	130.9 Å²	130.9	85%	0.848	78%	0.778	S	S	*	*			trans	-145.8	101.5	159.5	-175.2	0	0	0	0	105.7
1273	A	30.4	Very low	30.3	Very low	74 Å²	74	131.3 Å²	131.3	61%	0.612	77%	0.77	S	S	*	*				93	147.3	55.1	0	0	0	0	0	113
1274	P	37.1	Very low	30.3	Very low	120 Å²	120	132.1 Å²	132.1	78%	0.779	77%	0.77	S	S	*	*			trans	-128.7	175.1	-135.5	42.7	-30.2	0	0	0	117
1275	K	32.5	Very low	30.3	Very low	195 Å²	195	131.5 Å²	131.5	85%	0.848	76%	0.761	S	S	*	*			trans	-142.8	134.9	159.2	-78.1	177.3	179.1	170.6	0	107.8
1276	Q	28.8	Very low	30.5	Very low	168 Å²	168	130.1 Å²	130.1	79%	0.785	75%	0.754	S	S	*	*				66.3	131.5	51.9	-61.4	-169.9	11.4	0	0	113.3
1277	T	28.5	Very low	30.4	Very low	124 Å²	124	131.6 Å²	131.6	76%	0.761	75%	0.747	S	S	*	*			cis	-157.9	-144.9	-8.9	24.7	0	0	0	0	107.9
1278	P	35.7	Very low	30.6	Very low	107 Å²	107	133.7 Å²	133.7	70%	0.695	75%	0.749	S	S	*	*				-127.6	-177.1	-92.6	43.1	-27.7	0	0	0	116.2
1279	S	27.3	Very low	30.7	Very low	111 Å²	111	132.7 Å²	132.7	78%	0.776	74%	0.74	S	S	*	*			trans	67	119	147.7	-57.8	0	0	0	0	122.6
1280	A	32.3	Very low	31	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	74%	0.742	S	S	*	*				166.7	124.3	118.2	0	0	0	0	0	109.4
1281	T	27.9	Very low	31.1	Very low	118 Å²	118	127.8 Å²	127.8	72%	0.724	73%	0.73	S	S	*	*				91.1	132.4	50.9	-58.6	0	0	0	0	113.1
1282	N	29.3	Very low	31.4	Very low	132 Å²	132	125.2 Å²	125.2	71%	0.706	73%	0.729	S	S	*	*			trans	77.8	151.2	178.3	-57.2	-42.1	0	0	0	116.7
1283	Q	31.7	Very low	31.4	Very low	156 Å²	156	124.8 Å²	124.8	73%	0.729	73%	0.727	S	S	*	*			cis	-161.9	133	-16.9	-108.7	172.1	46.5	0	0	106.8
1284	N	28.7	Very low	31.5	Very low	132 Å²	132	125.6 Å²	125.6	71%	0.706	73%	0.734	S	S	*	*				99.4	158.2	83.4	-169.9	31.1	0	0	0	112.9
1285	V	30.7	Very low	31.2	Very low	109 Å²	109	125 Å²	125	66%	0.661	73%	0.732	S	S	*	*			trans	69.3	134.3	171.4	-165.2	0	0	0	0	114.6
1286	D	32.5	Very low	31	Very low	131 Å²	131	122.5 Å²	122.5	70%	0.701	73%	0.734	S	S	*	*			cis	-144.2	148.5	-14.9	-111.8	-21.8	0	0	0	107.7
1287	T	29.6	Very low	31	Very low	107 Å²	107	118.3 Å²	118.3	66%	0.656	73%	0.728	S	S	*	*				61.3	112.4	76.8	-38.6	0	0	0	0	111
1288	Q	31.6	Very low	31	Very low	160 Å²	160	118.2 Å²	118.2	75%	0.748	73%	0.727	S	S	*	*				-168.4	154.7	69.2	-83.4	-173.7	8.1	0	0	114.8
1289	H	33.9	Very low	30.8	Very low	152 Å²	152	121 Å²	121	70%	0.704	74%	0.735	S	S	*	*			trans	47.3	144.7	139.3	-60	-44	0	0	0	123
1290	S	33.7	Very low	30.9	Very low	100 Å²	100	121 Å²	121	70%	0.699	73%	0.73	S	S	*	*			cis	-164.4	172.3	-4	-108.1	0	0	0	0	114.3
1291	S	33	Very low	30.7	Very low	102 Å²	102	121.9 Å²	121.9	71%	0.713	73%	0.731	S	S	*	*			trans	-52.3	171.4	169.3	55.6	0	0	0	0	115.4
1292	S	33.5	Very low	30.8	Very low	99 Å²	99	124.5 Å²	124.5	69%	0.692	74%	0.735	S	S	*	*			cis	-167	139.1	39.4	41.5	0	0	0	0	110.6
1293	T	31.6	Very low	30.8	Very low	131 Å²	131	123.9 Å²	123.9	80%	0.804	74%	0.736	S	S	*	*				76.1	143	55.9	65.9	0	0	0	0	117
1294	A	31.5	Very low	30.7	Very low	91 Å²	91	122.5 Å²	122.5	75%	0.752	74%	0.74	S	S	*	*			trans	90.2	118.2	-179.6	0	0	0	0	0	115.5
1295	S	31	Very low	30.7	Very low	106 Å²	106	120.4 Å²	120.4	74%	0.741	74%	0.741	S	S	*	*			cis	92.1	119.7	8.3	-39	0	0	0	0	118.3
1296	T	27.5	Very low	30.5	Very low	144 Å²	144	121.5 Å²	121.5	88%	0.883	75%	0.748	S	S	*	*			trans	66.7	156.2	161.4	23.4	0	0	0	0	117.6
1297	A	29.4	Very low	30.4	Very low	80 Å²	80	121.1 Å²	121.1	66%	0.661	75%	0.751	S	S	*	*			cis	-154.1	154.6	1.5	0	0	0	0	0	114.1
1298	T	28.6	Very low	30.3	Very low	122 Å²	122	123.4 Å²	123.4	75%	0.748	75%	0.754	S	S	*	*			trans	30.3	121.8	139.7	-45.7	0	0	0	0	123.1	V1300	T1298-V1300 HydrophobicContact CG2-CG2 4.03Å
1299	L	30.9	Very low	30.1	Very low	166 Å²	166	122.4 Å²	122.4	87%	0.869	76%	0.758	S	S	*	*			trans	-176.9	101.6	142.3	-98.2	162.3	0	0	0	106.3
1300	V	29.4	Very low	29.8	Very low	110 Å²	110	119.3 Å²	119.3	67%	0.667	75%	0.75	S	S	*	*				67.7	116.9	70.9	-175.3	0	0	0	0	114.4	T1298	T1298-V1300 HydrophobicContact CG2-CG2 4.03Å
1301	S	28.9	Very low	29.6	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	75%	0.753	S	S	*	*			trans	64.9	130.9	173.8	-61.2	0	0	0	0	116.2
1302	E	30.2	Very low	29.4	Very low	174 Å²	174	121.8 Å²	121.8	81%	0.813	75%	0.752	S	S	*	*			cis	-158.2	156.6	48.1	-80.7	-171.8	140.9	0	0	115
1303	T	29.3	Very low	29.1	Very low	119 Å²	119	122.3 Å²	122.3	73%	0.73	76%	0.756	S	S	*	*			trans	58.3	136.8	154.3	56.6	0	0	0	0	122.1	A1305	T1303-A1305 PolarHBondContact O-N 2.93Å
1304	P	28.1	Very low	29.1	Very low	127 Å²	127	121.5 Å²	121.5	83%	0.825	75%	0.751	S	S	*	*			trans	-83.7	110.5	167.5	33.2	-31	0	0	0	111.4
1305	A	30	Very low	29.1	Very low	88 Å²	88	122.1 Å²	122.1	73%	0.727	75%	0.747	S	S	*	*			trans	-94.5	95.7	177.1	0	0	0	0	0	111.8	T1303 V1307	T1303-A1305 PolarHBondContact O-N 2.93Å; A1305-V1307 PolarHBondContact O-N 3.4Å; A1305-V1307 VanDerWaalsContact O-N 3.17Å
1306	T	26.2	Very low	28.9	Very low	131 Å²	131	121 Å²	121	80%	0.804	74%	0.744	S	S	*	*			trans	-62.5	112.1	168.7	-58.9	0	0	0	0	110.3
1307	V	29.7	Very low	29.2	Very low	124 Å²	124	118.8 Å²	118.8	75%	0.752	73%	0.732	S	S	*	*			trans	-125.2	123.7	166.5	-180	0	0	0	0	108.6	A1305 V1309	A1305-V1307 PolarHBondContact O-N 3.4Å; A1305-V1307 VanDerWaalsContact O-N 3.17Å; V1307-V1309 PolarHBondContact O-N 3.2Å
1308	H	27.2	Very low	29.1	Very low	155 Å²	155	121.7 Å²	121.7	72%	0.718	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-64.1	118	178.3	-74.6	-106.4	0	0	0	111.2
1309	V	29.2	Very low	29	Very low	138 Å²	138	123.1 Å²	123.1	84%	0.836	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-103.6	118.6	132.2	179.5	0	0	0	0	105.6	V1307	V1307-V1309 PolarHBondContact O-N 3.2Å
1310	T	27.6	Very low	28.9	Very low	87 Å²	87	122.5 Å²	122.5	53%	0.534	73%	0.732	S	S	.	*	P	Polyproline II helix	trans	-63.9	129.8	-170.3	47.1	0	0	0	0	111.6	I1312	T1310-I1312 PolarHBondContact O-N 3.49Å; T1310-I1312 VanDerWaalsContact O-N 3.14Å
1311	P	27.7	Very low	28.7	Very low	117 Å²	117	122.7 Å²	122.7	76%	0.76	74%	0.736	S	S	*	*			trans	-58.6	114.8	137.2	28.7	-30.2	0	0	0	105.6	S1313	P1311-S1313 VanDerWaalsContact C-N 3.26Å; P1311-S1313 PolarHBondContact O-N 2.97Å
1312	I	30.2	Very low	28.6	Very low	138 Å²	138	123.6 Å²	123.6	71%	0.708	73%	0.731	S	S	*	*			trans	-68.8	98.8	171.6	-65.3	-177.3	0	0	0	105.7	T1310 V1314	T1310-I1312 PolarHBondContact O-N 3.49Å; T1310-I1312 VanDerWaalsContact O-N 3.14Å; I1312-V1314 HydrophobicContact CG2-CG2 4.04Å; I1312-V1314 PolarHBondContact O-N 2.93Å
1313	S	27.3	Very low	28.4	Very low	109 Å²	109	120.4 Å²	120.4	76%	0.762	72%	0.723	S	S	*	*			trans	-68.3	70.9	174.1	-179	0	0	0	0	109.2	P1311	P1311-S1313 VanDerWaalsContact C-N 3.26Å; P1311-S1313 PolarHBondContact O-N 2.97Å
1314	V	30.6	Very low	28.3	Very low	115 Å²	115	121.4 Å²	121.4	70%	0.697	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-54.4	121.6	161.5	-176.6	0	0	0	0	105.3	I1312 A1316	I1312-V1314 HydrophobicContact CG2-CG2 4.04Å; I1312-V1314 PolarHBondContact O-N 2.93Å; V1314-A1316 PolarHBondContact O-N 2.91Å
1315	P	32.5	Very low	28.2	Very low	104 Å²	104	119.9 Å²	119.9	68%	0.675	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-61.2	129.8	-172.1	24.4	-33.9	0	0	0	108.9	P1317	P1315-P1317 WeakPolarHBondContact O-CD 3.42Å; P1315-P1317 VanDerWaalsContact O-N 3.16Å
1316	A	27.2	Very low	28.1	Very low	83 Å²	83	121.2 Å²	121.2	69%	0.686	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-58.2	120.2	165.9	0	0	0	0	0	107.8	V1314 V1318	V1314-A1316 PolarHBondContact O-N 2.91Å; A1316-V1318 PolarHBondContact O-N 2.93Å
1317	P	33.1	Very low	28.3	Very low	96 Å²	96	121.8 Å²	121.8	62%	0.623	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-60.3	120.1	149.2	28.6	-29.7	0	0	0	105.4	P1315 Q1319	P1315-P1317 WeakPolarHBondContact O-CD 3.42Å; P1315-P1317 VanDerWaalsContact O-N 3.16Å; P1317-Q1319 PolarHBondContact O-N 2.84Å
1318	V	27.3	Very low	28.4	Very low	141 Å²	141	118.9 Å²	118.9	86%	0.855	68%	0.677	S	S	*	*			trans	-70.1	76.8	156	-179.2	0	0	0	0	105.6	A1316	A1316-V1318 PolarHBondContact O-N 2.93Å
1319	Q	27.2	Very low	28.6	Very low	152 Å²	152	115.3 Å²	115.3	71%	0.71	66%	0.663	S	S	*	*			trans	-92.1	124.8	159	-107.8	172.1	-23.7	0	0	106.2	P1317	P1317-Q1319 PolarHBondContact O-N 2.84Å
1320	E	26.9	Very low	28.7	Very low	153 Å²	153	112.2 Å²	112.2	72%	0.715	65%	0.645	S	S	*	*			trans	-54	158.3	-178.8	-63.8	157.5	127.1	0	0	110.1	L1322	E1320-L1322 VanDerWaalsContact C-N 3.3Å; E1320-L1322 PolarHBondContact O-N 2.81Å
1321	P	25.7	Very low	29	Very low	115 Å²	115	114.6 Å²	114.6	75%	0.747	65%	0.653	S	S	*	*			trans	-55.9	105.3	158.1	27	-32.8	0	0	0	106.8	V1323	P1321-V1323 PolarHBondContact O-N 2.83Å
1322	L	26.6	Very low	29.5	Very low	129 Å²	129	112 Å²	112	68%	0.675	64%	0.635	S	S	*	*			trans	-72.4	71.2	171.5	-93.7	170.1	0	0	0	108.5	E1320 I1324	E1320-L1322 VanDerWaalsContact C-N 3.3Å; E1320-L1322 PolarHBondContact O-N 2.81Å; L1322-I1324 PolarHBondContact O-N 2.8Å
1323	V	26.1	Very low	29.6	Very low	108 Å²	108	110.1 Å²	110.1	66%	0.655	62%	0.624	S	S	*	*			trans	-48.4	90.9	137.2	-170.9	0	0	0	0	105.7	P1321 D1325	P1321-V1323 PolarHBondContact O-N 2.83Å; V1323-D1325 HydrophobicContact CG1-CB 4.08Å; V1323-D1325 PolarHBondContact O-N 3.35Å
1324	I	26.9	Very low	30	Very low	139 Å²	139	109.5 Å²	109.5	71%	0.713	61%	0.611	S	S	*	*			trans	-71.2	75.1	157.7	-56.6	-179.4	0	0	0	105.3	L1322	L1322-I1324 PolarHBondContact O-N 2.8Å
1325	D	26.9	Very low	30.4	Very low	95 Å²	95	107.5 Å²	107.5	51%	0.508	60%	0.597	S	S	.	*			trans	-61.5	158.3	156.5	-149.2	-37.8	0	0	0	107.8	V1323	V1323-D1325 HydrophobicContact CG1-CB 4.08Å; V1323-D1325 PolarHBondContact O-N 3.35Å
1326	H	28.7	Very low	30.7	Very low	116 Å²	116	104.4 Å²	104.4	54%	0.537	58%	0.577	S	S	.	*			trans	65.2	60.3	175.4	-53.6	23.3	0	0	0	115.3	D1329	H1326-D1329 IonicContact CD2-OD2 3.37Å; H1326-D1329 IonicContact CG-OD2 2.68Å; H1326-D1329 IonicContact NE2-OD2 2.7Å
1327	H	30.1	Very low	31.2	Very low	144 Å²	144	104.9 Å²	104.9	67%	0.667	57%	0.566	S	S	*	*	S	Bend		-115.7	1.2	120.7	-103	-61.4	0	0	0	114.1	D1329 V1330	H1327-D1329 PolarHBondContact O-N 2.91Å; H1327-V1330 WeakPolarHBondContact ND1-CG2 3.48Å; H1327-V1330 PolarHBondContact O-N 2.76Å; H1327-V1330 VanDerWaalsContact O-N 3.08Å
1328	S	31.7	Very low	31.5	Very low	63 Å²	63	107.1 Å²	107.1	44%	0.441	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	34.6	150.9	46	0	0	0	0	113.3	T1332	S1328-T1332 WeakPolarHBondContact O-CB 3.38Å; S1328-T1332 VanDerWaalsContact O-CG2 3.24Å; S1328-T1332 WeakPolarHBondContact O-CG2 3.42Å; S1328-T1332 PolarHBondContact O-OG1 3.23Å
1329	D	30.8	Very low	32.2	Very low	80 Å²	80	108.9 Å²	108.9	43%	0.428	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-138.7	16.2	166.4	-94.4	-13.2	0	0	0	111.7	H1326 H1327 T1332 Q1333	H1326-D1329 IonicContact CD2-OD2 3.37Å; H1326-D1329 IonicContact CG-OD2 2.68Å; H1326-D1329 IonicContact NE2-OD2 2.7Å; H1327-D1329 PolarHBondContact O-N 2.91Å; D1329-T1332 VanDerWaalsContact CA-OG1 3.29Å; D1329-T1332 WeakPolarHBondContact CA-OG1 3.22Å; D1329-T1332 PolarHBondContact N-OG1 3.25Å; D1329-T1332 PolarHBondContact OD1-OG1 2.85Å; D1329-Q1333 WeakPolarHBondContact O-CB 3.06Å
1330	V	31.1	Very low	32.8	Very low	73 Å²	73	109.2 Å²	109.2	44%	0.442	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117	-38.9	160.3	177.6	0	0	0	0	110.4	H1327 L1334	H1327-V1330 WeakPolarHBondContact ND1-CG2 3.48Å; H1327-V1330 PolarHBondContact O-N 2.76Å; H1327-V1330 VanDerWaalsContact O-N 3.08Å; V1330-L1334 HydrophobicContact CG1-CD1 4.38Å; V1330-L1334 WeakPolarHBondContact O-CB 3.35Å; V1330-L1334 VanDerWaalsContact O-CD1 3.24Å; V1330-L1334 WeakPolarHBondContact O-CD1 3.2Å; V1330-L1334 PolarHBondContact O-N 3.15Å
1331	L	34.9	Very low	32.9	Very low	137 Å²	137	107 Å²	107	72%	0.717	56%	0.558	S	S	*	*	H	α-helix	trans	-81.7	-31.2	175.9	-77	167.4	0	0	0	113.8	D1335	L1331-D1335 VanDerWaalsContact O-CB 3.32Å; L1331-D1335 WeakPolarHBondContact O-CB 3.42Å; L1331-D1335 PolarHBondContact O-N 2.91Å
1332	T	37.3	Very low	33.3	Very low	62 Å²	62	107.3 Å²	107.3	38%	0.38	56%	0.564	S	S	.	*	H	α-helix	trans	-76.4	-33.7	168.4	56.1	0	0	0	0	111.5	S1328 D1329 D1335 S1336	S1328-T1332 WeakPolarHBondContact O-CB 3.38Å; S1328-T1332 VanDerWaalsContact O-CG2 3.24Å; S1328-T1332 WeakPolarHBondContact O-CG2 3.42Å; S1328-T1332 PolarHBondContact O-OG1 3.23Å; D1329-T1332 VanDerWaalsContact CA-OG1 3.29Å; D1329-T1332 WeakPolarHBondContact CA-OG1 3.22Å; D1329-T1332 PolarHBondContact N-OG1 3.25Å; D1329-T1332 PolarHBondContact OD1-OG1 2.85Å; T1332-D1335 CarbonylContact O-C 3.2Å; T1332-D1335 PolarHBondContact O-N 3.14Å; T1332-S1336 VanDerWaalsContact O-CB 3.3Å; T1332-S1336 WeakPolarHBondContact O-CB 3.45Å; T1332-S1336 PolarHBondContact O-N 3.49Å; T1332-S1336 PolarHBondContact O-OG 2.91Å
1333	Q	32.8	Very low	33.4	Very low	99 Å²	99	104.3 Å²	104.3	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-65.1	-41.7	170.5	-164.8	88.9	12.9	0	0	109.7	D1329 S1336 E1337	D1329-Q1333 WeakPolarHBondContact O-CB 3.06Å; Q1333-S1336 WeakPolarHBondContact CA-OG 3.32Å; Q1333-S1336 PolarHBondContact O-N 3.06Å; Q1333-S1336 PolarHBondContact O-OG 2.94Å; Q1333-E1337 VanDerWaalsContact O-CB 3.26Å; Q1333-E1337 WeakPolarHBondContact O-CB 3.26Å; Q1333-E1337 VanDerWaalsContact O-CG 3.28Å; Q1333-E1337 WeakPolarHBondContact O-CG 3.42Å; Q1333-E1337 PolarHBondContact O-N 3.23Å
1334	L	36.4	Very low	33.5	Very low	95 Å²	95	106.4 Å²	106.4	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-61.5	-47.1	168.3	-103.7	72.9	0	0	0	112	V1330 S1336 E1337 L1338	V1330-L1334 HydrophobicContact CG1-CD1 4.38Å; V1330-L1334 WeakPolarHBondContact O-CB 3.35Å; V1330-L1334 VanDerWaalsContact O-CD1 3.24Å; V1330-L1334 WeakPolarHBondContact O-CD1 3.2Å; V1330-L1334 PolarHBondContact O-N 3.15Å; L1334-S1336 PolarHBondContact O-N 3.03Å; L1334-E1337 PolarHBondContact O-N 2.76Å; L1334-L1338 WeakPolarHBondContact O-CB 3.19Å; L1334-L1338 WeakPolarHBondContact O-CD1 3.37Å; L1334-L1338 WeakPolarHBondContact O-CG 3.41Å; L1334-L1338 PolarHBondContact O-N 3.45Å
1335	D	38.3	Very low	33.6	Very low	74 Å²	74	104.1 Å²	104.1	40%	0.396	57%	0.573	S	S	.	*	H	α-helix	trans	-73.3	-3.5	-179.6	-166.3	49.8	0	0	0	114.1	L1331 T1332 R1339	L1331-D1335 VanDerWaalsContact O-CB 3.32Å; L1331-D1335 WeakPolarHBondContact O-CB 3.42Å; L1331-D1335 PolarHBondContact O-N 2.91Å; T1332-D1335 CarbonylContact O-C 3.2Å; T1332-D1335 PolarHBondContact O-N 3.14Å; D1335-R1339 VanDerWaalsContact CG-CZ 3.46Å; D1335-R1339 VanDerWaalsContact CG-NH1 3.29Å; D1335-R1339 WeakPolarHBondContact O-CD 3.45Å; D1335-R1339 WeakPolarHBondContact O-CG 3.33Å; D1335-R1339 VanDerWaalsContact O-CZ 3.28Å; D1335-R1339 PolarHBondContact O-NH1 3.1Å; D1335-R1339 IonicContact OD1-CZ 3.29Å; D1335-R1339 IonicContact OD1-NH1 3.62Å; D1335-R1339 IonicContact OD1-NH2 3.11Å; D1335-R1339 PolarHBondContact OD1-NH2 2.9Å; D1335-R1339 IonicContact OD2-CZ 3.32Å; D1335-R1339 IonicContact OD2-NH1 3.14Å; D1335-R1339 PolarHBondContact OD2-NH1 3.41Å; D1335-R1339 IonicContact OD2-NH2 2.65Å; D1335-R1339 PolarHBondContact OD2-NH2 2.92Å
1336	S	38.6	Very low	34	Very low	39 Å²	39	107.8 Å²	107.8	27%	0.273	59%	0.586	S	S	.	*	H	α-helix	trans	-112.4	-28.5	171.8	59.5	0	0	0	0	113.4	T1332 Q1333 L1334 R1339 K1340	T1332-S1336 VanDerWaalsContact O-CB 3.3Å; T1332-S1336 WeakPolarHBondContact O-CB 3.45Å; T1332-S1336 PolarHBondContact O-N 3.49Å; T1332-S1336 PolarHBondContact O-OG 2.91Å; Q1333-S1336 WeakPolarHBondContact CA-OG 3.32Å; Q1333-S1336 PolarHBondContact O-N 3.06Å; Q1333-S1336 PolarHBondContact O-OG 2.94Å; L1334-S1336 PolarHBondContact O-N 3.03Å; S1336-R1339 CarbonylContact O-C 3.14Å; S1336-R1339 PolarHBondContact O-N 3.42Å; S1336-K1340 WeakPolarHBondContact O-CB 3.47Å; S1336-K1340 VanDerWaalsContact O-CG 3.31Å; S1336-K1340 WeakPolarHBondContact O-CG 3.25Å; S1336-K1340 PolarHBondContact O-N 2.7Å
1337	E	38.9	Very low	34	Very low	93 Å²	93	107.2 Å²	107.2	44%	0.435	60%	0.595	S	S	.	*	H	α-helix	trans	-67.9	-41.8	164.4	-74.5	-66.1	117.7	0	0	111	Q1333 L1334 R1339 K1340 V1341	Q1333-E1337 VanDerWaalsContact O-CB 3.26Å; Q1333-E1337 WeakPolarHBondContact O-CB 3.26Å; Q1333-E1337 VanDerWaalsContact O-CG 3.28Å; Q1333-E1337 WeakPolarHBondContact O-CG 3.42Å; Q1333-E1337 PolarHBondContact O-N 3.23Å; L1334-E1337 PolarHBondContact O-N 2.76Å; E1337-R1339 PolarHBondContact O-N 2.94Å; E1337-K1340 PolarHBondContact O-N 3.35Å; E1337-V1341 PolarHBondContact O-N 2.97Å
1338	L	38.9	Very low	33.9	Very low	142 Å²	142	104.3 Å²	104.3	74%	0.743	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-7.7	169.5	-74.8	167.2	0	0	0	113.5	L1334	L1334-L1338 WeakPolarHBondContact O-CB 3.19Å; L1334-L1338 WeakPolarHBondContact O-CD1 3.37Å; L1334-L1338 WeakPolarHBondContact O-CG 3.41Å; L1334-L1338 PolarHBondContact O-N 3.45Å
1339	R	42.7	Very low	34	Very low	178 Å²	178	106.7 Å²	106.7	67%	0.672	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	2.4	171.8	-64.8	-175	-173.5	116.7	9.4	114	D1335 S1336 E1337	D1335-R1339 VanDerWaalsContact CG-CZ 3.46Å; D1335-R1339 VanDerWaalsContact CG-NH1 3.29Å; D1335-R1339 WeakPolarHBondContact O-CD 3.45Å; D1335-R1339 WeakPolarHBondContact O-CG 3.33Å; D1335-R1339 VanDerWaalsContact O-CZ 3.28Å; D1335-R1339 PolarHBondContact O-NH1 3.1Å; D1335-R1339 IonicContact OD1-CZ 3.29Å; D1335-R1339 IonicContact OD1-NH1 3.62Å; D1335-R1339 IonicContact OD1-NH2 3.11Å; D1335-R1339 PolarHBondContact OD1-NH2 2.9Å; D1335-R1339 IonicContact OD2-CZ 3.32Å; D1335-R1339 IonicContact OD2-NH1 3.14Å; D1335-R1339 PolarHBondContact OD2-NH1 3.41Å; D1335-R1339 IonicContact OD2-NH2 2.65Å; D1335-R1339 PolarHBondContact OD2-NH2 2.92Å; S1336-R1339 CarbonylContact O-C 3.14Å; S1336-R1339 PolarHBondContact O-N 3.42Å; E1337-R1339 PolarHBondContact O-N 2.94Å
1340	K	38.1	Very low	34.4	Very low	159 Å²	159	108 Å²	108	69%	0.691	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.1	-15.9	-175.5	-80.2	177.2	177.9	173.9	0	115.6	S1336 E1337	S1336-K1340 WeakPolarHBondContact O-CB 3.47Å; S1336-K1340 VanDerWaalsContact O-CG 3.31Å; S1336-K1340 WeakPolarHBondContact O-CG 3.25Å; S1336-K1340 PolarHBondContact O-N 2.7Å; E1337-K1340 PolarHBondContact O-N 3.35Å
1341	V	29.5	Very low	34.3	Very low	106 Å²	106	109.4 Å²	109.4	64%	0.642	64%	0.639	S	S	*	*	S	Bend	trans	-115.1	99.9	-175	-161.1	0	0	0	0	113.2	E1337	E1337-V1341 PolarHBondContact O-N 2.97Å
1342	S	33.8	Very low	34.1	Very low	123 Å²	123	108.8 Å²	108.8	86%	0.86	64%	0.641	S	S	*	*			trans	67.8	118.1	167.7	-157.9	0	0	0	0	117.6
1343	G	28.9	Very low	33.6	Very low	66 Å²	66	111.5 Å²	111.5	68%	0.68	66%	0.658	S	S	*	*			cis	129.4	92.7	-10	0	0	0	0	0	114.4
1344	V	28.3	Very low	33.4	Very low	151 Å²	151	112.6 Å²	112.6	92%	0.915	67%	0.671	S	S	*	*			trans	-131.4	137.6	157.1	178.3	0	0	0	0	107.1
1345	S	29.8	Very low	33.1	Very low	92 Å²	92	115.7 Å²	115.7	64%	0.643	68%	0.683	S	S	*	*			trans	-114.6	-172.7	-156.4	-59.7	0	0	0	0	114
1346	H	34.7	Very low	32.7	Very low	171 Å²	171	116.5 Å²	116.5	79%	0.792	69%	0.694	S	S	*	*			trans	93.7	113.7	168.3	-49.7	-66.9	0	0	0	115.1
1347	S	29.4	Very low	32.3	Very low	104 Å²	104	121.7 Å²	121.7	73%	0.727	72%	0.718	S	S	*	*			cis	83	132	40	80.3	0	0	0	0	114
1348	A	28.4	Very low	31.9	Very low	83 Å²	83	122.9 Å²	122.9	69%	0.686	73%	0.732	S	S	*	*			cis	-170.9	154.2	-8.3	0	0	0	0	0	112.6
1349	S	32.9	Very low	31.6	Very low	113 Å²	113	120.7 Å²	120.7	79%	0.79	73%	0.728	S	S	*	*			trans	67	-178.8	146.3	-57.9	0	0	0	0	118.6
1350	P	38.5	Very low	31.2	Very low	107 Å²	107	118.5 Å²	118.5	70%	0.695	73%	0.727	S	S	*	*				-140.6	-172.5	-70.9	43.8	-28.5	0	0	0	115.3
1351	S	30.4	Very low	30.9	Very low	103 Å²	103	116.7 Å²	116.7	72%	0.72	73%	0.73	S	S	*	*			trans	75.3	153.9	148.3	-63.9	0	0	0	0	118.5
1352	T	29.5	Very low	31.3	Very low	124 Å²	124	116.5 Å²	116.5	76%	0.761	73%	0.731	S	S	*	*			cis	-165.4	-177.3	-6.5	18.5	0	0	0	0	110.5
1353	V	27.6	Very low	31.2	Very low	120 Å²	120	118.4 Å²	118.4	73%	0.727	73%	0.726	S	S	*	*			trans	92	104.7	161.1	-171	0	0	0	0	114.1
1354	V	28.8	Very low	31.4	Very low	122 Å²	122	121 Å²	121	74%	0.739	73%	0.729	S	S	*	*				47.1	151.6	88.4	-102.7	0	0	0	0	115
1355	E	28.8	Very low	31.6	Very low	160 Å²	160	120 Å²	120	75%	0.748	72%	0.717	S	S	*	*			cis	-157.7	152.4	20.4	-135.7	156.9	-139.4	0	0	107
1356	S	29.7	Very low	32	Very low	91 Å²	91	120.5 Å²	120.5	64%	0.636	72%	0.718	S	S	*	*				169.3	138	69	-103.6	0	0	0	0	106.9
1357	L	30.1	Very low	31.8	Very low	148 Å²	148	120 Å²	120	78%	0.775	72%	0.72	S	S	*	*				64.3	128	80.9	-64.7	167.2	0	0	0	114.2
1358	T	31.9	Very low	31.9	Very low	118 Å²	118	119.2 Å²	119.2	72%	0.724	72%	0.72	S	S	*	*			cis	-125.6	-135.5	4.8	44.9	0	0	0	0	110.5
1359	S	31	Very low	31.9	Very low	96 Å²	96	120.6 Å²	120.6	67%	0.671	72%	0.723	S	S	*	*			cis	-169.8	160.5	-2.5	141.9	0	0	0	0	108.8
1360	M	34.3	Very low	31.6	Very low	132 Å²	132	123.7 Å²	123.7	65%	0.65	73%	0.725	S	S	*	*			cis	-167.5	116.3	-26.8	-94.1	-56.9	101.1	0	0	110.8
1361	T	32.8	Very low	31.1	Very low	120 Å²	120	124.4 Å²	124.4	74%	0.736	73%	0.728	S	S	*	*			trans	61.9	174.7	133.9	63.4	0	0	0	0	122.3
1362	P	37.7	Very low	31	Very low	103 Å²	103	125.8 Å²	125.8	67%	0.669	73%	0.732	S	S	*	*				-143	167	-58.8	42.4	-27.1	0	0	0	118.6
1363	Q	32	Very low	31.6	Very low	162 Å²	162	125.9 Å²	125.9	76%	0.757	73%	0.734	S	S	*	*			trans	40.5	145.9	136.9	-64.1	-179.9	10.1	0	0	125.2
1364	T	32.7	Very low	31.6	Very low	121 Å²	121	124.6 Å²	124.6	74%	0.742	74%	0.736	S	S	*	*				160.8	120.9	121.6	-68.9	0	0	0	0	109.4
1365	I	33.2	Very low	31.8	Very low	131 Å²	131	123.8 Å²	123.8	67%	0.672	74%	0.736	S	S	*	*				80.3	136.1	50.5	-71.3	173.3	0	0	0	112.8
1366	P	38.4	Very low	31.8	Very low	101 Å²	101	123.9 Å²	123.9	66%	0.656	74%	0.74	S	S	*	*			cis	-146.7	-165.4	-24.5	40.1	-18	0	0	0	116.5
1367	L	29.3	Very low	31.7	Very low	161 Å²	161	122.7 Å²	122.7	84%	0.843	74%	0.742	S	S	*	*			trans	89.3	146.2	140	-116.2	68.9	0	0	0	124.6
1368	A	32.1	Very low	31.5	Very low	88 Å²	88	125.2 Å²	125.2	73%	0.727	75%	0.75	S	S	*	*			trans	69.5	150.1	153.2	0	0	0	0	0	120.1
1369	C	27.3	Very low	31.6	Very low	111 Å²	111	124 Å²	124	75%	0.75	75%	0.751	S	S	*	*			cis	-163.9	152.8	-21.8	-110.4	0	0	0	0	111.9
1370	Q	27	Very low	31.7	Very low	178 Å²	178	125.5 Å²	125.5	83%	0.832	76%	0.759	S	S	*	*			trans	45.6	144.1	149.3	-63.2	-177.4	-4.3	0	0	124.5
1371	T	29.5	Very low	31.4	Very low	122 Å²	122	123.6 Å²	123.6	75%	0.748	76%	0.764	S	S	*	*			trans	112.7	91.8	147.3	-41.6	0	0	0	0	114.5
1372	V	27.5	Very low	31.1	Very low	132 Å²	132	124.1 Å²	124.1	80%	0.8	77%	0.767	S	S	*	*				76.4	123.9	74.5	178	0	0	0	0	114.5
1373	P	42.1	Very low	30.5	Very low	126 Å²	126	126.4 Å²	126.4	82%	0.818	77%	0.772	S	S	*	*			trans	-112.9	167.6	-177.2	42.1	-35.3	0	0	0	116.3
1374	A	27.9	Very low	30.2	Very low	93 Å²	93	123.2 Å²	123.2	77%	0.769	77%	0.774	S	S	*	*			trans	-165.7	150.9	156.6	0	0	0	0	0	109
1375	S	32.2	Very low	29.9	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	78%	0.775	S	S	*	*			cis	99.8	136.6	10.1	-157.8	0	0	0	0	116.8
1376	I	28.2	Very low	29.7	Very low	163 Å²	163	119.7 Å²	119.7	84%	0.836	78%	0.776	S	S	*	*			trans	71.5	141.5	173.4	-55.9	150.5	0	0	0	115.3
1377	G	28.6	Very low	29.2	Very low	65 Å²	65	123.5 Å²	123.5	67%	0.67	79%	0.785	S	S	*	*			cis	155.8	-175.4	-9.8	0	0	0	0	0	114.5
1378	Q	26.8	Very low	29.1	Very low	202 Å²	202	120.5 Å²	120.5	94%	0.944	78%	0.783	S	S	*	*			trans	72.8	156.4	170.9	-63.8	-172.1	-11.9	0	0	119.6
1379	A	34	Very low	29	Very low	91 Å²	91	120.7 Å²	120.7	75%	0.752	79%	0.785	S	S	*	*			trans	-109.4	179.1	-176	0	0	0	0	0	111.6
1380	P	32.3	Very low	29.1	Very low	129 Å²	129	120.7 Å²	120.7	84%	0.838	79%	0.786	S	S	*	*				-133.7	155.5	121.7	38	-30.5	0	0	0	113.4
1381	A	28.2	Very low	29.4	Very low	92 Å²	92	120.3 Å²	120.3	76%	0.76	79%	0.788	S	S	*	*			trans	-88	156.4	158.9	0	0	0	0	0	109.9
1382	V	26.6	Very low	29.5	Very low	130 Å²	130	121.2 Å²	121.2	79%	0.788	79%	0.787	S	S	*	*			trans	-174.4	113.6	140.6	138.7	0	0	0	0	111.2
1383	I	25.4	Very low	30.1	Very low	152 Å²	152	120.5 Å²	120.5	78%	0.779	79%	0.785	S	S	*	*			trans	47.9	132.5	135.3	-51.8	171.8	0	0	0	120.6
1384	A	26	Very low	29.5	Very low	95 Å²	95	120.7 Å²	120.7	79%	0.785	78%	0.78	S	S	*	*			trans	72.5	151	157.1	0	0	0	0	0	118.5
1385	A	25.8	Very low	29.7	Very low	93 Å²	93	121.3 Å²	121.3	77%	0.769	79%	0.785	S	S	*	*			cis	-169.1	-176.5	-21.4	0	0	0	0	0	109.2
1386	A	27.7	Very low	29.7	Very low	84 Å²	84	121.4 Å²	121.4	69%	0.694	79%	0.785	S	S	*	*			trans	77.3	123.7	151.8	0	0	0	0	0	119.9
1387	H	28.8	Very low	29.9	Very low	182 Å²	182	120.5 Å²	120.5	84%	0.843	79%	0.787	S	S	*	*			trans	45.7	112.8	139.6	-63.5	-89.6	0	0	0	119.6
1388	A	27.2	Very low	30.3	Very low	97 Å²	97	122 Å²	122	80%	0.802	79%	0.785	S	S	*	*				75.5	84.2	61.3	0	0	0	0	0	115.6
1389	A	30.6	Very low	30.5	Very low	93 Å²	93	121.5 Å²	121.5	77%	0.769	78%	0.783	S	S	*	*			trans	-153.4	119.4	148.6	0	0	0	0	0	106.2
1390	S	28.6	Very low	30.4	Very low	110 Å²	110	122.8 Å²	122.8	77%	0.769	79%	0.786	S	S	*	*				64.9	100.7	70.9	179.3	0	0	0	0	113.6
1391	L	32.7	Very low	30.7	Very low	170 Å²	170	122.4 Å²	122.4	89%	0.89	78%	0.784	S	S	*	*			trans	-166.7	101.7	130.9	-103.8	160.9	0	0	0	112.7
1392	I	31.8	Very low	30.9	Very low	141 Å²	141	123.9 Å²	123.9	72%	0.723	79%	0.789	S	S	*	*			trans	-72.6	139.6	159.2	-70	165.4	0	0	0	106.5	N1394	I1392-N1394 HydrophobicContact CG2-CB 3.9Å
1393	P	39.9	Very low	31	Very low	117 Å²	117	127.6 Å²	127.6	76%	0.76	79%	0.789	S	S	*	*				-135.7	155.4	61.6	22.8	1.6	0	0	0	115.9
1394	N	29.1	Very low	31.3	Very low	131 Å²	131	128.4 Å²	128.4	70%	0.701	79%	0.793	S	S	*	*			cis	82	103.8	34.3	-171	24.8	0	0	0	114.7	I1392	I1392-N1394 HydrophobicContact CG2-CB 3.9Å
1395	A	32.5	Very low	31.5	Very low	106 Å²	106	129.3 Å²	129.3	88%	0.876	79%	0.785	S	S	*	*			trans	-155.1	52.8	172.5	0	0	0	0	0	112.3
1396	S	32.5	Very low	31.9	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	79%	0.789	S	S	*	*			trans	-75.9	148.4	169.7	-52.5	0	0	0	0	111.9
1397	V	33.5	Very low	32.2	Very low	144 Å²	144	134.8 Å²	134.8	87%	0.873	80%	0.798	S	S	*	*			trans	-163.9	146.6	143	131.6	0	0	0	0	109.4
1398	P	35.7	Very low	32.4	Very low	98 Å²	98	133.4 Å²	133.4	64%	0.636	80%	0.802	S	S	*	*			trans	-132	167.2	-142.7	41.7	-25.8	0	0	0	117.8
1399	Q	32.2	Very low	32.7	Very low	190 Å²	190	131.9 Å²	131.9	89%	0.888	80%	0.797	S	S	*	*			trans	38.5	129.7	139	-64	173.4	-1.6	0	0	121.4
1400	S	31.2	Very low	33.2	Very low	118 Å²	118	135.6 Å²	135.6	83%	0.825	80%	0.802	S	S	*	*				-159.2	164.1	116.5	83.6	0	0	0	0	108.8
1401	P	38.5	Very low	33.5	Very low	122 Å²	122	134.8 Å²	134.8	79%	0.792	80%	0.802	S	S	*	*				-134.8	155.3	-119.6	39.4	-22.2	0	0	0	118.1
1402	S	32.4	Very low	33.9	Very low	123 Å²	123	128.6 Å²	128.6	86%	0.86	78%	0.78	S	S	*	*			trans	-158.1	107.6	153.2	58.1	0	0	0	0	110.5
1403	R	29.5	Very low	34.4	Very low	208 Å²	208	125.9 Å²	125.9	79%	0.785	77%	0.767	S	S	*	*			trans	-140.8	130.9	177.2	-173.5	178.8	-175.5	-173.6	-0.5	109.3	D1405	R1403-D1405 IonicContact CZ-OD2 2.68Å; R1403-D1405 IonicContact NE-OD2 3.12Å; R1403-D1405 PolarHBondContact NE-OD2 3.39Å; R1403-D1405 IonicContact NH2-OD2 3.6Å; R1403-D1405 PolarHBondContact NH2-OD2 2.87Å
1404	L	31.2	Very low	34.6	Very low	168 Å²	168	123.5 Å²	123.5	88%	0.88	75%	0.745	S	S	*	*			trans	-131.1	75.6	172.9	-80.4	173.7	0	0	0	109.1
1405	D	30.6	Very low	35.6	Very low	115 Å²	115	122.4 Å²	122.4	62%	0.615	74%	0.736	S	S	*	*			trans	-107.1	136.1	160.5	-62.2	-41.2	0	0	0	107.1	R1403	R1403-D1405 IonicContact CZ-OD2 2.68Å; R1403-D1405 IonicContact NE-OD2 3.12Å; R1403-D1405 PolarHBondContact NE-OD2 3.39Å; R1403-D1405 IonicContact NH2-OD2 3.6Å; R1403-D1405 PolarHBondContact NH2-OD2 2.87Å
1406	A	33.8	Very low	36.3	Very low	103 Å²	103	122.9 Å²	122.9	85%	0.851	72%	0.718	S	S	*	*			trans	-143.7	52.6	-169.4	0	0	0	0	0	113.8
1407	E	33.1	Very low	37.2	Very low	189 Å²	189	118.2 Å²	118.2	88%	0.883	69%	0.685	S	S	*	*			trans	-103.9	106.7	161.9	-71.3	-158.2	130.4	0	0	110.9
1408	T	34.5	Very low	38.1	Very low	152 Å²	152	113.6 Å²	113.6	93%	0.933	65%	0.654	S	S	*	*			trans	169.3	151.1	149	25.5	0	0	0	0	109.8
1409	G	33.1	Very low	39.4	Very low	66 Å²	66	111.6 Å²	111.6	68%	0.68	65%	0.645	S	S	*	*			trans	107	47.2	160.6	0	0	0	0	0	118.4	A1411	G1409-A1411 PolarHBondContact O-N 2.89Å
1410	L	40.3	Very low	40.1	Very low	170 Å²	170	105.9 Å²	105.9	89%	0.89	62%	0.621	S	S	*	*			trans	-75.6	31.7	169.2	-107.3	171.5	0	0	0	114.2
1411	A	35.7	Very low	41.8	Very low	93 Å²	93	105.3 Å²	105.3	77%	0.769	60%	0.603	S	S	*	*	S	Bend	trans	-137.7	127.2	177.4	0	0	0	0	0	110	G1409	G1409-A1411 PolarHBondContact O-N 2.89Å
1412	G	40.5	Very low	42.6	Very low	41 Å²	41	104.3 Å²	104.3	42%	0.423	59%	0.589	S	S	.	*	S	Bend	trans	122.2	-22.9	-172.2	0	0	0	0	0	113.4	H1414 E1415	G1412-H1414 PolarHBondContact O-N 3.24Å; G1412-E1415 PolarHBondContact O-N 3.47Å
1413	L	41.8	Very low	43.9	Very low	84 Å²	84	101 Å²	101	44%	0.44	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67	26	167.6	-115.6	171.4	0	0	0	113.3	L1417 N1597	L1413-L1417 VanDerWaalsContact C-CD2 3.43Å; L1413-L1417 HydrophobicContact CD2-CD1 4.21Å; L1413-L1417 HydrophobicContact CD2-CD2 3.99Å; L1413-L1417 WeakPolarHBondContact O-CD2 3.23Å; L1413-N1597 HydrophobicContact CD2-CB 3.89Å; L1413-N1597 HydrophobicContact CG-CB 4.31Å
1414	H	45	Very low	45	Very low	67 Å²	67	96 Å²	96	31%	0.31	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.7	17.9	174.9	-150.3	-34.5	0	0	0	112.5	G1412 K1600 Q1601	G1412-H1414 PolarHBondContact O-N 3.24Å; H1414-K1600 CarbonylContact C-O 3.48Å; H1414-K1600 PolarHBondContact NE2-NZ 3.13Å; H1414-Q1601 VanDerWaalsContact ND1-CB 3.34Å; H1414-Q1601 WeakPolarHBondContact ND1-CB 3.31Å; H1414-Q1601 VanDerWaalsContact O-CA 3.29Å; H1414-Q1601 WeakPolarHBondContact O-CA 3.5Å; H1414-Q1601 VanDerWaalsContact O-CB 3.26Å; H1414-Q1601 WeakPolarHBondContact O-CB 3.46Å
1415	E	50.4	Low	45.8	Very low	107 Å²	107	92 Å²	92	50%	0.5	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.9	-49.4	-179.1	175.2	166.9	-120.7	0	0	114	G1412 L1417 R1602	G1412-E1415 PolarHBondContact O-N 3.47Å; E1415-L1417 PolarHBondContact O-N 3.04Å; E1415-R1602 IonicContact OE1-CZ 3.11Å; E1415-R1602 IonicContact OE1-NH1 2.69Å; E1415-R1602 PolarHBondContact OE1-NH1 3.26Å; E1415-R1602 IonicContact OE1-NH2 3.92Å; E1415-R1602 PolarHBondContact OE1-NH2 2.82Å; E1415-R1602 VanDerWaalsContact OE1-NH2 3.12Å
1416	K	47.1	Very low	46.7	Very low	116 Å²	116	94.5 Å²	94.5	50%	0.504	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-17.7	168.7	-78.4	177	101.7	-68.4	0	113.6	Q1598	K1416-Q1598 HydrophobicContact CB-CG 4.4Å; K1416-Q1598 WeakPolarHBondContact O-CG 3.36Å; K1416-Q1598 PolarHBondContact O-NE2 2.88Å
1417	L	51.8	Low	47.4	Very low	8 Å²	8	98.5 Å²	98.5	4%	0.042	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-64.6	-150.6	-94.9	71.7	0	0	0	109.3	L1413 E1415 A1419 L1420 I1599 K1600	L1413-L1417 VanDerWaalsContact C-CD2 3.43Å; L1413-L1417 HydrophobicContact CD2-CD1 4.21Å; L1413-L1417 HydrophobicContact CD2-CD2 3.99Å; L1413-L1417 WeakPolarHBondContact O-CD2 3.23Å; E1415-L1417 PolarHBondContact O-N 3.04Å; L1417-A1419 PolarHBondContact O-N 2.84Å; L1417-A1419 VanDerWaalsContact O-N 3.12Å; L1417-L1420 PolarHBondContact O-N 3.48Å; L1417-I1599 VanDerWaalsContact C-CA 3.44Å; L1417-I1599 VanDerWaalsContact CB-C 3.41Å; L1417-I1599 VanDerWaalsContact CG-N 3.25Å; L1417-I1599 VanDerWaalsContact O-CA 3.32Å; L1417-I1599 WeakPolarHBondContact O-CA 3.45Å; L1417-K1600 VanDerWaalsContact C-N 3.29Å; L1417-K1600 CarbonylContact C-O 3.53Å; L1417-K1600 WeakPolarHBondContact CA-O 3.48Å; L1417-K1600 HydrophobicContact CB-CB 4.08Å; L1417-K1600 WeakPolarHBondContact CB-O 3.33Å; L1417-K1600 HydrophobicContact CD2-CB 3.9Å
1418	E	51.2	Low	47.9	Very low	47 Å²	47	96.6 Å²	96.6	22%	0.22	51%	0.51	C	S	.	.	H	α-helix	trans	-67.8	-11	177.9	-107.8	160.6	64.6	0	0	112.9	L1420 K1421 M1422 K1600 Q1601 R1602 L1603	E1418-L1420 PolarHBondContact O-N 2.79Å; E1418-K1421 HydrophobicContact CG-CB 4.04Å; E1418-K1421 WeakPolarHBondContact O-CA 3.23Å; E1418-K1421 PolarHBondContact O-N 3.05Å; E1418-M1422 PolarHBondContact O-N 2.76Å; E1418-K1600 VanDerWaalsContact N-N 3.12Å; E1418-K1600 PolarHBondContact N-O 3.08Å; E1418-K1600 VanDerWaalsContact OE2-C 3.29Å; E1418-K1600 WeakPolarHBondContact OE2-CA 3.38Å; E1418-Q1601 VanDerWaalsContact CB-O 3.3Å; E1418-Q1601 WeakPolarHBondContact CB-O 3.44Å; E1418-Q1601 PolarHBondContact OE2-N 3.16Å; E1418-R1602 WeakPolarHBondContact OE1-CA 3.4Å; E1418-R1602 PolarHBondContact OE1-N 3.03Å; E1418-L1603 PolarHBondContact OE1-N 3.29Å
1419	A	62.7	Low	48.3	Very low	56 Å²	56	96.2 Å²	96.2	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-55.7	-34.4	163	0	0	0	0	0	112.6	L1417 E1423	L1417-A1419 PolarHBondContact O-N 2.84Å; L1417-A1419 VanDerWaalsContact O-N 3.12Å; A1419-E1423 PolarHBondContact O-N 2.87Å; A1419-E1423 VanDerWaalsContact O-N 3.08Å
1420	L	48.7	Very low	48.7	Very low	71 Å²	71	102 Å²	102	37%	0.372	51%	0.514	S	S	.	.	H	α-helix	trans	-79.8	-20.5	170.3	-91.5	-167.3	0	0	0	114.2	L1417 E1418 E1423 Q1424 Q1598 I1599	L1417-L1420 PolarHBondContact O-N 3.48Å; E1418-L1420 PolarHBondContact O-N 2.79Å; L1420-E1423 HydrophobicContact CD2-CB 4.28Å; L1420-E1423 HydrophobicContact CD2-CG 4.49Å; L1420-Q1424 WeakPolarHBondContact O-CB 3.28Å; L1420-Q1424 PolarHBondContact O-N 3.08Å; L1420-Q1424 VanDerWaalsContact O-N 3.08Å; L1420-Q1598 HydrophobicContact CB-CG 4.21Å; L1420-Q1598 HydrophobicContact CD1-CB 3.67Å; L1420-Q1598 HydrophobicContact CD1-CG 3.78Å; L1420-Q1598 HydrophobicContact CG-CB 4.29Å; L1420-Q1598 HydrophobicContact CG-CG 3.87Å; L1420-I1599 HydrophobicContact CB-CD1 4.38Å; L1420-I1599 HydrophobicContact CB-CG1 4.06Å
1421	K	65.7	Low	48.6	Very low	106 Å²	106	96.9 Å²	96.9	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-71.4	-44.2	169.2	-173.9	162.9	-176.7	174.5	0	110.2	E1418 E1423 Q1424 D1425 I1599	E1418-K1421 HydrophobicContact CG-CB 4.04Å; E1418-K1421 WeakPolarHBondContact O-CA 3.23Å; E1418-K1421 PolarHBondContact O-N 3.05Å; K1421-E1423 VanDerWaalsContact C-N 3.33Å; K1421-E1423 PolarHBondContact O-N 2.81Å; K1421-Q1424 PolarHBondContact O-N 3.4Å; K1421-Q1424 VanDerWaalsContact O-N 3.09Å; K1421-D1425 PolarHBondContact O-N 2.85Å; K1421-I1599 HydrophobicContact CB-CG1 4.27Å
1422	M	56.1	Low	48.6	Very low	100 Å²	100	99.1 Å²	99.1	49%	0.493	50%	0.502	S	S	.	.	H	α-helix	trans	-59.6	-40	172.5	-73.2	-173.6	169.9	0	0	112.6	E1418 Q1424 R1426 L1603	E1418-M1422 PolarHBondContact O-N 2.76Å; M1422-Q1424 VanDerWaalsContact C-N 3.3Å; M1422-Q1424 PolarHBondContact O-N 2.87Å; M1422-R1426 WeakPolarHBondContact O-CB 3.42Å; M1422-R1426 PolarHBondContact O-N 2.96Å; M1422-L1603 HydrophobicContact CE-CD2 3.77Å; M1422-L1603 HydrophobicContact CE-CG 4.04Å
1423	E	59.2	Low	48.4	Very low	55 Å²	55	104.4 Å²	104.4	26%	0.257	52%	0.52	S	S	.	.	H	α-helix	trans	-74.6	-15.2	176	-178.6	56.6	-159.8	0	0	113.8	A1419 L1420 K1421 R1426 R1427	A1419-E1423 PolarHBondContact O-N 2.87Å; A1419-E1423 VanDerWaalsContact O-N 3.08Å; L1420-E1423 HydrophobicContact CD2-CB 4.28Å; L1420-E1423 HydrophobicContact CD2-CG 4.49Å; K1421-E1423 VanDerWaalsContact C-N 3.33Å; K1421-E1423 PolarHBondContact O-N 2.81Å; E1423-R1426 VanDerWaalsContact CD-NH2 3.32Å; E1423-R1426 IonicContact OE1-CZ 3.89Å; E1423-R1426 IonicContact OE1-NH2 2.91Å; E1423-R1426 PolarHBondContact OE1-NH2 2.81Å; E1423-R1426 IonicContact OE2-CZ 3.28Å; E1423-R1426 VanDerWaalsContact OE2-CZ 3.28Å; E1423-R1426 IonicContact OE2-NE 2.76Å; E1423-R1426 PolarHBondContact OE2-NE 3.47Å; E1423-R1426 IonicContact OE2-NH2 2.94Å; E1423-R1426 PolarHBondContact OE2-NH2 3.36Å; E1423-R1427 WeakPolarHBondContact O-CD 3.21Å; E1423-R1427 WeakPolarHBondContact O-CG 3.37Å; E1423-R1427 IonicContact OE1-CZ 3.53Å; E1423-R1427 IonicContact OE1-NE 3.05Å; E1423-R1427 PolarHBondContact OE1-NE 3.01Å; E1423-R1427 IonicContact OE1-NH2 3.07Å; E1423-R1427 PolarHBondContact OE1-NH2 3.5Å; E1423-R1427 VanDerWaalsContact OE1-NH2 3.07Å
1424	Q	52.6	Low	48	Very low	103 Å²	103	104.3 Å²	104.3	48%	0.481	53%	0.531	S	S	.	.	H	α-helix	trans	-83.5	-48.3	168.4	-173.6	170.6	-9.4	0	0	111.1	L1420 K1421 M1422 R1426 R1427	L1420-Q1424 WeakPolarHBondContact O-CB 3.28Å; L1420-Q1424 PolarHBondContact O-N 3.08Å; L1420-Q1424 VanDerWaalsContact O-N 3.08Å; K1421-Q1424 PolarHBondContact O-N 3.4Å; K1421-Q1424 VanDerWaalsContact O-N 3.09Å; M1422-Q1424 VanDerWaalsContact C-N 3.3Å; M1422-Q1424 PolarHBondContact O-N 2.87Å; Q1424-R1426 PolarHBondContact O-N 2.56Å; Q1424-R1427 WeakPolarHBondContact O-CB 3.37Å; Q1424-R1427 PolarHBondContact O-N 2.86Å
1425	D	48.5	Very low	47.5	Very low	84 Å²	84	109 Å²	109	45%	0.449	56%	0.557	S	S	.	*	H	α-helix	trans	-57.6	-33.7	173.6	-62.4	-22.3	0	0	0	110.6	K1421 R1427 E1428	K1421-D1425 PolarHBondContact O-N 2.85Å; D1425-R1427 PolarHBondContact O-N 3.44Å; D1425-E1428 PolarHBondContact O-N 2.97Å
1426	R	48.1	Very low	46.8	Very low	167 Å²	167	106.3 Å²	106.3	63%	0.63	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	9.2	174.5	-154.3	-167.1	66.9	70.4	6.7	114.8	M1422 E1423 Q1424	M1422-R1426 WeakPolarHBondContact O-CB 3.42Å; M1422-R1426 PolarHBondContact O-N 2.96Å; E1423-R1426 VanDerWaalsContact CD-NH2 3.32Å; E1423-R1426 IonicContact OE1-CZ 3.89Å; E1423-R1426 IonicContact OE1-NH2 2.91Å; E1423-R1426 PolarHBondContact OE1-NH2 2.81Å; E1423-R1426 IonicContact OE2-CZ 3.28Å; E1423-R1426 VanDerWaalsContact OE2-CZ 3.28Å; E1423-R1426 IonicContact OE2-NE 2.76Å; E1423-R1426 PolarHBondContact OE2-NE 3.47Å; E1423-R1426 IonicContact OE2-NH2 2.94Å; E1423-R1426 PolarHBondContact OE2-NH2 3.36Å; Q1424-R1426 PolarHBondContact O-N 2.56Å
1427	R	48.7	Very low	46.1	Very low	187 Å²	187	107.7 Å²	107.7	71%	0.706	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.9	-3.1	175	-72.7	175	-178	-140	-3.5	113.9	E1423 Q1424 D1425	E1423-R1427 WeakPolarHBondContact O-CD 3.21Å; E1423-R1427 WeakPolarHBondContact O-CG 3.37Å; E1423-R1427 IonicContact OE1-CZ 3.53Å; E1423-R1427 IonicContact OE1-NE 3.05Å; E1423-R1427 PolarHBondContact OE1-NE 3.01Å; E1423-R1427 IonicContact OE1-NH2 3.07Å; E1423-R1427 PolarHBondContact OE1-NH2 3.5Å; E1423-R1427 VanDerWaalsContact OE1-NH2 3.07Å; Q1424-R1427 WeakPolarHBondContact O-CB 3.37Å; Q1424-R1427 PolarHBondContact O-N 2.86Å; D1425-R1427 PolarHBondContact O-N 3.44Å
1428	E	45.5	Very low	45.3	Very low	148 Å²	148	112.9 Å²	112.9	69%	0.692	61%	0.609	S	S	*	*	S	Bend	trans	-110.6	11.7	-176.7	-64.5	179.1	-165.4	0	0	112.6	D1425	D1425-E1428 PolarHBondContact O-N 2.97Å
1429	D	41.1	Very low	44.4	Very low	144 Å²	144	117 Å²	117	77%	0.77	64%	0.637	S	S	*	*	S	Bend	trans	-133.7	33	-169.1	-160.3	29.8	0	0	0	115.4
1430	M	42.2	Very low	43.2	Very low	187 Å²	187	119.8 Å²	119.8	92%	0.921	65%	0.649	S	S	*	*			trans	-154	137.8	157.6	-84.5	-153.5	-75.2	0	0	110.6
1431	G	37.4	Very low	42.5	Very low	63 Å²	63	124.2 Å²	124.2	65%	0.649	67%	0.673	S	S	*	*			trans	-154.1	-160	-178	0	0	0	0	0	113.7
1432	D	37	Very low	41	Very low	141 Å²	141	122.6 Å²	122.6	75%	0.754	69%	0.687	S	S	*	*			trans	68.2	149	173.2	-47.8	-27.9	0	0	0	115.9
1433	D	35.1	Very low	40.2	Very low	151 Å²	151	127 Å²	127	81%	0.807	70%	0.703	S	S	*	*			cis	-157.4	162.2	5.6	-150.8	-16.2	0	0	0	113.7
1434	A	34.7	Very low	39.3	Very low	82 Å²	82	131.7 Å²	131.7	68%	0.678	73%	0.73	S	S	*	*			trans	64.8	151	160	0	0	0	0	0	118.7
1435	I	34.6	Very low	39	Very low	165 Å²	165	136 Å²	136	85%	0.846	75%	0.75	S	S	*	*			cis	-144.5	152	7.2	-53.3	163.1	0	0	0	106.6
1436	G	34.1	Very low	39	Very low	52 Å²	52	135 Å²	135	54%	0.536	74%	0.744	S	S	.	*			cis	136.5	143.1	-0.3	0	0	0	0	0	113
1437	T	33	Very low	39.1	Very low	144 Å²	144	131.4 Å²	131.4	88%	0.883	74%	0.742	S	S	*	*			trans	72.4	142.7	-180	80.8	0	0	0	0	115.8
1438	T	34.3	Very low	39.3	Very low	118 Å²	118	127.9 Å²	127.9	72%	0.724	74%	0.736	S	S	*	*			cis	-143.7	139.8	11	52.6	0	0	0	0	113.2
1439	T	33.3	Very low	39.9	Very low	132 Å²	132	128.4 Å²	128.4	81%	0.81	74%	0.743	S	S	*	*			trans	35.9	141.1	145.8	51.7	0	0	0	0	122.3
1440	T	36.9	Very low	41.3	Very low	116 Å²	116	125.2 Å²	125.2	71%	0.712	73%	0.73	S	S	*	*			cis	-151.1	158.9	19.3	45.6	0	0	0	0	112.3
1441	D	35.6	Very low	42.2	Very low	164 Å²	164	123.9 Å²	123.9	88%	0.877	73%	0.725	S	S	*	*			trans	38	133.6	153	-54.5	-22.7	0	0	0	121.5
1442	G	33.4	Very low	43.8	Very low	72 Å²	72	127.6 Å²	127.6	74%	0.742	72%	0.724	S	S	*	*			cis	160.2	153.3	-3.1	0	0	0	0	0	112.6
1443	K	38.3	Very low	45.5	Very low	192 Å²	192	121 Å²	121	84%	0.835	69%	0.689	S	S	*	*			trans	83.6	76	179.7	-63.5	-176.8	175.9	174.1	0	119.3
1444	D	42.1	Very low	47	Very low	153 Å²	153	118.2 Å²	118.2	82%	0.818	67%	0.674	S	S	*	*				53	89.3	119.8	-38.5	-27.6	0	0	0	119.3
1445	E	44.8	Very low	48.7	Very low	194 Å²	194	117 Å²	117	91%	0.907	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-77.7	149.1	155.9	-64.5	-170.6	118.4	0	0	111.2
1446	I	50	Low	50.4	Low	63 Å²	63	112.8 Å²	112.8	32%	0.323	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-96.1	126.1	175.5	-66.8	-176.1	0	0	0	109.6	I1448	I1446-I1448 PolarHBondContact O-N 2.77Å
1447	P	49.6	Very low	52	Low	91 Å²	91	112.2 Å²	112.2	59%	0.591	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.4	171.9	-23.7	34.5	0	0	0	111.8	D1449	P1447-D1449 VanDerWaalsContact C-N 3.29Å; P1447-D1449 PolarHBondContact O-N 3.32Å
1448	I	52.8	Low	53.5	Low	114 Å²	114	109.9 Å²	109.9	59%	0.585	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-21.1	-172	-63.1	178.4	0	0	0	111.8	I1446 T1450	I1446-I1448 PolarHBondContact O-N 2.77Å; I1448-T1450 VanDerWaalsContact C-N 3.25Å; I1448-T1450 PolarHBondContact O-N 3.39Å
1449	D	58.5	Low	55	Low	158 Å²	158	105.8 Å²	105.8	85%	0.845	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-5	-170.7	-53	-70	0	0	0	115.2	P1447	P1447-D1449 VanDerWaalsContact C-N 3.29Å; P1447-D1449 PolarHBondContact O-N 3.32Å
1450	T	69.8	Low	56.6	Low	78 Å²	78	105.9 Å²	105.9	48%	0.479	58%	0.582	S	S	.	*	S	Bend	trans	-94.1	141.6	171.7	64.7	0	0	0	0	111.5	I1448 K1452 G1453 L1454	I1448-T1450 VanDerWaalsContact C-N 3.25Å; I1448-T1450 PolarHBondContact O-N 3.39Å; T1450-K1452 PolarHBondContact O-N 2.86Å; T1450-K1452 VanDerWaalsContact O-N 3.11Å; T1450-G1453 WeakPolarHBondContact O-CA 3.22Å; T1450-G1453 PolarHBondContact O-N 3.17Å; T1450-G1453 PolarHBondContact OG1-N 3.14Å; T1450-L1454 PolarHBondContact O-N 3.2Å
1451	L	61.3	Low	57.6	Low	158 Å²	158	105.9 Å²	105.9	83%	0.827	58%	0.582	S	S	*	*	H	α-helix	trans	-59.6	-26.1	176.3	-149.4	153.9	0	0	0	111.9	A1455	L1451-A1455 WeakPolarHBondContact O-CB 3.4Å; L1451-A1455 PolarHBondContact O-N 2.99Å; L1451-A1455 VanDerWaalsContact O-N 3.15Å
1452	K	70	Confident	58.3	Low	142 Å²	142	104 Å²	104	62%	0.617	57%	0.57	S	S	*	*	H	α-helix	trans	-71.2	-49.2	169.1	-176	175.3	-178.2	-71.7	0	112.3	T1450 L1454 A1455 E1456	T1450-K1452 PolarHBondContact O-N 2.86Å; T1450-K1452 VanDerWaalsContact O-N 3.11Å; K1452-L1454 VanDerWaalsContact C-N 3.32Å; K1452-L1454 PolarHBondContact O-N 3.01Å; K1452-A1455 PolarHBondContact O-N 3.36Å; K1452-A1455 VanDerWaalsContact O-N 3.16Å; K1452-E1456 WeakPolarHBondContact CE-OE1 3.43Å; K1452-E1456 WeakPolarHBondContact CG-OE1 3.25Å; K1452-E1456 IonicContact NZ-OE1 3.63Å; K1452-E1456 PolarHBondContact NZ-OE1 3.48Å; K1452-E1456 IonicContact NZ-OE2 3.51Å; K1452-E1456 PolarHBondContact O-N 3.31Å
1453	G	72.6	Confident	58.9	Low	3 Å²	3	107.8 Å²	107.8	3%	0.031	57%	0.568	C	S	.	*	H	α-helix	trans	-58.9	-41.3	176	0	0	0	0	0	112.6	T1450 E1456 A1457	T1450-G1453 WeakPolarHBondContact O-CA 3.22Å; T1450-G1453 PolarHBondContact O-N 3.17Å; T1450-G1453 PolarHBondContact OG1-N 3.14Å; G1453-E1456 PolarHBondContact O-N 3.47Å; G1453-A1457 VanDerWaalsContact O-CB 3.28Å; G1453-A1457 WeakPolarHBondContact O-CB 3.27Å; G1453-A1457 PolarHBondContact O-N 3.13Å
1454	L	68	Low	59	Low	92 Å²	92	102.4 Å²	102.4	48%	0.482	56%	0.56	S	S	.	*	H	α-helix	trans	-66.3	-38.7	174.5	-165.9	151.3	0	0	0	112.1	T1450 K1452 L1458	T1450-L1454 PolarHBondContact O-N 3.2Å; K1452-L1454 VanDerWaalsContact C-N 3.32Å; K1452-L1454 PolarHBondContact O-N 3.01Å; L1454-L1458 HydrophobicContact CD2-CD1 3.71Å; L1454-L1458 HydrophobicContact CD2-CG 4.28Å; L1454-L1458 WeakPolarHBondContact O-CB 3.48Å; L1454-L1458 WeakPolarHBondContact O-CG 3.49Å; L1454-L1458 PolarHBondContact O-N 3.44Å
1455	A	70.1	Confident	58.8	Low	56 Å²	56	103.4 Å²	103.4	46%	0.463	57%	0.565	S	S	.	*	H	α-helix	trans	-67	-38.5	173.6	0	0	0	0	0	112.8	L1451 K1452 G1459	L1451-A1455 WeakPolarHBondContact O-CB 3.4Å; L1451-A1455 PolarHBondContact O-N 2.99Å; L1451-A1455 VanDerWaalsContact O-N 3.15Å; K1452-A1455 PolarHBondContact O-N 3.36Å; K1452-A1455 VanDerWaalsContact O-N 3.16Å; A1455-G1459 PolarHBondContact O-N 3.41Å
1456	E	69.4	Low	58.3	Low	77 Å²	77	97.7 Å²	97.7	36%	0.36	56%	0.559	S	S	.	*	H	α-helix	trans	-71.7	-36.5	175.6	-75.3	175	-159.8	0	0	112.4	K1452 G1453 G1459 K1460	K1452-E1456 WeakPolarHBondContact CE-OE1 3.43Å; K1452-E1456 WeakPolarHBondContact CG-OE1 3.25Å; K1452-E1456 IonicContact NZ-OE1 3.63Å; K1452-E1456 PolarHBondContact NZ-OE1 3.48Å; K1452-E1456 IonicContact NZ-OE2 3.51Å; K1452-E1456 PolarHBondContact O-N 3.31Å; G1453-E1456 PolarHBondContact O-N 3.47Å; E1456-G1459 PolarHBondContact O-N 2.85Å; E1456-K1460 WeakPolarHBondContact O-CG 3.49Å; E1456-K1460 PolarHBondContact O-N 2.91Å
1457	A	67.6	Low	57.5	Low	40 Å²	40	105.5 Å²	105.5	33%	0.331	58%	0.584	S	S	.	*	H	α-helix	trans	-63	-47	171.7	0	0	0	0	0	111.3	G1453 G1459 K1460 V1461	G1453-A1457 VanDerWaalsContact O-CB 3.28Å; G1453-A1457 WeakPolarHBondContact O-CB 3.27Å; G1453-A1457 PolarHBondContact O-N 3.13Å; A1457-G1459 VanDerWaalsContact C-N 3.33Å; A1457-G1459 PolarHBondContact O-N 2.95Å; A1457-K1460 PolarHBondContact O-N 3.45Å; A1457-V1461 WeakPolarHBondContact O-CG2 3.28Å; A1457-V1461 PolarHBondContact O-N 3.26Å
1458	L	64.9	Low	56.8	Low	95 Å²	95	108.5 Å²	108.5	50%	0.497	59%	0.59	S	S	.	*	H	α-helix	trans	-60.8	-41	172.3	-74.4	174.9	0	0	0	111.8	L1454 K1460 V1461 I1462	L1454-L1458 HydrophobicContact CD2-CD1 3.71Å; L1454-L1458 HydrophobicContact CD2-CG 4.28Å; L1454-L1458 WeakPolarHBondContact O-CB 3.48Å; L1454-L1458 WeakPolarHBondContact O-CG 3.49Å; L1454-L1458 PolarHBondContact O-N 3.44Å; L1458-K1460 PolarHBondContact O-N 2.97Å; L1458-V1461 PolarHBondContact O-N 3.03Å; L1458-I1462 WeakPolarHBondContact O-CB 3.35Å; L1458-I1462 WeakPolarHBondContact O-CD1 3.4Å; L1458-I1462 WeakPolarHBondContact O-CG1 3.35Å; L1458-I1462 PolarHBondContact O-N 3.07Å
1459	G	67.2	Low	55.9	Low	31 Å²	31	109.8 Å²	109.8	32%	0.32	60%	0.604	S	S	.	*	H	α-helix	trans	-57.9	-46.7	174.3	0	0	0	0	0	112.7	A1455 E1456 A1457 I1462 H1463	A1455-G1459 PolarHBondContact O-N 3.41Å; E1456-G1459 PolarHBondContact O-N 2.85Å; A1457-G1459 VanDerWaalsContact C-N 3.33Å; A1457-G1459 PolarHBondContact O-N 2.95Å; G1459-I1462 PolarHBondContact O-N 2.95Å; G1459-H1463 PolarHBondContact O-N 3.45Å; G1459-H1463 VanDerWaalsContact O-N 3.11Å
1460	K	66	Low	54.7	Low	134 Å²	134	108.8 Å²	108.8	58%	0.583	60%	0.603	S	S	*	*	H	α-helix	trans	-63.8	-39.5	176.1	-73.2	176.9	-179.9	-175.9	0	112.4	E1456 A1457 L1458 I1462 A1464	E1456-K1460 WeakPolarHBondContact O-CG 3.49Å; E1456-K1460 PolarHBondContact O-N 2.91Å; A1457-K1460 PolarHBondContact O-N 3.45Å; L1458-K1460 PolarHBondContact O-N 2.97Å; K1460-I1462 VanDerWaalsContact C-N 3.34Å; K1460-A1464 PolarHBondContact O-N 3.27Å
1461	V	58.9	Low	53.1	Low	117 Å²	117	110.6 Å²	110.6	71%	0.709	62%	0.616	S	S	*	*	H	α-helix	trans	-69.8	-29.2	176.8	171.6	0	0	0	0	112.6	A1457 L1458	A1457-V1461 WeakPolarHBondContact O-CG2 3.28Å; A1457-V1461 PolarHBondContact O-N 3.26Å; L1458-V1461 PolarHBondContact O-N 3.03Å
1462	I	48.6	Very low	51.7	Low	123 Å²	123	110.4 Å²	110.4	63%	0.631	61%	0.613	S	S	*	*	H	α-helix	trans	-85.4	-20.3	-179.3	-68.4	167.8	0	0	0	112.7	L1458 G1459 K1460	L1458-I1462 WeakPolarHBondContact O-CB 3.35Å; L1458-I1462 WeakPolarHBondContact O-CD1 3.4Å; L1458-I1462 WeakPolarHBondContact O-CG1 3.35Å; L1458-I1462 PolarHBondContact O-N 3.07Å; G1459-I1462 PolarHBondContact O-N 2.95Å; K1460-I1462 VanDerWaalsContact C-N 3.34Å
1463	H	47.1	Very low	50.1	Low	152 Å²	152	109.4 Å²	109.4	70%	0.704	62%	0.621	S	S	*	*			trans	-118.8	23.2	-176.6	-74.9	-75.9	0	0	0	115.3	G1459 D1465	G1459-H1463 PolarHBondContact O-N 3.45Å; G1459-H1463 VanDerWaalsContact O-N 3.11Å; H1463-D1465 PolarHBondContact O-N 3Å
1464	A	40.9	Very low	48.3	Very low	80 Å²	80	113.3 Å²	113.3	66%	0.661	65%	0.646	S	S	*	*			trans	-76.3	59.2	178.5	0	0	0	0	0	114.3	K1460	K1460-A1464 PolarHBondContact O-N 3.27Å
1465	D	37.6	Very low	46.8	Very low	173 Å²	173	115.9 Å²	115.9	93%	0.925	66%	0.66	S	S	*	*	S	Bend	trans	-161.4	82.7	165	-104.2	-31.2	0	0	0	108.6	H1463	H1463-D1465 PolarHBondContact O-N 3Å
1466	G	33.2	Very low	45	Very low	75 Å²	75	122.2 Å²	122.2	77%	0.773	68%	0.68	S	S	*	*			trans	179	39.5	-169.1	0	0	0	0	0	118.7
1467	R	34.1	Very low	43.3	Very low	226 Å²	226	124 Å²	124	85%	0.853	70%	0.698	S	S	*	*			trans	-157.6	151.6	172.4	-91.7	-159.1	165.7	120	1.6	110.3
1468	E	34.4	Very low	41.7	Very low	154 Å²	154	129.5 Å²	129.5	72%	0.72	72%	0.722	S	S	*	*			cis	-156.7	156.9	-24.9	-144.4	165.3	148.8	0	0	106.4
1469	T	32.8	Very low	40.2	Very low	141 Å²	141	132.8 Å²	132.8	87%	0.865	74%	0.739	S	S	*	*			trans	-85.1	146	-168.7	44.2	0	0	0	0	114.3
1470	T	35.3	Very low	38.5	Very low	137 Å²	137	138.2 Å²	138.2	84%	0.84	77%	0.766	S	S	*	*			trans	-133.9	129.7	171.7	-43.7	0	0	0	0	110.4
1471	P	34.6	Very low	36.9	Very low	116 Å²	116	139.7 Å²	139.7	75%	0.753	78%	0.781	S	S	*	*			trans	-110.1	137.8	-166.4	37.8	-32.6	0	0	0	117.1
1472	M	31.5	Very low	35.6	Very low	154 Å²	154	137.9 Å²	137.9	76%	0.759	78%	0.778	S	S	*	*			trans	58.5	146	149.6	-90.3	-172.3	69.7	0	0	121	P1474	M1472-P1474 HydrophobicContact CE-CB 3.8Å; M1472-P1474 HydrophobicContact CE-CG 3.86Å
1473	P	37.1	Very low	34.9	Very low	121 Å²	121	138 Å²	138	79%	0.786	79%	0.79	S	S	*	*				-133.5	176.3	82	35.4	-19.6	0	0	0	114.7
1474	P	35	Very low	34.1	Very low	85 Å²	85	136.1 Å²	136.1	55%	0.552	79%	0.789	S	S	*	*			trans	-101.4	-177.8	-171.8	39.3	-33.7	0	0	0	115.7	M1472	M1472-P1474 HydrophobicContact CE-CB 3.8Å; M1472-P1474 HydrophobicContact CE-CG 3.86Å
1475	D	35.8	Very low	33.8	Very low	147 Å²	147	136 Å²	136	79%	0.786	80%	0.795	S	S	*	*			trans	72.7	91.9	159	-57.2	-29.9	0	0	0	120.5
1476	H	33.5	Very low	33.4	Very low	188 Å²	188	133.6 Å²	133.6	87%	0.87	78%	0.779	S	S	*	*				-159.8	137	122.7	-127.7	-83.3	0	0	0	112.5
1477	P	33.5	Very low	33.8	Very low	115 Å²	115	137.9 Å²	137.9	75%	0.747	78%	0.781	S	S	*	*			trans	-109	116.8	-179.8	35.9	-28	0	0	0	114
1478	D	34.2	Very low	33.7	Very low	155 Å²	155	133.1 Å²	133.1	83%	0.829	77%	0.772	S	S	*	*			trans	-162.4	176.6	146	-143.7	-33.8	0	0	0	109.6
1479	L	33.7	Very low	34.2	Very low	164 Å²	164	130.6 Å²	130.6	86%	0.859	76%	0.763	S	S	*	*			trans	71	63	-177.1	-56.2	175.9	0	0	0	115.9	D1481	L1479-D1481 PolarHBondContact O-N 2.88Å
1480	T	30.6	Very low	34.1	Very low	145 Å²	145	131.6 Å²	131.6	89%	0.89	76%	0.758	S	S	*	*			trans	-84.2	100.2	156.6	55.4	0	0	0	0	110.7
1481	D	33.6	Very low	34.3	Very low	165 Å²	165	130.5 Å²	130.5	88%	0.882	76%	0.756	S	S	*	*			trans	-130.4	121.4	162.2	-162.5	-0.5	0	0	0	109.6	L1479	L1479-D1481 PolarHBondContact O-N 2.88Å
1482	A	30.9	Very low	34.8	Very low	79 Å²	79	129 Å²	129	65%	0.653	74%	0.739	S	S	*	*			trans	-133.4	96.4	-160.9	0	0	0	0	0	111.7	T1484	A1482-T1484 VanDerWaalsContact C-N 3.26Å; A1482-T1484 PolarHBondContact O-N 3.12Å; A1482-T1484 VanDerWaalsContact O-N 3.08Å
1483	S	34.1	Very low	36.5	Very low	126 Å²	126	125.7 Å²	125.7	88%	0.881	72%	0.724	S	S	*	*			trans	-83.5	71	166.1	55.7	0	0	0	0	111.1	G1485	S1483-G1485 PolarHBondContact O-N 2.64Å; S1483-G1485 VanDerWaalsContact O-N 3.14Å
1484	T	30.3	Very low	38.3	Very low	112 Å²	112	124.2 Å²	124.2	69%	0.687	71%	0.714	S	S	*	*			trans	-53.4	119.4	166.7	-59.9	0	0	0	0	108.8	A1482 Q1486	A1482-T1484 VanDerWaalsContact C-N 3.26Å; A1482-T1484 PolarHBondContact O-N 3.12Å; A1482-T1484 VanDerWaalsContact O-N 3.08Å; T1484-Q1486 HydrophobicContact CG2-CB 4.45Å; T1484-Q1486 PolarHBondContact O-N 2.64Å
1485	G	33.8	Very low	40	Very low	77 Å²	77	127.1 Å²	127.1	79%	0.794	72%	0.721	S	S	*	*			trans	-72.6	53.7	-179.8	0	0	0	0	0	113.5	S1483 M1487	S1483-G1485 PolarHBondContact O-N 2.64Å; S1483-G1485 VanDerWaalsContact O-N 3.14Å; G1485-M1487 PolarHBondContact O-N 2.91Å
1486	Q	30.1	Very low	41.4	Very low	124 Å²	124	122.8 Å²	122.8	58%	0.579	70%	0.699	S	S	*	*			trans	-66.3	93.8	177.1	-179.1	168	-16.7	0	0	109.1	T1484	T1484-Q1486 HydrophobicContact CG2-CB 4.45Å; T1484-Q1486 PolarHBondContact O-N 2.64Å
1487	M	40.4	Very low	43.1	Very low	165 Å²	165	117.3 Å²	117.3	81%	0.813	68%	0.676	S	S	*	*			trans	-77.8	121.8	156.5	-69.2	-169.5	-61.4	0	0	106.9	G1485 L1489	G1485-M1487 PolarHBondContact O-N 2.91Å; M1487-L1489 PolarHBondContact O-N 2.85Å
1488	D	33.5	Very low	45.1	Very low	125 Å²	125	118.2 Å²	118.2	67%	0.668	67%	0.67	S	S	*	*			trans	-58.2	108.2	-168.7	-59.3	-56.5	0	0	0	112.8
1489	L	43.4	Very low	47.1	Very low	102 Å²	102	116.6 Å²	116.6	53%	0.534	66%	0.659	S	S	.	*			trans	-99.5	18.3	165.7	-80.4	169.2	0	0	0	111.7	M1487 S1491 E1492	M1487-L1489 PolarHBondContact O-N 2.85Å; L1489-S1491 PolarHBondContact O-N 2.9Å; L1489-E1492 HydrophobicContact CD2-CB 4.2Å; L1489-E1492 HydrophobicContact CD2-CG 4.06Å; L1489-E1492 WeakPolarHBondContact CD2-OE2 3.48Å; L1489-E1492 PolarHBondContact O-N 3.3Å
1490	E	31.8	Very low	48.9	Very low	162 Å²	162	113.4 Å²	113.4	76%	0.757	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	49.8	173.6	-61.8	-167.4	176.7	0	0	112
1491	S	39.1	Very low	51.3	Low	114 Å²	114	110.4 Å²	110.4	80%	0.797	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.7	-6.9	168.7	50.9	0	0	0	0	115.3	L1489	L1489-S1491 PolarHBondContact O-N 2.9Å
1492	E	45.3	Very low	53.7	Low	83 Å²	83	110.4 Å²	110.4	39%	0.388	61%	0.611	S	S	.	*	S	Bend	trans	-95.6	140.4	179.2	-63.6	-155.5	140.8	0	0	112.8	L1489	L1489-E1492 HydrophobicContact CD2-CB 4.2Å; L1489-E1492 HydrophobicContact CD2-CG 4.06Å; L1489-E1492 WeakPolarHBondContact CD2-OE2 3.48Å; L1489-E1492 PolarHBondContact O-N 3.3Å
1493	D	67	Low	56.1	Low	86 Å²	86	111.5 Å²	111.5	46%	0.46	60%	0.602	S	S	.	*			trans	-66.7	135.2	-173.8	-168.6	-48.9	0	0	0	112.1	E1495 V1496 I1497	D1493-E1495 PolarHBondContact O-N 3.38Å; D1493-E1495 VanDerWaalsContact O-N 3.17Å; D1493-E1495 WeakPolarHBondContact OD1-CB 3.39Å; D1493-E1495 PolarHBondContact OD1-N 2.84Å; D1493-V1496 HydrophobicContact CB-CG2 4.1Å; D1493-V1496 WeakPolarHBondContact O-CB 3.45Å; D1493-V1496 PolarHBondContact O-N 2.66Å; D1493-I1497 PolarHBondContact O-N 3.39Å
1494	P	74.2	Confident	58.2	Low	89 Å²	89	115 Å²	115	58%	0.578	60%	0.596	S	S	*	*	H	α-helix	trans	-56.6	-27	175	23.4	-34.8	0	0	0	114.3	Q1498	P1494-Q1498 WeakPolarHBondContact O-CG 3.43Å; P1494-Q1498 PolarHBondContact O-N 2.84Å
1495	E	70.7	Confident	60.7	Low	147 Å²	147	115.9 Å²	115.9	69%	0.687	59%	0.594	S	S	*	*	H	α-helix	trans	-64.2	-38.3	170.8	-72.1	-152	136.3	0	0	112.1	D1493 Q1498 M1499	D1493-E1495 PolarHBondContact O-N 3.38Å; D1493-E1495 VanDerWaalsContact O-N 3.17Å; D1493-E1495 WeakPolarHBondContact OD1-CB 3.39Å; D1493-E1495 PolarHBondContact OD1-N 2.84Å; E1495-Q1498 PolarHBondContact O-N 3.41Å; E1495-M1499 VanDerWaalsContact O-CB 3.29Å; E1495-M1499 WeakPolarHBondContact O-CB 3Å; E1495-M1499 PolarHBondContact O-N 2.77Å
1496	V	65.3	Low	63.1	Low	55 Å²	55	117.2 Å²	117.2	33%	0.333	58%	0.58	S	S	.	*	H	α-helix	trans	-67	-41.8	178.9	175	0	0	0	0	110.5	D1493 M1499 I1500	D1493-V1496 HydrophobicContact CB-CG2 4.1Å; D1493-V1496 WeakPolarHBondContact O-CB 3.45Å; D1493-V1496 PolarHBondContact O-N 2.66Å; V1496-M1499 WeakPolarHBondContact O-CB 3.41Å; V1496-M1499 PolarHBondContact O-N 2.62Å; V1496-I1500 HydrophobicContact CG1-CD1 3.96Å; V1496-I1500 WeakPolarHBondContact O-CG1 3.41Å; V1496-I1500 PolarHBondContact O-N 3.47Å
1497	I	68.6	Low	65.3	Low	74 Å²	74	115.4 Å²	115.4	38%	0.379	57%	0.571	S	S	.	*	H	α-helix	trans	-62.5	-45.6	175	-60.8	178.4	0	0	0	110.4	D1493 M1499 I1500 V1501	D1493-I1497 PolarHBondContact O-N 3.39Å; I1497-M1499 VanDerWaalsContact C-N 3.34Å; I1497-M1499 PolarHBondContact O-N 3.5Å; I1497-I1500 PolarHBondContact O-N 3.45Å; I1497-V1501 WeakPolarHBondContact O-CG2 3.41Å; I1497-V1501 PolarHBondContact O-N 3.1Å
1498	Q	76.4	Confident	67.4	Low	133 Å²	133	113.8 Å²	113.8	62%	0.621	56%	0.561	S	S	*	*	H	α-helix	trans	-61.9	-39	174.5	-73.5	-172.2	45.2	0	0	112.6	P1494 E1495 V1501 R1502	P1494-Q1498 WeakPolarHBondContact O-CG 3.43Å; P1494-Q1498 PolarHBondContact O-N 2.84Å; E1495-Q1498 PolarHBondContact O-N 3.41Å; Q1498-V1501 PolarHBondContact O-N 3.24Å; Q1498-R1502 VanDerWaalsContact O-CB 3.26Å; Q1498-R1502 WeakPolarHBondContact O-CB 3.48Å; Q1498-R1502 PolarHBondContact O-N 2.93Å
1499	M	75.8	Confident	69.8	Low	121 Å²	121	115.9 Å²	115.9	60%	0.596	56%	0.564	S	S	*	*	H	α-helix	trans	-63.4	-43.2	177.6	-164.5	-164.7	-46.3	0	0	111.7	E1495 V1496 I1497 R1502 H1503	E1495-M1499 VanDerWaalsContact O-CB 3.29Å; E1495-M1499 WeakPolarHBondContact O-CB 3Å; E1495-M1499 PolarHBondContact O-N 2.77Å; V1496-M1499 WeakPolarHBondContact O-CB 3.41Å; V1496-M1499 PolarHBondContact O-N 2.62Å; I1497-M1499 VanDerWaalsContact C-N 3.34Å; I1497-M1499 PolarHBondContact O-N 3.5Å; M1499-R1502 PolarHBondContact O-N 3.46Å; M1499-H1503 WeakPolarHBondContact O-CB 2.75Å; M1499-H1503 PolarHBondContact O-N 2.67Å
1500	I	72.6	Confident	71.8	Confident	97 Å²	97	113.7 Å²	113.7	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-46.5	176.2	-69.2	166	0	0	0	110.6	V1496 I1497 H1503 R1504	V1496-I1500 HydrophobicContact CG1-CD1 3.96Å; V1496-I1500 WeakPolarHBondContact O-CG1 3.41Å; V1496-I1500 PolarHBondContact O-N 3.47Å; I1497-I1500 PolarHBondContact O-N 3.45Å; I1500-H1503 PolarHBondContact O-N 3.39Å; I1500-R1504 WeakPolarHBondContact O-CB 3.23Å; I1500-R1504 PolarHBondContact O-N 3.1Å
1501	V	81	Confident	74	Confident	82 Å²	82	111.2 Å²	111.2	50%	0.497	54%	0.544	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176.9	170.9	0	0	0	0	111.1	I1497 Q1498 R1504 M1505	I1497-V1501 WeakPolarHBondContact O-CG2 3.41Å; I1497-V1501 PolarHBondContact O-N 3.1Å; Q1498-V1501 PolarHBondContact O-N 3.24Å; V1501-R1504 PolarHBondContact O-N 2.85Å; V1501-M1505 HydrophobicContact CG1-CE 4.33Å; V1501-M1505 PolarHBondContact O-N 2.65Å
1502	R	82.4	Confident	76.1	Confident	166 Å²	166	109.4 Å²	109.4	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-58	-49.8	176.9	-167.1	-172.5	-148.3	110.4	-0.2	111.4	Q1498 M1499 R1504 M1505 E1506	Q1498-R1502 VanDerWaalsContact O-CB 3.26Å; Q1498-R1502 WeakPolarHBondContact O-CB 3.48Å; Q1498-R1502 PolarHBondContact O-N 2.93Å; M1499-R1502 PolarHBondContact O-N 3.46Å; R1502-R1504 VanDerWaalsContact C-N 3.33Å; R1502-R1504 PolarHBondContact O-N 3.07Å; R1502-M1505 WeakPolarHBondContact O-CB 3.35Å; R1502-M1505 PolarHBondContact O-N 2.66Å; R1502-E1506 WeakPolarHBondContact O-CG 3.11Å; R1502-E1506 PolarHBondContact O-N 3.05Å
1503	H	82.8	Confident	78	Confident	102 Å²	102	113.1 Å²	113.1	47%	0.472	54%	0.538	S	S	.	.	H	α-helix	trans	-62.6	-39.6	179.5	-169.2	66.6	0	0	0	112.2	M1499 I1500 M1505 E1506 Q1507	M1499-H1503 WeakPolarHBondContact O-CB 2.75Å; M1499-H1503 PolarHBondContact O-N 2.67Å; I1500-H1503 PolarHBondContact O-N 3.39Å; H1503-M1505 VanDerWaalsContact C-N 3.32Å; H1503-M1505 PolarHBondContact O-N 2.82Å; H1503-E1506 PolarHBondContact O-N 3.4Å; H1503-Q1507 PolarHBondContact CE1-NE2 3.22Å; H1503-Q1507 PolarHBondContact NE2-NE2 3.43Å; H1503-Q1507 VanDerWaalsContact O-CG 3.27Å; H1503-Q1507 WeakPolarHBondContact O-CG 3.38Å; H1503-Q1507 PolarHBondContact O-N 3.47Å
1504	R	76.8	Confident	78.8	Confident	199 Å²	199	114.2 Å²	114.2	75%	0.751	54%	0.54	S	S	*	.	H	α-helix	trans	-62.6	-39.8	176.4	-147	178.5	-146.4	173.4	7	111.8	I1500 V1501 R1502 H1508	I1500-R1504 WeakPolarHBondContact O-CB 3.23Å; I1500-R1504 PolarHBondContact O-N 3.1Å; V1501-R1504 PolarHBondContact O-N 2.85Å; R1502-R1504 VanDerWaalsContact C-N 3.33Å; R1502-R1504 PolarHBondContact O-N 3.07Å; R1504-H1508 PolarHBondContact O-N 3.18Å; R1504-H1508 VanDerWaalsContact O-N 3.17Å
1505	M	83.6	Confident	79.2	Confident	130 Å²	130	117.5 Å²	117.5	64%	0.64	54%	0.541	S	S	*	.	H	α-helix	trans	-68.5	-40.1	177	-156.6	-173.8	-59.2	0	0	112.1	V1501 R1502 H1503 H1508 K1509	V1501-M1505 HydrophobicContact CG1-CE 4.33Å; V1501-M1505 PolarHBondContact O-N 2.65Å; R1502-M1505 WeakPolarHBondContact O-CB 3.35Å; R1502-M1505 PolarHBondContact O-N 2.66Å; H1503-M1505 VanDerWaalsContact C-N 3.32Å; H1503-M1505 PolarHBondContact O-N 2.82Å; M1505-H1508 PolarHBondContact O-N 3.34Å; M1505-K1509 WeakPolarHBondContact O-CB 3.47Å; M1505-K1509 PolarHBondContact O-N 3.08Å
1506	E	84.8	Confident	79.8	Confident	106 Å²	106	114.5 Å²	114.5	50%	0.495	53%	0.533	S	S	.	.	H	α-helix	trans	-63.5	-41.6	174.3	-73.9	172	-174.3	0	0	112.6	R1502 H1503 K1509 L1510	R1502-E1506 WeakPolarHBondContact O-CG 3.11Å; R1502-E1506 PolarHBondContact O-N 3.05Å; H1503-E1506 PolarHBondContact O-N 3.4Å; E1506-K1509 PolarHBondContact O-N 3.37Å; E1506-L1510 PolarHBondContact O-N 3.47Å
1507	Q	76.2	Confident	80.5	Confident	86 Å²	86	116.1 Å²	116.1	40%	0.402	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-43.6	175.2	-67.4	-74.1	2.6	0	0	111.6	H1503 K1509 L1510 L1511	H1503-Q1507 PolarHBondContact CE1-NE2 3.22Å; H1503-Q1507 PolarHBondContact NE2-NE2 3.43Å; H1503-Q1507 VanDerWaalsContact O-CG 3.27Å; H1503-Q1507 WeakPolarHBondContact O-CG 3.38Å; H1503-Q1507 PolarHBondContact O-N 3.47Å; Q1507-K1509 PolarHBondContact O-N 3.44Å; Q1507-L1510 PolarHBondContact O-N 2.96Å; Q1507-L1511 WeakPolarHBondContact O-CG 3.29Å; Q1507-L1511 PolarHBondContact O-N 2.82Å
1508	H	83.3	Confident	80.9	Confident	131 Å²	131	117.1 Å²	117.1	61%	0.606	54%	0.542	S	S	*	.	H	α-helix	trans	-62.3	-42.7	175.9	-164.3	-68.7	0	0	0	111.9	R1504 M1505 L1510 L1511 E1512	R1504-H1508 PolarHBondContact O-N 3.18Å; R1504-H1508 VanDerWaalsContact O-N 3.17Å; M1505-H1508 PolarHBondContact O-N 3.34Å; H1508-L1510 VanDerWaalsContact C-N 3.29Å; H1508-L1510 PolarHBondContact O-N 3.09Å; H1508-L1511 PolarHBondContact O-N 2.88Å; H1508-E1512 PolarHBondContact O-N 2.86Å
1509	K	85.3	Confident	80.9	Confident	168 Å²	168	115.4 Å²	115.4	73%	0.73	53%	0.534	S	S	*	.	H	α-helix	trans	-65.1	-31.3	177.2	-166.9	170.7	-174.9	173.3	0	112.7	M1505 E1506 Q1507 K1513	M1505-K1509 WeakPolarHBondContact O-CB 3.47Å; M1505-K1509 PolarHBondContact O-N 3.08Å; E1506-K1509 PolarHBondContact O-N 3.37Å; Q1507-K1509 PolarHBondContact O-N 3.44Å; K1509-K1513 WeakPolarHBondContact O-CB 3.28Å; K1509-K1513 PolarHBondContact O-N 3.32Å
1510	L	83.9	Confident	81	Confident	56 Å²	56	116.7 Å²	116.7	29%	0.293	53%	0.532	S	S	.	.	H	α-helix	trans	-72.8	-42.9	174.2	-176.3	65.5	0	0	0	112.4	E1506 Q1507 H1508 K1513 Q1514	E1506-L1510 PolarHBondContact O-N 3.47Å; Q1507-L1510 PolarHBondContact O-N 2.96Å; H1508-L1510 VanDerWaalsContact C-N 3.29Å; H1508-L1510 PolarHBondContact O-N 3.09Å; L1510-K1513 PolarHBondContact O-N 3.28Å; L1510-Q1514 PolarHBondContact O-N 3.27Å
1511	L	78.4	Confident	81.2	Confident	110 Å²	110	116 Å²	116	58%	0.576	53%	0.529	S	S	*	.	H	α-helix	trans	-62.3	-45	177.5	-74.5	168.5	0	0	0	111.6	Q1507 H1508 K1513 Q1514 R1515	Q1507-L1511 WeakPolarHBondContact O-CG 3.29Å; Q1507-L1511 PolarHBondContact O-N 2.82Å; H1508-L1511 PolarHBondContact O-N 2.88Å; L1511-K1513 VanDerWaalsContact C-N 3.32Å; L1511-K1513 PolarHBondContact O-N 3.2Å; L1511-Q1514 PolarHBondContact O-N 2.83Å; L1511-Q1514 VanDerWaalsContact O-N 3.13Å; L1511-R1515 PolarHBondContact O-N 3.39Å
1512	E	84.6	Confident	80.8	Confident	77 Å²	77	119.9 Å²	119.9	36%	0.36	54%	0.535	S	S	.	.	H	α-helix	trans	-65.6	-36.4	177.4	-163.5	59.9	-153.8	0	0	111.6	H1508 Q1514 R1515 V1516	H1508-E1512 PolarHBondContact O-N 2.86Å; E1512-Q1514 VanDerWaalsContact C-N 3.32Å; E1512-Q1514 PolarHBondContact O-N 3.2Å; E1512-R1515 WeakPolarHBondContact O-CB 3.34Å; E1512-R1515 PolarHBondContact O-N 3.05Å; E1512-R1515 WeakPolarHBondContact OE1-CD 3.31Å; E1512-R1515 IonicContact OE1-CZ 2.82Å; E1512-R1515 IonicContact OE1-NH1 3.69Å; E1512-R1515 PolarHBondContact OE1-NH1 3.02Å; E1512-R1515 VanDerWaalsContact OE1-NH1 3.09Å; E1512-R1515 WeakPolarHBondContact OE2-CD 3.42Å; E1512-R1515 IonicContact OE2-NH1 2.69Å; E1512-R1515 PolarHBondContact OE2-NH1 2.86Å; E1512-V1516 WeakPolarHBondContact O-CG2 3.45Å; E1512-V1516 PolarHBondContact O-N 2.61Å
1513	K	85.4	Confident	80.2	Confident	160 Å²	160	116 Å²	116	70%	0.696	53%	0.533	S	S	*	.	H	α-helix	trans	-62.4	-36.7	172.4	-171.7	176.1	-179.5	-179.3	0	112.5	K1509 L1510 L1511 E1517	K1509-K1513 WeakPolarHBondContact O-CB 3.28Å; K1509-K1513 PolarHBondContact O-N 3.32Å; L1510-K1513 PolarHBondContact O-N 3.28Å; L1511-K1513 VanDerWaalsContact C-N 3.32Å; L1511-K1513 PolarHBondContact O-N 3.2Å; K1513-E1517 PolarHBondContact O-N 3.29Å
1514	Q	82.1	Confident	79.8	Confident	109 Å²	109	117.8 Å²	117.8	51%	0.509	54%	0.54	S	S	.	.	H	α-helix	trans	-69.2	-41.4	174.1	-73.2	-176.2	-15	0	0	112	L1510 L1511 E1512 E1517 I1518	L1510-Q1514 PolarHBondContact O-N 3.27Å; L1511-Q1514 PolarHBondContact O-N 2.83Å; L1511-Q1514 VanDerWaalsContact O-N 3.13Å; E1512-Q1514 VanDerWaalsContact C-N 3.32Å; E1512-Q1514 PolarHBondContact O-N 3.2Å; Q1514-E1517 PolarHBondContact O-N 3.36Å; Q1514-I1518 WeakPolarHBondContact O-CG1 3.36Å; Q1514-I1518 PolarHBondContact O-N 3.42Å
1515	R	84.2	Confident	79	Confident	158 Å²	158	114.8 Å²	114.8	60%	0.596	54%	0.537	S	S	*	.	H	α-helix	trans	-58.2	-48.7	175.4	-174.5	-173.2	178.9	-164.5	4.5	111.7	L1511 E1512 E1517 I1518 E1519	L1511-R1515 PolarHBondContact O-N 3.39Å; E1512-R1515 WeakPolarHBondContact O-CB 3.34Å; E1512-R1515 PolarHBondContact O-N 3.05Å; E1512-R1515 WeakPolarHBondContact OE1-CD 3.31Å; E1512-R1515 IonicContact OE1-CZ 2.82Å; E1512-R1515 IonicContact OE1-NH1 3.69Å; E1512-R1515 PolarHBondContact OE1-NH1 3.02Å; E1512-R1515 VanDerWaalsContact OE1-NH1 3.09Å; E1512-R1515 WeakPolarHBondContact OE2-CD 3.42Å; E1512-R1515 IonicContact OE2-NH1 2.69Å; E1512-R1515 PolarHBondContact OE2-NH1 2.86Å; R1515-E1517 PolarHBondContact O-N 2.89Å; R1515-I1518 PolarHBondContact O-N 2.83Å; R1515-E1519 PolarHBondContact O-N 3.25Å
1516	V	81.5	Confident	77.1	Confident	84 Å²	84	118.7 Å²	118.7	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-39.4	178.8	172.5	0	0	0	0	112.1	E1512 E1519 R1520	E1512-V1516 WeakPolarHBondContact O-CG2 3.45Å; E1512-V1516 PolarHBondContact O-N 2.61Å; V1516-E1519 PolarHBondContact O-N 3.46Å; V1516-R1520 VanDerWaalsContact O-CB 3.25Å; V1516-R1520 WeakPolarHBondContact O-CB 3.46Å; V1516-R1520 PolarHBondContact O-N 2.86Å
1517	E	80.9	Confident	74.9	Confident	90 Å²	90	119.8 Å²	119.8	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-69.9	-35.9	176.5	-167.6	60.4	-148	0	0	112.2	K1513 Q1514 R1515 R1520 L1521	K1513-E1517 PolarHBondContact O-N 3.29Å; Q1514-E1517 PolarHBondContact O-N 3.36Å; R1515-E1517 PolarHBondContact O-N 2.89Å; E1517-R1520 PolarHBondContact O-N 3.37Å; E1517-L1521 HydrophobicContact CG-CD1 4.36Å; E1517-L1521 WeakPolarHBondContact O-CB 3.42Å; E1517-L1521 VanDerWaalsContact O-CG 3.27Å; E1517-L1521 WeakPolarHBondContact O-CG 3.29Å; E1517-L1521 PolarHBondContact O-N 3.22Å
1518	I	76.1	Confident	73.2	Confident	94 Å²	94	121.2 Å²	121.2	48%	0.482	58%	0.575	S	S	.	*	H	α-helix	trans	-62.9	-43.9	173	-70.3	165.9	0	0	0	110.8	Q1514 R1515 R1520 L1521 R1522	Q1514-I1518 WeakPolarHBondContact O-CG1 3.36Å; Q1514-I1518 PolarHBondContact O-N 3.42Å; R1515-I1518 PolarHBondContact O-N 2.83Å; I1518-R1520 VanDerWaalsContact C-N 3.35Å; I1518-L1521 PolarHBondContact O-N 2.66Å; I1518-R1522 WeakPolarHBondContact O-CG 3.46Å; I1518-R1522 PolarHBondContact O-N 2.86Å
1519	E	77.7	Confident	70.9	Confident	98 Å²	98	126.9 Å²	126.9	46%	0.458	59%	0.591	S	S	.	*	H	α-helix	trans	-68.5	-35.3	178.2	-147.6	59	-115.1	0	0	112	R1515 V1516 L1521 R1522 S1523	R1515-E1519 PolarHBondContact O-N 3.25Å; V1516-E1519 PolarHBondContact O-N 3.46Å; E1519-L1521 VanDerWaalsContact C-N 3.33Å; E1519-L1521 PolarHBondContact O-N 2.81Å; E1519-R1522 PolarHBondContact O-N 3.49Å; E1519-S1523 VanDerWaalsContact O-CB 3.32Å; E1519-S1523 WeakPolarHBondContact O-CB 3.42Å; E1519-S1523 PolarHBondContact O-N 3.43Å; E1519-S1523 PolarHBondContact O-OG 3Å
1520	R	77.5	Confident	68.5	Low	148 Å²	148	123.1 Å²	123.1	56%	0.558	59%	0.591	S	S	*	*	H	α-helix	trans	-64.8	-33.8	171.4	-173.3	176.2	-175.2	75.6	-3.8	112.5	V1516 E1517 I1518 K1524	V1516-R1520 VanDerWaalsContact O-CB 3.25Å; V1516-R1520 WeakPolarHBondContact O-CB 3.46Å; V1516-R1520 PolarHBondContact O-N 2.86Å; E1517-R1520 PolarHBondContact O-N 3.37Å; I1518-R1520 VanDerWaalsContact C-N 3.35Å; R1520-K1524 WeakPolarHBondContact O-CD 3.43Å; R1520-K1524 VanDerWaalsContact O-CG 3.29Å; R1520-K1524 WeakPolarHBondContact O-CG 3.49Å; R1520-K1524 PolarHBondContact O-N 3.44Å
1521	L	77	Confident	66.2	Low	82 Å²	82	127.1 Å²	127.1	43%	0.429	62%	0.618	S	S	.	*	H	α-helix	trans	-74.8	-42.7	174	-73.4	167	0	0	0	111.8	E1517 I1518 E1519 S1523 K1524 I1525	E1517-L1521 HydrophobicContact CG-CD1 4.36Å; E1517-L1521 WeakPolarHBondContact O-CB 3.42Å; E1517-L1521 VanDerWaalsContact O-CG 3.27Å; E1517-L1521 WeakPolarHBondContact O-CG 3.29Å; E1517-L1521 PolarHBondContact O-N 3.22Å; I1518-L1521 PolarHBondContact O-N 2.66Å; E1519-L1521 VanDerWaalsContact C-N 3.33Å; E1519-L1521 PolarHBondContact O-N 2.81Å; L1521-S1523 VanDerWaalsContact C-N 3.33Å; L1521-S1523 PolarHBondContact O-N 3.09Å; L1521-K1524 WeakPolarHBondContact O-CB 3.27Å; L1521-K1524 PolarHBondContact O-N 2.88Å; L1521-K1524 VanDerWaalsContact O-N 3.1Å; L1521-I1525 WeakPolarHBondContact O-CG1 3.34Å; L1521-I1525 PolarHBondContact O-N 3.44Å
1522	R	71.8	Confident	64.1	Low	163 Å²	163	127 Å²	127	62%	0.615	63%	0.627	S	S	*	*	H	α-helix	trans	-57.4	-45.6	172.7	-74.8	173.6	163.5	-140.1	-13.6	111.7	I1518 E1519 K1524 I1525 R1526	I1518-R1522 WeakPolarHBondContact O-CG 3.46Å; I1518-R1522 PolarHBondContact O-N 2.86Å; E1519-R1522 PolarHBondContact O-N 3.49Å; R1522-K1524 PolarHBondContact O-N 3.22Å; R1522-I1525 PolarHBondContact O-N 3.34Å; R1522-I1525 VanDerWaalsContact O-N 3.11Å; R1522-R1526 PolarHBondContact O-N 3.37Å; R1522-R1526 VanDerWaalsContact O-N 3.15Å
1523	S	71	Confident	61.7	Low	85 Å²	85	129.5 Å²	129.5	59%	0.594	65%	0.647	S	S	*	*	H	α-helix	trans	-62	-26.6	176.3	-57.8	0	0	0	0	113.7	E1519 L1521	E1519-S1523 VanDerWaalsContact O-CB 3.32Å; E1519-S1523 WeakPolarHBondContact O-CB 3.42Å; E1519-S1523 PolarHBondContact O-N 3.43Å; E1519-S1523 PolarHBondContact O-OG 3Å; L1521-S1523 VanDerWaalsContact C-N 3.33Å; L1521-S1523 PolarHBondContact O-N 3.09Å
1524	K	73.6	Confident	59.3	Low	140 Å²	140	127.7 Å²	127.7	61%	0.609	65%	0.645	S	S	*	*	H	α-helix	trans	-83.1	-22	175.2	-74.7	168	177.7	176.8	0	114	R1520 L1521 R1522	R1520-K1524 WeakPolarHBondContact O-CD 3.43Å; R1520-K1524 VanDerWaalsContact O-CG 3.29Å; R1520-K1524 WeakPolarHBondContact O-CG 3.49Å; R1520-K1524 PolarHBondContact O-N 3.44Å; L1521-K1524 WeakPolarHBondContact O-CB 3.27Å; L1521-K1524 PolarHBondContact O-N 2.88Å; L1521-K1524 VanDerWaalsContact O-N 3.1Å; R1522-K1524 PolarHBondContact O-N 3.22Å
1525	I	59.7	Low	56.9	Low	136 Å²	136	128.6 Å²	128.6	70%	0.697	66%	0.66	S	S	*	*	H	α-helix	trans	-90.9	-22.8	-178.5	-67.3	167.2	0	0	0	111.1	L1521 R1522 V1527	L1521-I1525 WeakPolarHBondContact O-CG1 3.34Å; L1521-I1525 PolarHBondContact O-N 3.44Å; R1522-I1525 PolarHBondContact O-N 3.34Å; R1522-I1525 VanDerWaalsContact O-N 3.11Å; I1525-V1527 PolarHBondContact O-N 3.09Å
1526	R	43.4	Very low	54.5	Low	211 Å²	211	128.6 Å²	128.6	80%	0.796	67%	0.667	S	S	*	*			trans	-73.7	88	177.6	-163.2	176.9	-154.4	162.6	6.6	111.8	R1522 P1528	R1522-R1526 PolarHBondContact O-N 3.37Å; R1522-R1526 VanDerWaalsContact O-N 3.15Å; R1526-P1528 VanDerWaalsContact O-CD 3.28Å; R1526-P1528 WeakPolarHBondContact O-CD 3.36Å
1527	V	40	Very low	52.1	Low	130 Å²	130	133.3 Å²	133.3	79%	0.788	69%	0.686	S	S	*	*			trans	-57.6	119.2	169.2	-179.8	0	0	0	0	109.5	I1525 R1529	I1525-V1527 PolarHBondContact O-N 3.09Å; V1527-R1529 PolarHBondContact O-N 3.36Å
1528	P	40.1	Very low	49.9	Very low	115 Å²	115	136.4 Å²	136.4	75%	0.747	70%	0.704	S	S	*	*			trans	-81	105.2	178.8	-7.6	25.3	0	0	0	110.2	R1526 A1530	R1526-P1528 VanDerWaalsContact O-CD 3.28Å; R1526-P1528 WeakPolarHBondContact O-CD 3.36Å; P1528-A1530 PolarHBondContact O-N 2.59Å
1529	R	35.5	Very low	47.8	Very low	250 Å²	250	135.5 Å²	135.5	94%	0.943	72%	0.717	S	S	*	*			trans	-77.6	106.4	164.5	-170.1	171.1	-174.7	149	3	107.8	V1527	V1527-R1529 PolarHBondContact O-N 3.36Å
1530	A	35.2	Very low	45.8	Very low	89 Å²	89	137.6 Å²	137.6	74%	0.736	73%	0.732	S	S	*	*			trans	-77.9	138.9	-163.9	0	0	0	0	0	114.3	P1528	P1528-A1530 PolarHBondContact O-N 2.59Å
1531	T	35.5	Very low	43.9	Very low	140 Å²	140	138.6 Å²	138.6	86%	0.859	75%	0.748	S	S	*	*			trans	-131.1	133.9	134.5	27.2	0	0	0	0	106.8
1532	S	33	Very low	42	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	77%	0.771	S	S	*	*			trans	-100.5	114.1	-179.4	175.4	0	0	0	0	108.9
1533	V	35.3	Very low	40.2	Very low	128 Å²	128	141.1 Å²	141.1	78%	0.776	78%	0.781	S	S	*	*			trans	-134.9	119.9	164.1	-174.4	0	0	0	0	105.5	P1535	V1533-P1535 WeakPolarHBondContact O-CD 3.41Å
1534	N	33.8	Very low	38.5	Very low	122 Å²	122	143.9 Å²	143.9	65%	0.652	79%	0.79	S	S	*	*			trans	-81.3	129.5	176.4	-84	13.8	0	0	0	110.1
1535	P	31.8	Very low	36.6	Very low	129 Å²	129	142.5 Å²	142.5	84%	0.838	79%	0.793	S	S	*	*			trans	-106.4	58.4	159	38.4	-27.8	0	0	0	109.7	V1533	V1533-P1535 WeakPolarHBondContact O-CD 3.41Å
1536	E	34.5	Very low	35.5	Very low	157 Å²	157	142 Å²	142	73%	0.734	80%	0.797	S	S	*	*			trans	-97.7	140.8	158.4	-78.7	-172.8	116	0	0	107.9
1537	M	30.4	Very low	34.9	Very low	183 Å²	183	139.1 Å²	139.1	90%	0.901	80%	0.796	S	S	*	*			trans	65	59.6	175.4	-53.6	-59.7	-66.1	0	0	116.5
1538	I	35.4	Very low	34.4	Very low	156 Å²	156	139.4 Å²	139.4	80%	0.8	80%	0.799	S	S	*	*			trans	-119.1	126.4	136.3	-61	179.8	0	0	0	106.5	D1540	I1538-D1540 WeakPolarHBondContact CG2-OD2 3.42Å
1539	G	31.1	Very low	34	Very low	74 Å²	74	138.1 Å²	138.1	76%	0.763	80%	0.798	S	S	*	*			trans	-150	105.3	178.1	0	0	0	0	0	108.3
1540	D	36.2	Very low	34	Very low	143 Å²	143	133.9 Å²	133.9	77%	0.765	79%	0.793	S	S	*	*			trans	-107.3	102.1	-179.8	-58.5	-61.5	0	0	0	108.9	I1538	I1538-D1540 WeakPolarHBondContact CG2-OD2 3.42Å
1541	D	37.2	Very low	33.7	Very low	169 Å²	169	138 Å²	138	90%	0.904	80%	0.797	S	S	*	*			trans	-167.1	131.6	138.1	-108.3	-30.4	0	0	0	109.1
1542	E	36.8	Very low	33.3	Very low	197 Å²	197	136.7 Å²	136.7	92%	0.921	79%	0.793	S	S	*	*			trans	-80.5	133.8	-169.8	-67.7	-174.4	97.7	0	0	113.1
1543	A	35	Very low	33.4	Very low	100 Å²	100	135.8 Å²	135.8	83%	0.826	79%	0.792	S	S	*	*			trans	-134.7	61	165.6	0	0	0	0	0	111.7
1544	D	34.4	Very low	33.6	Very low	143 Å²	143	137.5 Å²	137.5	77%	0.765	80%	0.796	S	S	*	*			trans	74.8	139.8	151.7	-130.5	-33.3	0	0	0	121.3
1545	T	35.1	Very low	33.4	Very low	112 Å²	112	134.6 Å²	134.6	69%	0.687	80%	0.796	S	S	*	*			trans	-5.1	130.8	167.3	45.5	0	0	0	0	121.8
1546	T	35.5	Very low	33.5	Very low	125 Å²	125	136.2 Å²	136.2	77%	0.767	80%	0.797	S	S	*	*				-176.5	147.9	95.4	25.5	0	0	0	0	115
1547	L	30.5	Very low	33.5	Very low	151 Å²	151	133.5 Å²	133.5	79%	0.791	80%	0.802	S	S	*	*			trans	51.1	98.8	154	-64	166.6	0	0	0	117.7
1548	T	29.2	Very low	33.5	Very low	136 Å²	136	130.4 Å²	130.4	83%	0.834	80%	0.798	S	S	*	*				64.6	83.7	54.1	-39.6	0	0	0	0	114.9
1549	A	33.2	Very low	33.4	Very low	88 Å²	88	131 Å²	131	73%	0.727	80%	0.802	S	S	*	*			trans	-159	136.5	154.9	0	0	0	0	0	112
1550	L	35.7	Very low	33.5	Very low	160 Å²	160	131.9 Å²	131.9	84%	0.838	80%	0.797	S	S	*	*			trans	45.9	88.9	152	-56	173.6	0	0	0	116.3
1551	Q	27.8	Very low	33.5	Very low	175 Å²	175	133 Å²	133	82%	0.818	80%	0.802	S	S	*	*			cis	63.5	121.2	41	-152	178.7	13	0	0	114.2
1552	S	27.9	Very low	33.4	Very low	113 Å²	113	130.4 Å²	130.4	79%	0.79	79%	0.794	S	S	*	*			trans	55.4	100.9	162.5	57.9	0	0	0	0	120.2
1553	A	34.7	Very low	33.2	Very low	90 Å²	90	125.1 Å²	125.1	74%	0.744	78%	0.784	S	S	*	*			trans	-153.8	114.9	146.9	0	0	0	0	0	111.6
1554	L	38.7	Very low	33.2	Very low	164 Å²	164	125.9 Å²	125.9	86%	0.859	78%	0.783	S	S	*	*			trans	27.7	131.2	156.4	-65	72.2	0	0	0	119.4
1555	G	30	Very low	33.5	Very low	62 Å²	62	124.8 Å²	124.8	64%	0.639	78%	0.784	S	S	*	*			cis	96.8	138.1	13.1	0	0	0	0	0	113.4
1556	N	33.3	Very low	33.6	Very low	162 Å²	162	124.9 Å²	124.9	87%	0.866	79%	0.787	S	S	*	*			trans	83.7	103.7	173.6	-50.8	-26.2	0	0	0	119
1557	A	36.3	Very low	33.8	Very low	101 Å²	101	124 Å²	124	84%	0.835	78%	0.783	S	S	*	*				-175.3	132.8	123.8	0	0	0	0	0	110.2
1558	S	29.9	Very low	33.8	Very low	117 Å²	117	123.7 Å²	123.7	82%	0.818	78%	0.782	S	S	*	*			trans	-145.6	145.5	-175.5	-52.9	0	0	0	0	113.1
1559	L	33.2	Very low	33.8	Very low	168 Å²	168	122.3 Å²	122.3	88%	0.88	77%	0.774	S	S	*	*			trans	-146.1	101.1	165.8	-69	177.4	0	0	0	107.8
1560	S	33.7	Very low	33.7	Very low	94 Å²	94	125.8 Å²	125.8	66%	0.657	78%	0.775	S	S	*	*				83	100.6	101.4	67.7	0	0	0	0	114.6
1561	L	35	Very low	33.5	Very low	166 Å²	166	125.2 Å²	125.2	87%	0.869	77%	0.771	S	S	*	*				79.8	151.8	74.5	-76.9	171.4	0	0	0	114.2
1562	P	36	Very low	33.8	Very low	114 Å²	114	120.8 Å²	120.8	74%	0.74	76%	0.757	S	S	*	*			cis	-138.7	160.7	12.3	40.5	-21.9	0	0	0	119.9
1563	A	33.1	Very low	34	Very low	87 Å²	87	122.2 Å²	122.2	72%	0.719	76%	0.756	S	S	*	*			trans	63.4	111.9	139.6	0	0	0	0	0	125.4
1564	S	34.3	Very low	33.9	Very low	115 Å²	115	124.5 Å²	124.5	80%	0.804	76%	0.756	S	S	*	*				14.5	162.2	115.8	-48.8	0	0	0	0	122.2
1565	P	39.5	Very low	33.6	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	75%	0.753	S	S	*	*			cis	-143.3	175.2	22	43.6	-24.5	0	0	0	119.7
1566	P	38.2	Very low	33.7	Very low	115 Å²	115	125.2 Å²	125.2	75%	0.747	76%	0.758	S	S	*	*			trans	-109.3	-156.1	168.9	46	-36.5	0	0	0	111.4
1567	P	39.4	Very low	33.6	Very low	105 Å²	105	125 Å²	125	68%	0.682	75%	0.751	S	S	*	*			cis	-134.9	-166	-11.3	33.3	-9.3	0	0	0	115.4
1568	N	30.7	Very low	33.6	Very low	146 Å²	146	126.8 Å²	126.8	78%	0.781	74%	0.742	S	S	*	*			trans	115.1	151.4	155.7	-64.6	0.5	0	0	0	116.9
1569	T	29	Very low	33.8	Very low	107 Å²	107	129.6 Å²	129.6	66%	0.656	74%	0.742	S	S	*	*			cis	-170.8	161.8	-38.9	-40.8	0	0	0	0	106.8
1570	E	30.5	Very low	33.5	Very low	161 Å²	161	126.8 Å²	126.8	75%	0.752	74%	0.736	S	S	*	*			trans	74.3	147.5	163.3	-58.8	171.2	-156	0	0	117.9
1571	I	31.9	Very low	33.4	Very low	147 Å²	147	130 Å²	130	75%	0.754	75%	0.746	S	S	*	*			cis	-161.9	159.6	-15.7	-111.4	163.5	0	0	0	108.9
1572	P	34.8	Very low	33	Very low	82 Å²	82	127.1 Å²	127.1	53%	0.532	74%	0.739	S	S	.	*			trans	-105.3	-149.1	-164.9	42.3	-38.5	0	0	0	117.8
1573	D	32.2	Very low	32.7	Very low	144 Å²	144	132.2 Å²	132.2	77%	0.77	75%	0.75	S	S	*	*			trans	85.5	149.1	174	-57.2	-19.5	0	0	0	118.8
1574	N	32.6	Very low	32.4	Very low	138 Å²	138	138.2 Å²	138.2	74%	0.738	75%	0.754	S	S	*	*			cis	-151.5	-177.6	2.7	-142.3	-51.7	0	0	0	114
1575	E	31.6	Very low	32.1	Very low	168 Å²	168	137.3 Å²	137.3	79%	0.785	75%	0.746	S	S	*	*			trans	-73.4	174.8	-167.6	-62.8	-169.2	124.3	0	0	119.8
1576	G	32.7	Very low	31.6	Very low	73 Å²	73	139.8 Å²	139.8	75%	0.753	75%	0.751	S	S	*	*			trans	169.3	41.7	168.5	0	0	0	0	0	116.8
1577	Q	32.1	Very low	31.2	Very low	156 Å²	156	137.5 Å²	137.5	73%	0.729	75%	0.749	S	S	*	*				87.8	147.6	94	-150.2	-177.1	42.5	0	0	115.9
1578	H	35	Very low	30.9	Very low	139 Å²	139	140.1 Å²	140.1	64%	0.644	76%	0.757	S	S	*	*			trans	83.2	85.5	168.7	-71.4	-72.1	0	0	0	123
1579	H	33.4	Very low	31.3	Very low	176 Å²	176	138.3 Å²	138.3	82%	0.815	75%	0.753	S	S	*	*				75.7	138.1	113.1	-84.4	78.9	0	0	0	122.9
1580	C	28.7	Very low	31.4	Very low	110 Å²	110	140.6 Å²	140.6	74%	0.743	76%	0.761	S	S	*	*			trans	-100.2	-178.5	-160.9	-50.1	0	0	0	0	115.8
1581	N	30.8	Very low	31.6	Very low	162 Å²	162	139.4 Å²	139.4	87%	0.866	76%	0.76	S	S	*	*			trans	79.6	84.1	150.9	-65.3	-11.8	0	0	0	119.2
1582	S	26.8	Very low	31.6	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	77%	0.766	S	S	*	*			trans	-127.7	122.2	135.1	-178.2	0	0	0	0	109.2
1583	F	30	Very low	31.5	Very low	222 Å²	222	142.5 Å²	142.5	97%	0.974	78%	0.778	S	S	*	*			trans	-134.6	84.5	163.2	-110.7	-71.2	0	0	0	110
1584	R	27	Very low	31.3	Very low	213 Å²	213	140.6 Å²	140.6	80%	0.804	78%	0.776	S	S	*	*			trans	-130.6	146.9	167.5	-146.8	-167.4	-164.3	-165.2	7	107.6
1585	C	28	Very low	31.2	Very low	95 Å²	95	141.6 Å²	141.6	64%	0.642	78%	0.78	S	S	*	*			trans	71.7	139.9	157.9	-66.3	0	0	0	0	119.7
1586	I	28.3	Very low	31.2	Very low	173 Å²	173	138.8 Å²	138.8	89%	0.887	77%	0.774	S	S	*	*			trans	71	134.7	142.5	-63.6	160.1	0	0	0	117.9
1587	G	30.4	Very low	30.9	Very low	67 Å²	67	139.9 Å²	139.9	69%	0.691	76%	0.762	S	S	*	*			trans	161.5	88.7	165.9	0	0	0	0	0	115
1588	D	32.3	Very low	30.8	Very low	160 Å²	160	135.4 Å²	135.4	86%	0.856	74%	0.742	S	S	*	*			trans	-63.5	152.7	132.9	-72.8	-64.1	0	0	0	107.3
1589	P	39.4	Very low	30.5	Very low	108 Å²	108	133.1 Å²	133.1	70%	0.701	73%	0.733	S	S	*	*				-150.2	148.5	99.3	36	-18.1	0	0	0	115.9
1590	N	30.5	Very low	30.3	Very low	154 Å²	154	130 Å²	130	82%	0.824	72%	0.717	S	S	*	*			trans	-79.9	156	135.7	-93.3	-19.2	0	0	0	107.9
1591	D	34.5	Very low	30.4	Very low	136 Å²	136	129.1 Å²	129.1	73%	0.727	70%	0.702	S	S	*	*			trans	69.4	107.2	-178.9	-48.7	-34.3	0	0	0	114.8
1592	N	33	Very low	30.3	Very low	165 Å²	165	127.5 Å²	127.5	88%	0.882	68%	0.684	S	S	*	*				-159.3	156.7	103.3	-106.6	-78.9	0	0	0	112.1
1593	V	31.1	Very low	30.5	Very low	129 Å²	129	129.2 Å²	129.2	78%	0.782	68%	0.684	S	S	*	*			trans	-103.2	152.5	-177.6	171.6	0	0	0	0	110.1
1594	S	29.2	Very low	30.6	Very low	105 Å²	105	121.2 Å²	121.2	73%	0.734	66%	0.664	S	S	*	*			trans	89.4	154.2	169.7	-155.5	0	0	0	0	116.9
1595	I	30.2	Very low	30.8	Very low	158 Å²	158	118.6 Å²	118.6	81%	0.81	67%	0.665	S	S	*	*			trans	69.9	116.2	179.2	-50.2	174.1	0	0	0	113.7
1596	V	31.1	Very low	31	Very low	109 Å²	109	120.8 Å²	120.8	66%	0.661	67%	0.669	S	S	*	*			cis	-153.9	152.1	-4.7	110.8	0	0	0	0	111.1	Q1598	V1596-Q1598 HydrophobicContact CG1-CB 4.17Å
1597	N	26.7	Very low	31.5	Very low	96 Å²	96	117.7 Å²	117.7	51%	0.513	66%	0.66	S	S	.	*			trans	-102.6	99.2	174.8	-79.5	-29.3	0	0	0	112.2	L1413	L1413-N1597 HydrophobicContact CD2-CB 3.89Å; L1413-N1597 HydrophobicContact CG-CB 4.31Å
1598	Q	29.2	Very low	31.6	Very low	63 Å²	63	119.5 Å²	119.5	29%	0.294	66%	0.662	S	S	.	*			trans	-166.4	82.9	-177.2	-128.1	148.6	-57.8	0	0	122.5	K1416 L1420 V1596	K1416-Q1598 HydrophobicContact CB-CG 4.4Å; K1416-Q1598 WeakPolarHBondContact O-CG 3.36Å; K1416-Q1598 PolarHBondContact O-NE2 2.88Å; L1420-Q1598 HydrophobicContact CB-CG 4.21Å; L1420-Q1598 HydrophobicContact CD1-CB 3.67Å; L1420-Q1598 HydrophobicContact CD1-CG 3.78Å; L1420-Q1598 HydrophobicContact CG-CB 4.29Å; L1420-Q1598 HydrophobicContact CG-CG 3.87Å; V1596-Q1598 HydrophobicContact CG1-CB 4.17Å
1599	I	28.6	Very low	31.6	Very low	90 Å²	90	117.4 Å²	117.4	46%	0.462	66%	0.66	S	S	.	*			trans	-170.3	124.3	143.6	-102.8	165	0	0	0	115.3	L1417 L1420 K1421	L1417-I1599 VanDerWaalsContact C-CA 3.44Å; L1417-I1599 VanDerWaalsContact CB-C 3.41Å; L1417-I1599 VanDerWaalsContact CG-N 3.25Å; L1417-I1599 VanDerWaalsContact O-CA 3.32Å; L1417-I1599 WeakPolarHBondContact O-CA 3.45Å; L1420-I1599 HydrophobicContact CB-CD1 4.38Å; L1420-I1599 HydrophobicContact CB-CG1 4.06Å; K1421-I1599 HydrophobicContact CB-CG1 4.27Å
1600	K	30.1	Very low	31.3	Very low	110 Å²	110	124 Å²	124	48%	0.478	67%	0.671	S	S	.	*			trans	133	140.4	-167.3	-96.7	-177.6	152.4	-140.9	0	117.7	H1414 L1417 E1418	H1414-K1600 CarbonylContact C-O 3.48Å; H1414-K1600 PolarHBondContact NE2-NZ 3.13Å; L1417-K1600 VanDerWaalsContact C-N 3.29Å; L1417-K1600 CarbonylContact C-O 3.53Å; L1417-K1600 WeakPolarHBondContact CA-O 3.48Å; L1417-K1600 HydrophobicContact CB-CB 4.08Å; L1417-K1600 WeakPolarHBondContact CB-O 3.33Å; L1417-K1600 HydrophobicContact CD2-CB 3.9Å; E1418-K1600 VanDerWaalsContact N-N 3.12Å; E1418-K1600 PolarHBondContact N-O 3.08Å; E1418-K1600 VanDerWaalsContact OE2-C 3.29Å; E1418-K1600 WeakPolarHBondContact OE2-CA 3.38Å
1601	Q	30.5	Very low	31.2	Very low	92 Å²	92	126.2 Å²	126.2	43%	0.43	68%	0.676	S	S	.	*			trans	86.3	95.5	178.7	-50.5	174.2	20.7	0	0	121.1	H1414 E1418	H1414-Q1601 VanDerWaalsContact ND1-CB 3.34Å; H1414-Q1601 WeakPolarHBondContact ND1-CB 3.31Å; H1414-Q1601 VanDerWaalsContact O-CA 3.29Å; H1414-Q1601 WeakPolarHBondContact O-CA 3.5Å; H1414-Q1601 VanDerWaalsContact O-CB 3.26Å; H1414-Q1601 WeakPolarHBondContact O-CB 3.46Å; E1418-Q1601 VanDerWaalsContact CB-O 3.3Å; E1418-Q1601 WeakPolarHBondContact CB-O 3.44Å; E1418-Q1601 PolarHBondContact OE2-N 3.16Å
1602	R	30.1	Very low	31.2	Very low	129 Å²	129	124.9 Å²	124.9	49%	0.487	68%	0.678	S	S	.	*			cis	-144.6	149.5	3.5	-53.6	73.7	-165.6	-174.1	3.8	110.8	E1415 E1418	E1415-R1602 IonicContact OE1-CZ 3.11Å; E1415-R1602 IonicContact OE1-NH1 2.69Å; E1415-R1602 PolarHBondContact OE1-NH1 3.26Å; E1415-R1602 IonicContact OE1-NH2 3.92Å; E1415-R1602 PolarHBondContact OE1-NH2 2.82Å; E1415-R1602 VanDerWaalsContact OE1-NH2 3.12Å; E1418-R1602 WeakPolarHBondContact OE1-CA 3.4Å; E1418-R1602 PolarHBondContact OE1-N 3.03Å
1603	L	30.9	Very low	31.2	Very low	139 Å²	139	122.8 Å²	122.8	73%	0.728	67%	0.67	S	S	*	*			trans	-119	121	133.5	-83.6	178.6	0	0	0	110.6	E1418 M1422	E1418-L1603 PolarHBondContact OE1-N 3.29Å; M1422-L1603 HydrophobicContact CE-CD2 3.77Å; M1422-L1603 HydrophobicContact CE-CG 4.04Å
1604	G	32.3	Very low	31.1	Very low	54 Å²	54	127.5 Å²	127.5	56%	0.557	67%	0.674	S	S	*	*			trans	-160.8	123.7	176.4	0	0	0	0	0	111.1
1605	I	31.3	Very low	31.4	Very low	158 Å²	158	127.8 Å²	127.8	81%	0.81	68%	0.676	S	S	*	*			trans	-140.3	112.6	-177.2	-64.9	177.9	0	0	0	105.1
1606	I	31.5	Very low	31.5	Very low	142 Å²	142	124.4 Å²	124.4	73%	0.728	67%	0.672	S	S	*	*			cis	73.2	138.9	47.5	-57	176.7	0	0	0	110.9
1607	P	38.7	Very low	31.7	Very low	108 Å²	108	125.2 Å²	125.2	70%	0.701	68%	0.677	S	S	*	*			cis	-131.1	-174.6	-2	28.5	-5.4	0	0	0	115.9
1608	S	31.7	Very low	32.1	Very low	104 Å²	104	126 Å²	126	73%	0.727	69%	0.69	S	S	*	*			trans	106.5	110.8	137.6	-57.6	0	0	0	0	120.4
1609	S	33.8	Very low	32.5	Very low	117 Å²	117	127.6 Å²	127.6	82%	0.818	71%	0.708	S	S	*	*				-163.9	104.1	105.2	-85.2	0	0	0	0	114.9
1610	R	31.9	Very low	32.9	Very low	246 Å²	246	128.7 Å²	128.7	93%	0.928	72%	0.724	S	S	*	*			trans	39.4	108.5	143.7	-62.5	179.1	175.5	180	-1	119.7
1611	Q	29.8	Very low	33.5	Very low	200 Å²	200	129.5 Å²	129.5	94%	0.935	74%	0.74	S	S	*	*			trans	-95.1	160.5	135.5	-79.5	-173.2	-10.9	0	0	111.1
1612	S	33	Very low	33.8	Very low	109 Å²	109	129.5 Å²	129.5	76%	0.762	75%	0.751	S	S	*	*			trans	-132.4	150.2	165.1	-158.1	0	0	0	0	104.8
1613	V	32.6	Very low	34.1	Very low	120 Å²	120	129.6 Å²	129.6	73%	0.727	77%	0.765	S	S	*	*			cis	-152.5	157.3	47.3	174.1	0	0	0	0	111.1
1614	R	30.4	Very low	34.6	Very low	229 Å²	229	128.7 Å²	128.7	86%	0.864	77%	0.768	S	S	*	*			trans	-14.4	147.4	160.5	-54.3	165.5	179.1	175.2	-2.8	116.9
1615	S	34.1	Very low	35.1	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	78%	0.776	S	S	*	*				-166.1	141.6	56.2	31.2	0	0	0	0	110.8
1616	A	32.9	Very low	35.3	Very low	88 Å²	88	128.9 Å²	128.9	73%	0.727	77%	0.772	S	S	*	*				63	132	77.7	0	0	0	0	0	114
1617	T	34.8	Very low	35.4	Very low	125 Å²	125	126.7 Å²	126.7	77%	0.767	77%	0.77	S	S	*	*			cis	-168.7	156.8	7.7	3.9	0	0	0	0	112.6
1618	S	36	Very low	35.1	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	77%	0.77	S	S	*	*			trans	58.6	153.2	155.1	51.7	0	0	0	0	120.2
1619	S	36.9	Very low	35.2	Very low	97 Å²	97	126.6 Å²	126.6	68%	0.678	77%	0.771	S	S	*	*			cis	-167.1	135.7	-10.9	43	0	0	0	0	107.3
1620	S	38.1	Very low	35.1	Very low	112 Å²	112	125.4 Å²	125.4	78%	0.783	77%	0.768	S	S	*	*				58.3	140.6	77.8	-41.3	0	0	0	0	114.8
1621	P	42.5	Very low	35.4	Very low	128 Å²	128	119.4 Å²	119.4	83%	0.831	76%	0.762	S	S	*	*			cis	-116	-143.6	-0.1	40.6	-22.4	0	0	0	111.4
1622	S	36.1	Very low	35.8	Very low	92 Å²	92	114.3 Å²	114.3	64%	0.643	75%	0.746	S	S	*	*			cis	-162.4	134.2	0.3	44.4	0	0	0	0	114.3
1623	T	36.1	Very low	35.7	Very low	130 Å²	130	118.3 Å²	118.3	80%	0.798	75%	0.749	S	S	*	*			trans	46.6	127.4	144.2	52.1	0	0	0	0	125.5
1624	P	41.7	Very low	35.6	Very low	120 Å²	120	117.3 Å²	117.3	78%	0.779	75%	0.748	S	S	*	*			trans	-91.7	-156.8	159.8	42.9	-37.1	0	0	0	111.2
1625	P	42.7	Very low	35.6	Very low	111 Å²	111	114 Å²	114	72%	0.721	75%	0.747	S	S	*	*			cis	-144.8	-150.7	5.4	45.3	-22.5	0	0	0	116.5
1626	S	35.6	Very low	35.6	Very low	106 Å²	106	113 Å²	113	74%	0.741	74%	0.739	S	S	*	*			trans	81.7	150.5	158.3	75.4	0	0	0	0	119.9
1627	S	34.3	Very low	35.6	Very low	96 Å²	96	114 Å²	114	67%	0.671	74%	0.741	S	S	*	*			cis	-173.2	151.1	-19.5	49.6	0	0	0	0	115
1628	S	32.3	Very low	35.7	Very low	100 Å²	100	112.8 Å²	112.8	70%	0.699	74%	0.735	S	S	*	*			trans	69.4	156.2	141.2	70.6	0	0	0	0	124.1
1629	S	33	Very low	35.5	Very low	109 Å²	109	112.5 Å²	112.5	76%	0.762	73%	0.729	S	S	*	*			trans	69.9	132.9	167.9	73.2	0	0	0	0	117.1
1630	A	32.4	Very low	35.2	Very low	92 Å²	92	116.7 Å²	116.7	76%	0.76	74%	0.735	S	S	*	*			cis	74.1	150.2	8.7	0	0	0	0	0	117.3
1631	P	38	Very low	34.6	Very low	121 Å²	121	116 Å²	116	79%	0.786	73%	0.73	S	S	*	*			cis	-125.8	-120.4	-21.9	38.6	-19	0	0	0	110.1
1632	P	39.1	Very low	33.9	Very low	93 Å²	93	120.5 Å²	120.5	60%	0.604	73%	0.732	S	S	*	*				-121.8	175.7	-59.1	39.8	-25.5	0	0	0	115
1633	K	30.8	Very low	33.6	Very low	192 Å²	192	122.5 Å²	122.5	84%	0.835	74%	0.74	S	S	*	*			trans	39.7	133.5	141.5	-63.2	161.9	-173.2	174.5	0	120.8
1634	S	30.7	Very low	33.1	Very low	99 Å²	99	121.1 Å²	121.1	69%	0.692	74%	0.736	S	S	*	*				168.2	157.3	94.1	56	0	0	0	0	114.6
1635	L	30.1	Very low	32.4	Very low	161 Å²	161	123.6 Å²	123.6	84%	0.843	74%	0.737	S	S	*	*			trans	64.2	147.2	160.7	-61.5	153	0	0	0	118
1636	S	32.6	Very low	31.6	Very low	87 Å²	87	124.3 Å²	124.3	61%	0.608	74%	0.743	S	S	*	*			cis	-168.4	132.3	-19	48.7	0	0	0	0	113.4
1637	S	33.3	Very low	31.7	Very low	110 Å²	110	124 Å²	124	77%	0.769	74%	0.741	S	S	*	*			trans	67.3	172.2	152.4	85	0	0	0	0	117.3
1638	P	38.2	Very low	31.8	Very low	99 Å²	99	127 Å²	127	64%	0.643	75%	0.748	S	S	*	*			cis	-132.5	164.4	-2.5	40.3	-24	0	0	0	117
1639	T	31.8	Very low	31.5	Very low	108 Å²	108	127.5 Å²	127.5	66%	0.663	75%	0.752	S	S	*	*			trans	61.3	127.2	143.9	48.6	0	0	0	0	123.7
1640	K	29.5	Very low	31.3	Very low	184 Å²	184	131 Å²	131	80%	0.8	76%	0.76	S	S	*	*				65.1	107.2	129	-64.7	175.7	-179.7	-179.4	0	117.8
1641	S	26.3	Very low	31	Very low	98 Å²	98	129.3 Å²	129.3	69%	0.685	75%	0.752	S	S	*	*				70.5	107.9	68.2	78.6	0	0	0	0	115.2
1642	Y	27	Very low	30.8	Very low	223 Å²	223	135.4 Å²	135.4	88%	0.875	76%	0.761	S	S	*	*				-158.8	154.4	110.4	-132.8	-108.2	0	0	0	110.8
1643	V	30.5	Very low	30.7	Very low	134 Å²	134	134.9 Å²	134.9	81%	0.812	77%	0.772	S	S	*	*			trans	-88.7	125.7	164.3	171.1	0	0	0	0	107.4
1644	S	26	Very low	31	Very low	100 Å²	100	131.1 Å²	131.1	70%	0.699	77%	0.771	S	S	*	*			trans	-159.5	151.9	150.3	-150.2	0	0	0	0	113.6
1645	H	27	Very low	31.4	Very low	173 Å²	173	132.5 Å²	132.5	80%	0.801	78%	0.775	S	S	*	*			trans	-35.7	149.8	159.9	-53.3	-114.4	0	0	0	114.6
1646	C	25.8	Very low	31.8	Very low	125 Å²	125	129.2 Å²	129.2	85%	0.845	77%	0.771	S	S	*	*				-162.1	146.9	119.5	-126.9	0	0	0	0	114
1647	S	36.6	Very low	31.9	Very low	100 Å²	100	130.2 Å²	130.2	70%	0.699	78%	0.778	S	S	*	*			trans	-102.6	161.4	155.2	-54.1	0	0	0	0	108.3
1648	L	37	Very low	32.1	Very low	159 Å²	159	129.7 Å²	129.7	83%	0.832	78%	0.775	S	S	*	*			trans	65.3	154.1	-178.9	-63.3	77.2	0	0	0	115.2
1649	S	26.7	Very low	32	Very low	111 Å²	111	131.7 Å²	131.7	78%	0.776	78%	0.775	S	S	*	*				172.8	78.4	107.1	63	0	0	0	0	115.5
1650	I	27.1	Very low	32.1	Very low	181 Å²	181	133.1 Å²	133.1	93%	0.928	77%	0.774	S	S	*	*	S	Bend	trans	-147.4	113.9	143.8	-50.3	-179.7	0	0	0	106.8
1651	G	27.6	Very low	32.4	Very low	58 Å²	58	130.6 Å²	130.6	60%	0.598	77%	0.765	S	S	*	*			cis	-172.3	176.1	-8.8	0	0	0	0	0	112.8
1652	Y	33.3	Very low	32.8	Very low	248 Å²	248	131.8 Å²	131.8	97%	0.973	76%	0.76	S	S	*	*			trans	74.9	119.9	169.8	-56.5	-80.3	0	0	0	120.9
1653	G	36.7	Very low	33.2	Very low	82 Å²	82	130.8 Å²	130.8	85%	0.845	76%	0.755	S	S	*	*			trans	143	95.1	149.9	0	0	0	0	0	120.4
1654	S	38.1	Very low	33.4	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	75%	0.752	S	S	*	*			trans	-40	166.7	164.9	-58.8	0	0	0	0	119.4
1655	T	37.5	Very low	34.1	Very low	127 Å²	127	132.8 Å²	132.8	78%	0.779	75%	0.754	S	S	*	*			cis	-176.4	152.5	-5.5	27.9	0	0	0	0	112.5
1656	A	38.3	Very low	34.4	Very low	93 Å²	93	129.8 Å²	129.8	77%	0.769	75%	0.753	S	S	*	*			trans	62.9	153.3	149.4	0	0	0	0	0	121.3
1657	S	36.2	Very low	35.3	Very low	108 Å²	108	129.2 Å²	129.2	76%	0.755	75%	0.748	S	S	*	*			cis	-169.7	157.5	-15.8	-90.3	0	0	0	0	112.6
1658	S	37.2	Very low	35.3	Very low	99 Å²	99	130.1 Å²	130.1	69%	0.692	75%	0.754	S	S	*	*			trans	65.7	153.5	155.7	-71.5	0	0	0	0	121.3
1659	E	35.6	Very low	35.3	Very low	141 Å²	141	126.8 Å²	126.8	66%	0.659	75%	0.749	S	S	*	*			cis	-168.4	151	-10.6	-110.8	172.3	91	0	0	114.8
1660	Q	35.2	Very low	35.8	Very low	137 Å²	137	127.1 Å²	127.1	64%	0.64	75%	0.747	S	S	*	*			trans	59.8	154.5	146.2	-60.6	-165.8	39.9	0	0	122.9
1661	Q	35.6	Very low	36.1	Very low	131 Å²	131	124.5 Å²	124.5	61%	0.612	74%	0.739	S	S	*	*			cis	-170.7	152.6	-14.7	-109.1	-177	23.5	0	0	115.5
1662	Q	34.8	Very low	36.5	Very low	123 Å²	123	127 Å²	127	58%	0.575	75%	0.748	S	S	*	*			trans	66.8	154.6	145.3	-65	-172.9	35.1	0	0	121.9
1663	R	33.8	Very low	36.4	Very low	202 Å²	202	119.1 Å²	119.1	76%	0.762	73%	0.729	S	S	*	*			cis	-167.7	142.5	-6.1	-113.4	178.7	-174.8	163.9	4	114.5
1664	E	34.4	Very low	36.2	Very low	163 Å²	163	124.2 Å²	124.2	76%	0.762	73%	0.728	S	S	*	*			trans	47.7	162.9	131.8	-60.8	-66	96	0	0	125.1
1665	P	40.8	Very low	36	Very low	113 Å²	113	125.7 Å²	125.7	73%	0.734	73%	0.726	S	S	*	*			cis	-142.1	-166.4	-40	41.8	-22.4	0	0	0	116.6
1666	S	33.6	Very low	35.9	Very low	111 Å²	111	124.4 Å²	124.4	78%	0.776	72%	0.722	S	S	*	*			trans	-136	-163.4	177.2	71.8	0	0	0	0	112.8
1667	P	44.8	Very low	35.7	Very low	113 Å²	113	127.3 Å²	127.3	73%	0.734	73%	0.725	S	S	*	*			cis	-152.3	-146.6	34.4	46.3	-21.6	0	0	0	117.5
1668	S	36.5	Very low	36.2	Very low	118 Å²	118	127.5 Å²	127.5	83%	0.825	72%	0.724	S	S	*	*			trans	85.7	167.4	166.4	81.2	0	0	0	0	118.8
1669	A	38.3	Very low	36.1	Very low	90 Å²	90	126.6 Å²	126.6	74%	0.744	72%	0.722	S	S	*	*			cis	-163.5	-178.9	8.7	0	0	0	0	0	111.5
1670	T	36.2	Very low	36.3	Very low	117 Å²	117	126.8 Å²	126.8	72%	0.718	73%	0.733	S	S	*	*			cis	-172.7	116.8	-41.9	-73.7	0	0	0	0	114.5
1671	T	34.1	Very low	36.4	Very low	127 Å²	127	123.6 Å²	123.6	78%	0.779	74%	0.737	S	S	*	*			trans	65.3	149.1	153.8	59.3	0	0	0	0	128.3
1672	S	35.1	Very low	36.4	Very low	111 Å²	111	123.6 Å²	123.6	78%	0.776	75%	0.745	S	S	*	*			trans	86.8	154.3	144.9	78.4	0	0	0	0	121.2
1673	S	32.4	Very low	36.5	Very low	82 Å²	82	124.2 Å²	124.2	57%	0.573	75%	0.752	S	S	*	*			cis	179.5	159.8	-30.7	53.7	0	0	0	0	112.6
1674	F	32	Very low	36.4	Very low	188 Å²	188	122.2 Å²	122.2	83%	0.825	75%	0.751	S	S	*	*			trans	70	159.9	166.9	-53.6	-63	0	0	0	117.8
1675	L	33.3	Very low	36.4	Very low	146 Å²	146	120.8 Å²	120.8	76%	0.764	75%	0.748	S	S	*	*			cis	-163	165.8	-19.4	-116.2	166.2	0	0	0	112.1
1676	S	36.6	Very low	35.9	Very low	99 Å²	99	126 Å²	126	69%	0.692	78%	0.777	S	S	*	*			trans	58.5	108.3	150.4	58.1	0	0	0	0	124.1
1677	D	33.6	Very low	36.1	Very low	154 Å²	154	126.7 Å²	126.7	82%	0.824	78%	0.777	S	S	*	*				1	170.7	117.3	-89.8	-42.7	0	0	0	122.2
1678	P	45.9	Very low	35.6	Very low	112 Å²	112	127.4 Å²	127.4	73%	0.727	78%	0.78	S	S	*	*			cis	-142	-166.9	-19.6	35.2	-13.2	0	0	0	115.2
1679	A	36.3	Very low	35.5	Very low	81 Å²	81	127.9 Å²	127.9	67%	0.669	78%	0.777	S	S	*	*			trans	124.3	119.8	130.3	0	0	0	0	0	122
1680	T	38.3	Very low	35.4	Very low	145 Å²	145	130.2 Å²	130.2	89%	0.89	78%	0.779	S	S	*	*			trans	54.9	137.1	140.8	51.9	0	0	0	0	124.7
1681	G	38.3	Very low	35.3	Very low	69 Å²	69	131 Å²	131	71%	0.711	78%	0.783	S	S	*	*			trans	142.7	51.6	159.4	0	0	0	0	0	116.6
1682	V	36.3	Very low	35.4	Very low	131 Å²	131	131.3 Å²	131.3	79%	0.794	78%	0.783	S	S	*	*				57	139.9	96.4	-154.2	0	0	0	0	116.8
1683	I	35.1	Very low	35.4	Very low	137 Å²	137	132.7 Å²	132.7	70%	0.703	78%	0.784	S	S	*	*			trans	101.8	99.7	163.5	-53.2	-172.9	0	0	0	117.9
1684	E	33	Very low	35.7	Very low	159 Å²	159	136.6 Å²	136.6	74%	0.743	80%	0.8	S	S	*	*				42.9	154.1	125.5	-53.4	-168.6	118.5	0	0	123.1
1685	N	33.2	Very low	36	Very low	133 Å²	133	132.3 Å²	132.3	71%	0.711	80%	0.798	S	S	*	*			cis	-167.2	145.6	-20.5	-98.8	-20.4	0	0	0	109
1686	V	31.9	Very low	36.2	Very low	222 Å²	222	131.1 Å²	131.1	100%	1.345	80%	0.801	S	S	*	*			trans	176.3	0	139.4	149.5	0	0	0	0	108.8

Retrieved 1,686 of 1,686 residues in 1993.1 ms (Link to these results)

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