A0A087XSN5_POEFO Loading...

GRB10 interacting GYF protein 1

AlphaFold DB , UniProt , Accession A0A087XSN5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,151 aa.

						>A0A087XSN5_POEFO|A0A087XSN5
MTAETLNFGPEWLRALSSGGSVTSPPPSPAMPKYKLAEYRYGREEMLALYIKDNKVPEDMQDKEFAAILQDEPMQPLALVPLTEEEQRNFSMSVNSAAVLRLMGKGAGGPAPAGVVRGRGAARGGRGNAGRGRGEGGFYQRSIEDTEVGFGRNVREIHRSQSWDDRGERRFEKPLRREVGRPSFEESSGPVGPARKEYTRADSDNWRTLREEQEEDEGEPGTNWRLCGPRRDGLKNMDIDCGFADGGPRSAGWRDHSGPGEGRRRKFDFDFRDSEGHGAGRRRAGSEGLEDDRDGLPEWCTDEEDGEMGTFDSSGAFMPLKKGGKETILEEDLDFKGIEDEDEDDGFLDAERNNGDGDKDKGEQNLESKDSLPAAGEEKMKPAPPPAHCAPPSLELQPGSAGQVMENSQMNNSHSVKAGSASADVSDLASVGGSKAQLSPSVAAGTAAPLLPPSGGDPEDDEGLKHLQQEAEKMVASLQDTSMEEECFTHSLQQQQESRNTAAALPLSHEAAMKWFYKDPQGEIQGPFTTVEMCEWFQAGYFTMTLLVKRGCDEGFQPLGDVIKMWGRVPFAPGPSPPPLLGNLDQERLKKQQELATAALYQQLQQQQLFQLINRFPLSFPLECSEQGMMPSMNRSMSVPDTGPLWDMHTSASQSSGGEASLWDLTMNPNTQGPTLEQLQKLQERRDAELRAKRRKQVRRSSFNDQKSQSLLNERQPVCLLFWTRLKKIEKFYVVYQYKSMTSYYDNRKDDHFMLHLTFLLVDLNLKLVVGHTKSILWLQMGPNSYFKAYHLFRQQRQQQELLMKLLQQQQSSQQQGPAVGGSGWSSSPSSGLSKAGKSLTMLEMQEAERILSEFLLLARMWDVVGNRTHTDASCLIFASQHPGLSMGSSSMGGQWADGVGMWGGPGGLEGKGGSGGSSSSMGMWDEAVKNQAGLRGNTNNNLGLKNSRSSPSLTDQYMMRRKRTEDEEKLLKLLQGMKPQDGFTTWCEQMLHALNTSANNSSSSLDVATIVAYLKEVESPYAVLDFIRSYLGDTVEAKEFAKQFLERRAKQKANQQRQQQQLSKEVGGLNMNFPLQFHFKDSMRGMNPSTLQSMFQANHMGKAGLYDNQGGKMKKKPPMMLHSDPSILGYSFHNTGECLSMNELEMVEDY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	46.4	Very low	246 Å²	246	139.6 Å²	139.6	100%	1.212	77%	0.767	S	S	*	*				0	137.2	0	-72.5	151.6	173.4	0	0	106.8	A3	M1-A3 PolarHBondContact O-N 3.5Å
2	T	35.7	Very low	47.2	Very low	140 Å²	140	141.9 Å²	141.9	86%	0.859	76%	0.755	S	S	*	*			trans	-68.3	118.4	-176.9	40.9	0	0	0	0	109.7
3	A	39.3	Very low	47	Very low	88 Å²	88	138.7 Å²	138.7	73%	0.727	74%	0.738	S	S	*	*				81.7	113.2	71.7	0	0	0	0	0	111.1	M1	M1-A3 PolarHBondContact O-N 3.5Å
4	E	49	Very low	48.2	Very low	199 Å²	199	137.4 Å²	137.4	93%	0.93	72%	0.717	S	S	*	*			trans	-76.1	143.6	-177.3	-59.3	159.8	122.2	0	0	110.7
5	T	47.5	Very low	48.3	Very low	132 Å²	132	132.9 Å²	132.9	81%	0.81	71%	0.708	S	S	*	*			trans	-122.9	128.3	170	52.1	0	0	0	0	110
6	L	45.3	Very low	48.1	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	71%	0.71	S	S	*	*			trans	-75.1	133.4	-167	-69.7	160.5	0	0	0	112.8	F8	L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 HydrophobicContact CB-CD2 3.82Å; L6-F8 HydrophobicContact CB-CE2 4.05Å; L6-F8 HydrophobicContact CD1-CE2 4.42Å; L6-F8 PolarHBondContact O-N 2.94Å
7	N	48.2	Very low	48.1	Very low	134 Å²	134	131.6 Å²	131.6	72%	0.717	71%	0.711	S	S	*	*			trans	-77.3	71.8	179.3	-77.1	-67.5	0	0	0	112.8
8	F	40.2	Very low	48	Very low	188 Å²	188	129.9 Å²	129.9	83%	0.825	71%	0.71	S	S	*	*			trans	-104.7	102.9	169.9	-76.6	-78.1	0	0	0	111.4	L6	L6-F8 VanDerWaalsContact C-N 3.32Å; L6-F8 HydrophobicContact CB-CD2 3.82Å; L6-F8 HydrophobicContact CB-CE2 4.05Å; L6-F8 HydrophobicContact CD1-CE2 4.42Å; L6-F8 PolarHBondContact O-N 2.94Å
9	G	58.5	Low	47.8	Very low	39 Å²	39	127.3 Å²	127.3	40%	0.402	72%	0.716	S	S	.	*	S	Bend	trans	160.7	142.8	171.7	0	0	0	0	0	113.4	R14	G9-R14 PolarHBondContact O-NH2 2.78Å
10	P	64.3	Low	47.3	Very low	76 Å²	76	124.5 Å²	124.5	49%	0.494	72%	0.717	S	S	.	*			trans	-63.1	145.6	175.8	29.3	-35.3	0	0	0	110.9	W12 L13	P10-W12 PolarHBondContact O-N 2.79Å; P10-L13 WeakPolarHBondContact O-CB 3.47Å; P10-L13 PolarHBondContact O-N 2.96Å; P10-L13 VanDerWaalsContact O-N 3.16Å
11	E	43.3	Very low	46.7	Very low	144 Å²	144	123.6 Å²	123.6	67%	0.673	72%	0.719	S	S	*	*	H	α-helix	trans	-62.9	-35	-161.1	-171.3	171.1	-175.9	0	0	115.1	L13 R14 A15	E11-L13 PolarHBondContact O-N 3.4Å; E11-L13 VanDerWaalsContact O-N 3.16Å; E11-R14 WeakPolarHBondContact O-CB 3.43Å; E11-R14 PolarHBondContact O-N 2.8Å; E11-A15 PolarHBondContact O-N 3.06Å; E11-A15 VanDerWaalsContact O-N 3.16Å
12	W	55.4	Low	46.7	Very low	167 Å²	167	118.1 Å²	118.1	63%	0.633	70%	0.698	S	S	*	*	H	α-helix	trans	-57.9	-30.4	178.3	65.8	-93.2	0	0	0	113.2	P10 L16	P10-W12 PolarHBondContact O-N 2.79Å; W12-L16 HydrophobicContact CE3-CD1 4.16Å; W12-L16 HydrophobicContact CZ3-CD1 4.44Å; W12-L16 WeakPolarHBondContact O-CG 3.24Å; W12-L16 PolarHBondContact O-N 3.1Å
13	L	45	Very low	46.8	Very low	100 Å²	100	117.2 Å²	117.2	52%	0.524	69%	0.693	S	S	.	*	H	α-helix	trans	-76.4	-24.3	179.1	-124.2	160	0	0	0	112.4	P10 E11	P10-L13 WeakPolarHBondContact O-CB 3.47Å; P10-L13 PolarHBondContact O-N 2.96Å; P10-L13 VanDerWaalsContact O-N 3.16Å; E11-L13 PolarHBondContact O-N 3.4Å; E11-L13 VanDerWaalsContact O-N 3.16Å
14	R	62.8	Low	46.7	Very low	120 Å²	120	117.8 Å²	117.8	45%	0.453	69%	0.692	S	S	.	*	H	α-helix	trans	-77	-42.3	170.3	-91.1	176.4	-77.8	118.3	-0.1	111.8	G9 E11 L16 S17	G9-R14 PolarHBondContact O-NH2 2.78Å; E11-R14 WeakPolarHBondContact O-CB 3.43Å; E11-R14 PolarHBondContact O-N 2.8Å; R14-L16 PolarHBondContact O-N 3.27Å; R14-S17 PolarHBondContact O-N 3.13Å; R14-S17 VanDerWaalsContact O-N 3.08Å
15	A	50	Low	46.5	Very low	70 Å²	70	114.2 Å²	114.2	58%	0.579	69%	0.686	S	S	*	*	H	α-helix	trans	-60.8	-29.9	-177.3	0	0	0	0	0	113.8	E11 S18	E11-A15 PolarHBondContact O-N 3.06Å; E11-A15 VanDerWaalsContact O-N 3.16Å; A15-S18 PolarHBondContact O-OG 3.17Å
16	L	46.1	Very low	46.1	Very low	140 Å²	140	113 Å²	113	73%	0.733	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-19.2	177.5	-65.8	172.2	0	0	0	113.9	W12 R14	W12-L16 HydrophobicContact CE3-CD1 4.16Å; W12-L16 HydrophobicContact CZ3-CD1 4.44Å; W12-L16 WeakPolarHBondContact O-CG 3.24Å; W12-L16 PolarHBondContact O-N 3.1Å; R14-L16 PolarHBondContact O-N 3.27Å
17	S	48.2	Very low	45.9	Very low	105 Å²	105	111.9 Å²	111.9	73%	0.734	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-14.6	-175.1	-166.1	0	0	0	0	113.7	R14 G19	R14-S17 PolarHBondContact O-N 3.13Å; R14-S17 VanDerWaalsContact O-N 3.08Å; S17-G19 VanDerWaalsContact C-N 3.31Å; S17-G19 PolarHBondContact O-N 3.03Å
18	S	45.5	Very low	45.6	Very low	100 Å²	100	110.6 Å²	110.6	70%	0.699	68%	0.683	S	S	*	*			trans	-89.2	53.7	179	56.1	0	0	0	0	112.8	A15	A15-S18 PolarHBondContact O-OG 3.17Å
19	G	44.8	Very low	45.7	Very low	80 Å²	80	107.3 Å²	107.3	83%	0.825	68%	0.681	S	S	*	*			trans	-84.8	111.8	178.5	0	0	0	0	0	112.7	S17	S17-G19 VanDerWaalsContact C-N 3.31Å; S17-G19 PolarHBondContact O-N 3.03Å
20	G	37.3	Very low	44.8	Very low	71 Å²	71	110.2 Å²	110.2	73%	0.732	70%	0.701	S	S	*	*			trans	-139.7	24.8	-162.8	0	0	0	0	0	119
21	S	34.7	Very low	43.6	Very low	107 Å²	107	113.9 Å²	113.9	75%	0.748	71%	0.714	S	S	*	*			trans	62.4	138.5	167.2	-153.6	0	0	0	0	119.7
22	V	39.2	Very low	43.6	Very low	130 Å²	130	112.5 Å²	112.5	79%	0.788	72%	0.717	S	S	*	*			trans	41.2	123.2	165.6	-68.1	0	0	0	0	118.9
23	T	38	Very low	43.2	Very low	121 Å²	121	114.1 Å²	114.1	74%	0.742	73%	0.729	S	S	*	*	S	Bend	cis	-145.8	155.4	27.3	54.6	0	0	0	0	111.3
24	S	37.1	Very low	43	Very low	101 Å²	101	118.8 Å²	118.8	71%	0.706	74%	0.741	S	S	*	*			trans	47	124.8	167.9	57.3	0	0	0	0	119
25	P	45.2	Very low	42.1	Very low	123 Å²	123	123.1 Å²	123.1	80%	0.799	76%	0.762	S	S	*	*			trans	-66.1	131.8	170.2	29.2	-33.2	0	0	0	110.3
26	P	40.2	Very low	41.9	Very low	107 Å²	107	124.5 Å²	124.5	70%	0.695	76%	0.76	S	S	*	*			trans	-64.8	151.6	167	29.5	-34.2	0	0	0	109.5	S28	P26-S28 PolarHBondContact O-N 3.06Å; P26-S28 VanDerWaalsContact O-N 3.07Å
27	P	39.5	Very low	42.4	Very low	127 Å²	127	120.6 Å²	120.6	83%	0.825	75%	0.748	S	S	*	*			trans	-62.8	115.4	178.1	26.2	-33.7	0	0	0	109.7
28	S	41.8	Very low	42.5	Very low	106 Å²	106	123.7 Å²	123.7	74%	0.741	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-54.8	132.1	177.7	-58.5	0	0	0	0	110.3	P26 A30	P26-S28 PolarHBondContact O-N 3.06Å; P26-S28 VanDerWaalsContact O-N 3.07Å; S28-A30 PolarHBondContact O-N 2.71Å
29	P	41.8	Very low	42.9	Very low	119 Å²	119	128.8 Å²	128.8	77%	0.773	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-58.2	130.1	169.6	26.4	-33.3	0	0	0	108	M31	P29-M31 PolarHBondContact O-N 2.89Å
30	A	39.8	Very low	43.4	Very low	100 Å²	100	134.6 Å²	134.6	83%	0.826	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-53.9	117.6	-172.6	0	0	0	0	0	110.3	S28	S28-A30 PolarHBondContact O-N 2.71Å
31	M	39.7	Very low	45.1	Very low	154 Å²	154	139.5 Å²	139.5	76%	0.759	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-57.2	137.1	-180	-65.8	-153.7	-58.2	0	0	109.3	P29 K33	P29-M31 PolarHBondContact O-N 2.89Å; M31-K33 PolarHBondContact O-N 3.01Å
32	P	43.5	Very low	47.2	Very low	114 Å²	114	135.8 Å²	135.8	74%	0.74	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-52.9	120	171.6	-24.9	34.3	0	0	0	109	Y34	P32-Y34 PolarHBondContact O-N 2.79Å
33	K	47.3	Very low	49.1	Very low	202 Å²	202	135.8 Å²	135.8	88%	0.878	72%	0.715	S	S	*	*			trans	-54.4	114.7	177.6	-66.5	-176.2	179.3	-176	0	107.6	M31 K35	M31-K33 PolarHBondContact O-N 3.01Å; K33-K35 PolarHBondContact O-N 3.16Å; K33-K35 VanDerWaalsContact O-N 3.16Å
34	Y	40.8	Very low	51.2	Low	198 Å²	198	135.6 Å²	135.6	78%	0.776	71%	0.706	S	S	*	*			trans	-54.7	123.2	-177.8	-99.8	-113.7	0	0	0	108.8	P32 L36	P32-Y34 PolarHBondContact O-N 2.79Å; Y34-L36 WeakPolarHBondContact O-CD2 3.38Å; Y34-L36 PolarHBondContact O-N 3.25Å; Y34-L36 VanDerWaalsContact O-N 3.16Å
35	K	43.6	Very low	53.1	Low	210 Å²	210	132.8 Å²	132.8	91%	0.913	68%	0.682	S	S	*	*			trans	-74.1	107	165.1	-80.8	-161.6	172.7	-168.7	0	107.2	K33	K33-K35 PolarHBondContact O-N 3.16Å; K33-K35 VanDerWaalsContact O-N 3.16Å
36	L	46.7	Very low	54.8	Low	99 Å²	99	132 Å²	132	52%	0.518	67%	0.669	S	S	.	*			trans	-68	154.6	-176	-47.8	176	0	0	0	109.7	Y34 E38 E45	Y34-L36 WeakPolarHBondContact O-CD2 3.38Å; Y34-L36 PolarHBondContact O-N 3.25Å; Y34-L36 VanDerWaalsContact O-N 3.16Å; L36-E38 PolarHBondContact O-N 3.05Å; L36-E45 HydrophobicContact CD1-CG 3.81Å; L36-E45 WeakPolarHBondContact CD1-OE1 3.1Å; L36-E45 HydrophobicContact CD2-CG 3.73Å; L36-E45 HydrophobicContact CG-CG 4.27Å
37	A	54.9	Low	56.7	Low	58 Å²	58	128.2 Å²	128.2	48%	0.479	64%	0.643	S	S	.	*	B	Isolated β-bridge	trans	-78.5	121.9	173.1	0	0	0	0	0	108.2	Y39 R40	A37-Y39 PolarHBondContact O-N 2.95Å; A37-R40 HydrophobicContact CB-CB 4.06Å; A37-R40 PolarHBondContact O-N 3.11Å
38	E	50.3	Low	58.6	Low	171 Å²	171	126 Å²	126	80%	0.799	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-15.8	-161.4	-157	162.1	-156.8	0	0	115.9	L36	L36-E38 PolarHBondContact O-N 3.05Å
39	Y	54.3	Low	60.3	Low	207 Å²	207	126.8 Å²	126.8	81%	0.812	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.4	35.2	174.5	-58.7	-82.2	0	0	0	112.9	A37	A37-Y39 PolarHBondContact O-N 2.95Å
40	R	55.6	Low	62.2	Low	201 Å²	201	124.1 Å²	124.1	76%	0.758	61%	0.605	S	S	*	*	B	Isolated β-bridge	trans	-146.2	95.1	175	-65.5	-174.3	178	-159	-2.8	112.2	A37 G42	A37-R40 HydrophobicContact CB-CB 4.06Å; A37-R40 PolarHBondContact O-N 3.11Å; R40-G42 PolarHBondContact O-N 2.95Å; R40-G42 VanDerWaalsContact O-N 3.15Å
41	Y	73.7	Confident	64	Low	174 Å²	174	124.6 Å²	124.6	68%	0.682	59%	0.593	S	S	*	*			trans	-65.7	109.3	170.1	-50.7	-64.2	0	0	0	111	E45 M46	Y41-E45 WeakPolarHBondContact CA-OE1 3.42Å; Y41-M46 VanDerWaalsContact CB-SD 3.55Å; Y41-M46 HydrophobicContact CD2-SD 4.17Å; Y41-M46 HydrophobicContact CG-SD 4Å
42	G	77.4	Confident	65.5	Low	30 Å²	30	124 Å²	124	31%	0.309	59%	0.586	S	S	.	*			trans	-70	168.9	168.5	0	0	0	0	0	112.8	R40 E44 E45 M46	R40-G42 PolarHBondContact O-N 2.95Å; R40-G42 VanDerWaalsContact O-N 3.15Å; G42-E44 VanDerWaalsContact C-N 3.29Å; G42-E44 PolarHBondContact O-N 3Å; G42-E45 WeakPolarHBondContact CA-OE2 3.06Å; G42-E45 PolarHBondContact N-OE2 3.13Å; G42-E45 WeakPolarHBondContact O-CB 3.28Å; G42-E45 PolarHBondContact O-N 3.26Å; G42-M46 PolarHBondContact O-N 3.32Å
43	R	80.3	Confident	66.8	Low	129 Å²	129	125.1 Å²	125.1	49%	0.487	59%	0.585	S	S	.	*	H	α-helix	trans	-50.7	-47.3	179.9	178.6	-176.5	172.6	-82.4	0.5	112.3	E45 M46 L47 A78	R43-E45 VanDerWaalsContact C-N 3.28Å; R43-E45 PolarHBondContact O-N 3.28Å; R43-M46 PolarHBondContact O-N 2.78Å; R43-L47 HydrophobicContact CG-CD1 3.94Å; R43-L47 WeakPolarHBondContact O-CB 2.85Å; R43-L47 VanDerWaalsContact O-CG 3.28Å; R43-L47 WeakPolarHBondContact O-CG 3.3Å; R43-L47 PolarHBondContact O-N 3.03Å; R43-A78 PolarHBondContact NH2-O 2.93Å
44	E	81.3	Confident	68.2	Low	118 Å²	118	120.6 Å²	120.6	55%	0.551	57%	0.571	S	S	*	*	H	α-helix	trans	-71.8	-22.7	-177.7	-45.1	-40.2	115.7	0	0	113	G42 A48	G42-E44 VanDerWaalsContact C-N 3.29Å; G42-E44 PolarHBondContact O-N 3Å; E44-A48 VanDerWaalsContact O-CB 3.26Å; E44-A48 WeakPolarHBondContact O-CB 3.47Å; E44-A48 PolarHBondContact O-N 3.31Å
45	E	77	Confident	69.8	Low	42 Å²	42	119.8 Å²	119.8	20%	0.196	57%	0.572	C	S	.	*	H	α-helix	trans	-76.5	-46.5	175.8	-61.2	163.3	61.6	0	0	110.4	L36 Y41 G42 R43 L47 A48 L49	L36-E45 HydrophobicContact CD1-CG 3.81Å; L36-E45 WeakPolarHBondContact CD1-OE1 3.1Å; L36-E45 HydrophobicContact CD2-CG 3.73Å; L36-E45 HydrophobicContact CG-CG 4.27Å; Y41-E45 WeakPolarHBondContact CA-OE1 3.42Å; G42-E45 WeakPolarHBondContact CA-OE2 3.06Å; G42-E45 PolarHBondContact N-OE2 3.13Å; G42-E45 WeakPolarHBondContact O-CB 3.28Å; G42-E45 PolarHBondContact O-N 3.26Å; R43-E45 VanDerWaalsContact C-N 3.28Å; R43-E45 PolarHBondContact O-N 3.28Å; E45-L47 PolarHBondContact O-N 3.02Å; E45-A48 PolarHBondContact O-N 2.65Å; E45-A48 VanDerWaalsContact O-N 3.09Å; E45-L49 PolarHBondContact O-N 2.72Å
46	M	81.5	Confident	71.2	Confident	106 Å²	106	111.4 Å²	111.4	52%	0.522	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-35.2	172.9	-67.2	-58	-58.3	0	0	111.9	Y41 G42 R43 L49	Y41-M46 VanDerWaalsContact CB-SD 3.55Å; Y41-M46 HydrophobicContact CD2-SD 4.17Å; Y41-M46 HydrophobicContact CG-SD 4Å; G42-M46 PolarHBondContact O-N 3.32Å; R43-M46 PolarHBondContact O-N 2.78Å; M46-L49 HydrophobicContact SD-CD1 4.41Å
47	L	79.8	Confident	72.7	Confident	28 Å²	28	109.9 Å²	109.9	15%	0.147	53%	0.534	C	S	.	.	H	α-helix	trans	-74.8	-28.5	173.5	-71	174.1	0	0	0	113.2	R43 E45 L49 Y50 P76 A78 L79	R43-L47 HydrophobicContact CG-CD1 3.94Å; R43-L47 WeakPolarHBondContact O-CB 2.85Å; R43-L47 VanDerWaalsContact O-CG 3.28Å; R43-L47 WeakPolarHBondContact O-CG 3.3Å; R43-L47 PolarHBondContact O-N 3.03Å; E45-L47 PolarHBondContact O-N 3.02Å; L47-L49 VanDerWaalsContact C-N 3.26Å; L47-L49 PolarHBondContact O-N 3.04Å; L47-Y50 WeakPolarHBondContact O-CB 3.38Å; L47-Y50 PolarHBondContact O-N 2.91Å; L47-P76 HydrophobicContact CD2-CB 3.57Å; L47-P76 HydrophobicContact CD2-CG 3.94Å; L47-A78 HydrophobicContact CD1-CB 4.43Å; L47-A78 HydrophobicContact CD2-CB 4.4Å; L47-L79 HydrophobicContact CD1-CD2 3.94Å; L47-L79 HydrophobicContact CD1-CG 4.47Å; L47-L79 HydrophobicContact CD2-CD1 4.25Å; L47-L79 HydrophobicContact CD2-CD2 4.22Å; L47-L79 HydrophobicContact CD2-CG 3.89Å
48	A	79.3	Confident	73.5	Confident	81 Å²	81	115 Å²	115	67%	0.669	55%	0.548	S	S	*	.	H	α-helix	trans	-71.9	-18.3	174.2	0	0	0	0	0	113.4	E44 E45 Y50	E44-A48 VanDerWaalsContact O-CB 3.26Å; E44-A48 WeakPolarHBondContact O-CB 3.47Å; E44-A48 PolarHBondContact O-N 3.31Å; E45-A48 PolarHBondContact O-N 2.65Å; E45-A48 VanDerWaalsContact O-N 3.09Å; A48-Y50 VanDerWaalsContact C-N 3.31Å
49	L	77.6	Confident	74.5	Confident	122 Å²	122	113.3 Å²	113.3	64%	0.639	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-14.2	169.9	-63.6	175.1	0	0	0	113	E45 M46 L47 I51	E45-L49 PolarHBondContact O-N 2.72Å; M46-L49 HydrophobicContact SD-CD1 4.41Å; L47-L49 VanDerWaalsContact C-N 3.26Å; L47-L49 PolarHBondContact O-N 3.04Å; L49-I51 PolarHBondContact O-N 2.91Å
50	Y	81	Confident	75.2	Confident	62 Å²	62	107.8 Å²	107.8	24%	0.243	53%	0.527	C	S	.	.			trans	-78.6	101.6	178.3	178.3	-104.1	0	0	0	111.4	L47 A48 K52 P73 M74 P76	L47-Y50 WeakPolarHBondContact O-CB 3.38Å; L47-Y50 PolarHBondContact O-N 2.91Å; A48-Y50 VanDerWaalsContact C-N 3.31Å; Y50-K52 HydrophobicContact CE1-CB 3.81Å; Y50-K52 HydrophobicContact CE1-CG 4.09Å; Y50-K52 PolarHBondContact O-N 2.94Å; Y50-P73 PolarHBondContact OH-O 3.23Å; Y50-M74 WeakPolarHBondContact CE2-O 3.33Å; Y50-P76 HydrophobicContact CD1-CG 4.14Å; Y50-P76 HydrophobicContact CD2-CG 3.65Å; Y50-P76 HydrophobicContact CE2-CG 4.21Å; Y50-P76 HydrophobicContact CG-CG 3.6Å
51	I	79.4	Confident	75.8	Confident	110 Å²	110	103.9 Å²	103.9	56%	0.564	52%	0.517	S	S	*	.			trans	-87.6	105.6	171	-59.3	174.8	0	0	0	107.8	L49 D53 N54	L49-I51 PolarHBondContact O-N 2.91Å; I51-D53 VanDerWaalsContact C-N 3.26Å; I51-D53 PolarHBondContact O-N 3.02Å; I51-N54 HydrophobicContact CB-CB 4.13Å; I51-N54 HydrophobicContact CG2-CB 4.04Å; I51-N54 WeakPolarHBondContact O-CB 3.39Å; I51-N54 PolarHBondContact O-N 3.17Å
52	K	70.3	Confident	76	Confident	143 Å²	143	100.4 Å²	100.4	62%	0.622	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-37.4	-176.4	-170.9	-170.1	173	-165.1	0	113.3	Y50 P73	Y50-K52 HydrophobicContact CE1-CB 3.81Å; Y50-K52 HydrophobicContact CE1-CG 4.09Å; Y50-K52 PolarHBondContact O-N 2.94Å; K52-P73 WeakPolarHBondContact O-CG 3.38Å
53	D	71.8	Confident	75.8	Confident	136 Å²	136	108.4 Å²	108.4	73%	0.727	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	34.4	-173.3	-45.6	-55.1	0	0	0	111.2	I51	I51-D53 VanDerWaalsContact C-N 3.26Å; I51-D53 PolarHBondContact O-N 3.02Å
54	N	75.4	Confident	75.5	Confident	108 Å²	108	110.4 Å²	110.4	58%	0.578	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-71.3	132.9	179.8	-164.4	29.3	0	0	0	110.8	I51	I51-N54 HydrophobicContact CB-CB 4.13Å; I51-N54 HydrophobicContact CG2-CB 4.04Å; I51-N54 WeakPolarHBondContact O-CB 3.39Å; I51-N54 PolarHBondContact O-N 3.17Å
55	K	74.2	Confident	75	Confident	181 Å²	181	109 Å²	109	79%	0.787	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-89.5	144.8	179.4	-63.5	-174.9	179.1	-175	0	110.6
56	V	74.6	Confident	74.9	Confident	33 Å²	33	110 Å²	110	20%	0.2	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-61.2	128.9	171.4	-177.9	0	0	0	0	109.4	M60 Q61 L69	V56-M60 HydrophobicContact CG1-CB 3.84Å; V56-Q61 HydrophobicContact CB-CG 4.33Å; V56-Q61 HydrophobicContact CG1-CG 3.99Å; V56-Q61 PolarHBondContact O-NE2 3.05Å; V56-L69 HydrophobicContact CB-CD1 4.45Å; V56-L69 HydrophobicContact CG1-CD1 3.61Å; V56-L69 HydrophobicContact CG1-CD2 3.81Å; V56-L69 HydrophobicContact CG1-CG 4.34Å; V56-L69 HydrophobicContact CG2-CD1 3.93Å; V56-L69 HydrophobicContact CG2-CD2 4.2Å; V56-L69 HydrophobicContact CG2-CG 4.42Å
57	P	77.7	Confident	74.6	Confident	68 Å²	68	109.4 Å²	109.4	44%	0.442	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-53.8	143.8	173.4	-25.9	35.3	0	0	0	111.7	D59 M60	P57-D59 PolarHBondContact O-N 3.12Å; P57-M60 HydrophobicContact CB-CG 4.38Å; P57-M60 HydrophobicContact CG-SD 4.35Å; P57-M60 PolarHBondContact O-N 2.92Å
58	E	71.1	Confident	74.4	Confident	165 Å²	165	115 Å²	115	77%	0.771	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-61	-37.5	-173.9	-147.9	158.1	161.6	0	0	111.4	M60 Q61	E58-M60 PolarHBondContact O-N 3.01Å; E58-M60 VanDerWaalsContact O-N 3.07Å; E58-Q61 PolarHBondContact O-N 3.38Å; E58-Q61 VanDerWaalsContact O-N 3.12Å
59	D	72.4	Confident	74.4	Confident	135 Å²	135	113.1 Å²	113.1	72%	0.722	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-65.9	-5.6	175	-36.4	-66.7	0	0	0	114.6	P57	P57-D59 PolarHBondContact O-N 3.12Å
60	M	67.8	Low	74.1	Confident	91 Å²	91	113.1 Å²	113.1	45%	0.448	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-112.9	1	176.9	-65	-168.7	73.4	0	0	113.1	V56 P57 E58 D62	V56-M60 HydrophobicContact CG1-CB 3.84Å; P57-M60 HydrophobicContact CB-CG 4.38Å; P57-M60 HydrophobicContact CG-SD 4.35Å; P57-M60 PolarHBondContact O-N 2.92Å; E58-M60 PolarHBondContact O-N 3.01Å; E58-M60 VanDerWaalsContact O-N 3.07Å; M60-D62 VanDerWaalsContact C-N 3.25Å; M60-D62 PolarHBondContact O-N 2.67Å
61	Q	68.5	Low	73.5	Confident	120 Å²	120	116.6 Å²	116.6	56%	0.561	60%	0.598	S	S	*	*			trans	-85.3	2.5	178	-63.6	175.3	35.8	0	0	112.8	V56 E58	V56-Q61 HydrophobicContact CB-CG 4.33Å; V56-Q61 HydrophobicContact CG1-CG 3.99Å; V56-Q61 PolarHBondContact O-NE2 3.05Å; E58-Q61 PolarHBondContact O-N 3.38Å; E58-Q61 VanDerWaalsContact O-N 3.12Å
62	D	78.1	Confident	73.4	Confident	101 Å²	101	118.9 Å²	118.9	54%	0.54	61%	0.606	S	S	.	*	S	Bend	trans	-62.7	143.4	175.1	-84	-40	0	0	0	112.6	M60 E64 F65 A66	M60-D62 VanDerWaalsContact C-N 3.25Å; M60-D62 PolarHBondContact O-N 2.67Å; D62-E64 PolarHBondContact O-N 2.86Å; D62-F65 HydrophobicContact CB-CD2 4.14Å; D62-F65 PolarHBondContact O-N 2.88Å; D62-A66 PolarHBondContact O-N 3.41Å
63	K	72.4	Confident	73.7	Confident	197 Å²	197	114.5 Å²	114.5	86%	0.857	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-19.7	-174.8	-67.2	177	-179.1	171.8	0	114.1
64	E	73.7	Confident	73.8	Confident	172 Å²	172	114.4 Å²	114.4	80%	0.804	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-31.6	177.4	-57.8	-173.4	179.2	0	0	111.6	D62	D62-E64 PolarHBondContact O-N 2.86Å
65	F	70.8	Confident	74	Confident	88 Å²	88	114.3 Å²	114.3	39%	0.386	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-17.6	177.4	-58	-58.3	0	0	0	113.5	D62 A67 I68 L69	D62-F65 HydrophobicContact CB-CD2 4.14Å; D62-F65 PolarHBondContact O-N 2.88Å; F65-A67 PolarHBondContact O-N 2.69Å; F65-I68 HydrophobicContact CD1-CD1 4.22Å; F65-I68 WeakPolarHBondContact O-CG1 3.37Å; F65-I68 PolarHBondContact O-N 3.34Å; F65-L69 VanDerWaalsContact O-CB 3.3Å; F65-L69 WeakPolarHBondContact O-CB 3.29Å; F65-L69 PolarHBondContact O-N 2.83Å
66	A	74.9	Confident	74.4	Confident	63 Å²	63	107.3 Å²	107.3	52%	0.521	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.7	-13.6	177.2	0	0	0	0	0	115.3	D62	D62-A66 PolarHBondContact O-N 3.41Å
67	A	75.1	Confident	74.4	Confident	93 Å²	93	112.6 Å²	112.6	77%	0.769	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-16.2	173.6	0	0	0	0	0	114.4	F65	F65-A67 PolarHBondContact O-N 2.69Å
68	I	76.6	Confident	74.4	Confident	145 Å²	145	111.9 Å²	111.9	74%	0.744	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	-16.8	-179.9	62.6	169.6	0	0	0	113.3	F65	F65-I68 HydrophobicContact CD1-CD1 4.22Å; F65-I68 WeakPolarHBondContact O-CG1 3.37Å; F65-I68 PolarHBondContact O-N 3.34Å
69	L	78.8	Confident	74.7	Confident	42 Å²	42	107.8 Å²	107.8	22%	0.22	57%	0.568	C	S	.	*			trans	-69.3	137.3	169.9	-179.9	71.2	0	0	0	110.1	V56 F65 D71	V56-L69 HydrophobicContact CB-CD1 4.45Å; V56-L69 HydrophobicContact CG1-CD1 3.61Å; V56-L69 HydrophobicContact CG1-CD2 3.81Å; V56-L69 HydrophobicContact CG1-CG 4.34Å; V56-L69 HydrophobicContact CG2-CD1 3.93Å; V56-L69 HydrophobicContact CG2-CD2 4.2Å; V56-L69 HydrophobicContact CG2-CG 4.42Å; F65-L69 VanDerWaalsContact O-CB 3.3Å; F65-L69 WeakPolarHBondContact O-CB 3.29Å; F65-L69 PolarHBondContact O-N 2.83Å; L69-D71 WeakPolarHBondContact CD2-OD1 3.31Å
70	Q	72.4	Confident	75.1	Confident	123 Å²	123	105 Å²	105	58%	0.575	56%	0.555	S	S	*	*			trans	-109.5	109.9	167.6	-167.7	171.3	15.8	0	0	108.7	E72 M74	Q70-E72 PolarHBondContact O-N 2.93Å; Q70-M74 VanDerWaalsContact OE1-CE 3.3Å
71	D	68.2	Low	75.5	Confident	135 Å²	135	106 Å²	106	72%	0.722	57%	0.569	S	S	*	*	S	Bend	trans	-61.7	-27.6	-174.2	-65.6	-35.1	0	0	0	113.8	L69	L69-D71 WeakPolarHBondContact CD2-OD1 3.31Å
72	E	77.3	Confident	75.8	Confident	157 Å²	157	104.6 Å²	104.6	73%	0.734	56%	0.564	S	S	*	*	S	Bend	trans	-101.5	120	176.3	-172	171.7	-165	0	0	110.4	Q70 M74	Q70-E72 PolarHBondContact O-N 2.93Å; E72-M74 PolarHBondContact O-N 3.4Å
73	P	74.9	Confident	75.9	Confident	52 Å²	52	103.5 Å²	103.5	34%	0.338	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-67.1	122.1	-177.8	25.8	-33.3	0	0	0	111.4	Y50 K52 Q75	Y50-P73 PolarHBondContact OH-O 3.23Å; K52-P73 WeakPolarHBondContact O-CG 3.38Å; P73-Q75 PolarHBondContact O-N 3.01Å
74	M	75.2	Confident	76	Confident	133 Å²	133	100.6 Å²	100.6	66%	0.655	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-66.7	127	-176.6	-167	-176.3	-58.5	0	0	111.9	Y50 Q70 E72	Y50-M74 WeakPolarHBondContact CE2-O 3.33Å; Q70-M74 VanDerWaalsContact OE1-CE 3.3Å; E72-M74 PolarHBondContact O-N 3.4Å
75	Q	78.5	Confident	76	Confident	106 Å²	106	98.6 Å²	98.6	50%	0.495	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-65.2	134.3	179.7	-173.3	175.4	-4.6	0	0	111.5	P73 L77 L79	P73-Q75 PolarHBondContact O-N 3.01Å; Q75-L77 PolarHBondContact O-N 2.86Å; Q75-L79 HydrophobicContact CG-CB 4.27Å; Q75-L79 HydrophobicContact CG-CD1 4.12Å; Q75-L79 VanDerWaalsContact NE2-CB 3.35Å
76	P	82.4	Confident	76.3	Confident	34 Å²	34	98.4 Å²	98.4	22%	0.221	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-57.2	128.4	178.6	-27.5	34.4	0	0	0	112.5	L47 Y50 A78 L79	L47-P76 HydrophobicContact CD2-CB 3.57Å; L47-P76 HydrophobicContact CD2-CG 3.94Å; Y50-P76 HydrophobicContact CD1-CG 4.14Å; Y50-P76 HydrophobicContact CD2-CG 3.65Å; Y50-P76 HydrophobicContact CE2-CG 4.21Å; Y50-P76 HydrophobicContact CG-CG 3.6Å; P76-A78 PolarHBondContact O-N 3.3Å; P76-L79 WeakPolarHBondContact O-CB 3.15Å; P76-L79 PolarHBondContact O-N 3.16Å
77	L	76.6	Confident	76.3	Confident	144 Å²	144	101.4 Å²	101.4	75%	0.754	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-53.8	-28.1	-179	-65.5	175.6	0	0	0	113.5	Q75 L79 V80	Q75-L77 PolarHBondContact O-N 2.86Å; L77-L79 PolarHBondContact O-N 3.39Å; L77-V80 WeakPolarHBondContact O-CB 3.38Å; L77-V80 PolarHBondContact O-N 3.05Å
78	A	76.7	Confident	76.2	Confident	54 Å²	54	102.8 Å²	102.8	45%	0.446	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-65.9	-13.4	175.7	0	0	0	0	0	114.4	R43 L47 P76	R43-A78 PolarHBondContact NH2-O 2.93Å; L47-A78 HydrophobicContact CD1-CB 4.43Å; L47-A78 HydrophobicContact CD2-CB 4.4Å; P76-A78 PolarHBondContact O-N 3.3Å
79	L	77.3	Confident	75.9	Confident	78 Å²	78	100.1 Å²	100.1	41%	0.408	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-95.2	-12.2	170.9	-61.3	177.8	0	0	0	113	L47 Q75 P76 L77	L47-L79 HydrophobicContact CD1-CD2 3.94Å; L47-L79 HydrophobicContact CD1-CG 4.47Å; L47-L79 HydrophobicContact CD2-CD1 4.25Å; L47-L79 HydrophobicContact CD2-CD2 4.22Å; L47-L79 HydrophobicContact CD2-CG 3.89Å; Q75-L79 HydrophobicContact CG-CB 4.27Å; Q75-L79 HydrophobicContact CG-CD1 4.12Å; Q75-L79 VanDerWaalsContact NE2-CB 3.35Å; P76-L79 WeakPolarHBondContact O-CB 3.15Å; P76-L79 PolarHBondContact O-N 3.16Å; L77-L79 PolarHBondContact O-N 3.39Å
80	V	81.1	Confident	75.3	Confident	76 Å²	76	106.2 Å²	106.2	46%	0.461	54%	0.543	S	S	.	.	S	Bend	trans	-79.6	125.6	172.3	-176.6	0	0	0	0	107.6	L77 L82	L77-V80 WeakPolarHBondContact O-CB 3.38Å; L77-V80 PolarHBondContact O-N 3.05Å; V80-L82 PolarHBondContact O-N 2.94Å
81	P	77	Confident	74.7	Confident	114 Å²	114	104.9 Å²	104.9	74%	0.74	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-66.6	127.9	173.2	27.8	-32.7	0	0	0	109.2	T83	P81-T83 PolarHBondContact O-N 2.92Å
82	L	73.8	Confident	74	Confident	89 Å²	89	103.4 Å²	103.4	47%	0.466	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-53	138.4	176	-70.9	123.2	0	0	0	110.6	V80 E86 F90	V80-L82 PolarHBondContact O-N 2.94Å; L82-E86 HydrophobicContact CB-CB 4.27Å; L82-E86 HydrophobicContact CD2-CB 3.83Å; L82-F90 HydrophobicContact CD2-CD2 3.87Å; L82-F90 HydrophobicContact CD2-CE2 3.81Å
83	T	79.9	Confident	72.8	Confident	78 Å²	78	99.4 Å²	99.4	48%	0.479	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-64	157.8	175.1	63	0	0	0	0	111	P81 E85 E86 Q87	P81-T83 PolarHBondContact O-N 2.92Å; T83-E85 PolarHBondContact O-N 2.89Å; T83-E85 VanDerWaalsContact O-N 3.11Å; T83-E86 VanDerWaalsContact CB-OE2 3.32Å; T83-E86 WeakPolarHBondContact CB-OE2 3.5Å; T83-E86 WeakPolarHBondContact CG2-OE2 3.19Å; T83-E86 PolarHBondContact N-OE2 2.97Å; T83-E86 PolarHBondContact O-N 2.94Å; T83-E86 VanDerWaalsContact O-N 3.16Å; T83-E86 VanDerWaalsContact OG1-CG 3.3Å; T83-E86 WeakPolarHBondContact OG1-CG 3.35Å; T83-E86 PolarHBondContact OG1-N 3.5Å; T83-E86 PolarHBondContact OG1-OE2 3.05Å; T83-Q87 WeakPolarHBondContact O-CB 3.27Å; T83-Q87 PolarHBondContact O-N 3.35Å
84	E	75.4	Confident	71.6	Confident	137 Å²	137	103.2 Å²	103.2	64%	0.64	55%	0.549	S	S	*	.	H	α-helix	trans	-58.5	-26.7	179.2	-157.1	-166.7	133.9	0	0	112.4	R88	E84-R88 WeakPolarHBondContact O-CG 3.47Å; E84-R88 PolarHBondContact O-N 3.39Å; E84-R88 VanDerWaalsContact O-N 3.16Å; E84-R88 PolarHBondContact O-NE 3.39Å; E84-R88 IonicContact OE1-CZ 3.61Å; E84-R88 IonicContact OE1-NH1 2.88Å; E84-R88 PolarHBondContact OE1-NH1 2.9Å; E84-R88 IonicContact OE1-NH2 2.56Å
85	E	72.4	Confident	70.4	Confident	129 Å²	129	103.7 Å²	103.7	60%	0.603	55%	0.554	S	S	*	*	H	α-helix	trans	-77.6	-45.2	175.5	-172	165.8	179.7	0	0	112.9	T83 Q87 R88 N89	T83-E85 PolarHBondContact O-N 2.89Å; T83-E85 VanDerWaalsContact O-N 3.11Å; E85-Q87 VanDerWaalsContact C-N 3.29Å; E85-Q87 PolarHBondContact O-N 3.38Å; E85-R88 WeakPolarHBondContact O-CB 3.48Å; E85-R88 PolarHBondContact O-N 3.39Å; E85-N89 VanDerWaalsContact O-CG 3.26Å; E85-N89 PolarHBondContact O-N 2.94Å; E85-N89 PolarHBondContact O-ND2 3.29Å
86	E	78.4	Confident	69.1	Low	84 Å²	84	100.6 Å²	100.6	39%	0.393	54%	0.544	S	S	.	.	H	α-helix	trans	-62	-39.3	172.3	-67.6	164.3	114.6	0	0	111.5	L82 T83 R88 N89 F90	L82-E86 HydrophobicContact CB-CB 4.27Å; L82-E86 HydrophobicContact CD2-CB 3.83Å; T83-E86 VanDerWaalsContact CB-OE2 3.32Å; T83-E86 WeakPolarHBondContact CB-OE2 3.5Å; T83-E86 WeakPolarHBondContact CG2-OE2 3.19Å; T83-E86 PolarHBondContact N-OE2 2.97Å; T83-E86 PolarHBondContact O-N 2.94Å; T83-E86 VanDerWaalsContact O-N 3.16Å; T83-E86 VanDerWaalsContact OG1-CG 3.3Å; T83-E86 WeakPolarHBondContact OG1-CG 3.35Å; T83-E86 PolarHBondContact OG1-N 3.5Å; T83-E86 PolarHBondContact OG1-OE2 3.05Å; E86-R88 VanDerWaalsContact C-N 3.34Å; E86-R88 PolarHBondContact O-N 3.45Å; E86-N89 CarbonylContact O-C 3.56Å; E86-N89 PolarHBondContact O-N 3.04Å; E86-F90 WeakPolarHBondContact O-CD2 3.47Å; E86-F90 PolarHBondContact O-N 3.23Å
87	Q	74.8	Confident	67.5	Low	126 Å²	126	100.1 Å²	100.1	59%	0.589	54%	0.543	S	S	*	.	H	α-helix	trans	-68.4	-31.9	179.2	-162.4	170.2	65.5	0	0	112.3	T83 E85 S91	T83-Q87 WeakPolarHBondContact O-CB 3.27Å; T83-Q87 PolarHBondContact O-N 3.35Å; E85-Q87 VanDerWaalsContact C-N 3.29Å; E85-Q87 PolarHBondContact O-N 3.38Å; Q87-S91 WeakPolarHBondContact O-CB 3.21Å; Q87-S91 PolarHBondContact O-N 3.17Å; Q87-S91 PolarHBondContact O-OG 3.2Å
88	R	71.8	Confident	66.2	Low	123 Å²	123	96.3 Å²	96.3	46%	0.464	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-44.9	164.4	-80.5	-177.4	-75.7	-100.2	-1.9	111.8	E84 E85 E86 S91 M92	E84-R88 WeakPolarHBondContact O-CG 3.47Å; E84-R88 PolarHBondContact O-N 3.39Å; E84-R88 VanDerWaalsContact O-N 3.16Å; E84-R88 PolarHBondContact O-NE 3.39Å; E84-R88 IonicContact OE1-CZ 3.61Å; E84-R88 IonicContact OE1-NH1 2.88Å; E84-R88 PolarHBondContact OE1-NH1 2.9Å; E84-R88 IonicContact OE1-NH2 2.56Å; E85-R88 WeakPolarHBondContact O-CB 3.48Å; E85-R88 PolarHBondContact O-N 3.39Å; E86-R88 VanDerWaalsContact C-N 3.34Å; E86-R88 PolarHBondContact O-N 3.45Å; R88-S91 PolarHBondContact O-N 3.32Å; R88-S91 PolarHBondContact O-OG 3.02Å; R88-S91 VanDerWaalsContact O-OG 3.06Å; R88-M92 PolarHBondContact O-N 3.24Å
89	N	71.1	Confident	65.1	Low	88 Å²	88	97.6 Å²	97.6	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-67	-39.4	-177.4	-69.5	-20.3	0	0	0	112.9	E85 E86 S91 M92	E85-N89 VanDerWaalsContact O-CG 3.26Å; E85-N89 PolarHBondContact O-N 2.94Å; E85-N89 PolarHBondContact O-ND2 3.29Å; E86-N89 CarbonylContact O-C 3.56Å; E86-N89 PolarHBondContact O-N 3.04Å; N89-S91 VanDerWaalsContact C-N 3.31Å; N89-S91 PolarHBondContact O-N 3.4Å; N89-M92 VanDerWaalsContact OD1-CE 3.25Å; N89-M92 WeakPolarHBondContact OD1-CE 3.34Å
90	F	65.4	Low	64.1	Low	171 Å²	171	99.9 Å²	99.9	75%	0.75	55%	0.546	S	S	*	.	H	α-helix	trans	-71.5	-19.9	174.8	-88.7	-78.5	0	0	0	114.2	L82 E86	L82-F90 HydrophobicContact CD2-CD2 3.87Å; L82-F90 HydrophobicContact CD2-CE2 3.81Å; E86-F90 WeakPolarHBondContact O-CD2 3.47Å; E86-F90 PolarHBondContact O-N 3.23Å
91	S	60.6	Low	63.1	Low	94 Å²	94	105.8 Å²	105.8	66%	0.657	56%	0.56	S	S	*	*	H	α-helix	trans	-93.8	-12.4	177.9	52.9	0	0	0	0	114	Q87 R88 N89 S93	Q87-S91 WeakPolarHBondContact O-CB 3.21Å; Q87-S91 PolarHBondContact O-N 3.17Å; Q87-S91 PolarHBondContact O-OG 3.2Å; R88-S91 PolarHBondContact O-N 3.32Å; R88-S91 PolarHBondContact O-OG 3.02Å; R88-S91 VanDerWaalsContact O-OG 3.06Å; N89-S91 VanDerWaalsContact C-N 3.31Å; N89-S91 PolarHBondContact O-N 3.4Å; S91-S93 PolarHBondContact O-N 3.38Å
92	M	53.2	Low	61.8	Low	104 Å²	104	107.7 Å²	107.7	51%	0.512	56%	0.563	S	S	.	*	S	Bend	trans	-73.1	122.7	168.4	-74.1	-167.8	-73	0	0	111.3	R88 N89 V94	R88-M92 PolarHBondContact O-N 3.24Å; N89-M92 VanDerWaalsContact OD1-CE 3.25Å; N89-M92 WeakPolarHBondContact OD1-CE 3.34Å; M92-V94 PolarHBondContact O-N 3.1Å
93	S	52.6	Low	60.4	Low	74 Å²	74	111.3 Å²	111.3	52%	0.517	58%	0.58	S	S	.	*			trans	-65.6	124.6	178.1	79.9	0	0	0	0	111.4	S91 N95 S96	S91-S93 PolarHBondContact O-N 3.38Å; S93-N95 PolarHBondContact O-N 2.88Å; S93-N95 VanDerWaalsContact O-N 3.11Å; S93-S96 WeakPolarHBondContact O-CB 3.3Å; S93-S96 PolarHBondContact O-N 3.31Å; S93-S96 PolarHBondContact O-OG 2.89Å; S93-S96 VanDerWaalsContact OG-CB 3.31Å; S93-S96 WeakPolarHBondContact OG-CB 3.41Å; S93-S96 PolarHBondContact OG-OG 3.22Å
94	V	49.1	Very low	58.5	Low	132 Å²	132	110.4 Å²	110.4	80%	0.8	59%	0.586	S	S	*	*	H	α-helix	trans	-56.5	-31.6	-172.7	-103.3	0	0	0	0	114.1	M92 S96	M92-V94 PolarHBondContact O-N 3.1Å; V94-S96 VanDerWaalsContact C-N 3.32Å; V94-S96 PolarHBondContact O-N 2.94Å
95	N	50.1	Low	56.7	Low	143 Å²	143	114 Å²	114	77%	0.765	60%	0.599	S	S	*	*	H	α-helix	trans	-73.4	-20.8	176.6	-66.9	-7.5	0	0	0	113.6	S93 V99	S93-N95 PolarHBondContact O-N 2.88Å; S93-N95 VanDerWaalsContact O-N 3.11Å; N95-V99 WeakPolarHBondContact O-CG2 3.18Å
96	S	52	Low	54.8	Low	40 Å²	40	111.3 Å²	111.3	28%	0.28	61%	0.606	S	S	.	*	H	α-helix	trans	-86.5	-35.2	-177.1	66.4	0	0	0	0	113.7	S93 V94 A98 V99 L100	S93-S96 WeakPolarHBondContact O-CB 3.3Å; S93-S96 PolarHBondContact O-N 3.31Å; S93-S96 PolarHBondContact O-OG 2.89Å; S93-S96 VanDerWaalsContact OG-CB 3.31Å; S93-S96 WeakPolarHBondContact OG-CB 3.41Å; S93-S96 PolarHBondContact OG-OG 3.22Å; V94-S96 VanDerWaalsContact C-N 3.32Å; V94-S96 PolarHBondContact O-N 2.94Å; S96-A98 VanDerWaalsContact C-N 3.29Å; S96-A98 PolarHBondContact O-N 3.48Å; S96-V99 PolarHBondContact O-N 2.79Å; S96-L100 WeakPolarHBondContact O-CB 3.33Å; S96-L100 WeakPolarHBondContact O-CG 3.26Å; S96-L100 PolarHBondContact O-N 3Å
97	A	48.4	Very low	52.6	Low	24 Å²	24	112.5 Å²	112.5	20%	0.198	63%	0.63	C	S	.	*	H	α-helix	trans	-70.1	-22.3	-172.7	0	0	0	0	0	114	R101	A97-R101 WeakPolarHBondContact O-CG 3.5Å; A97-R101 PolarHBondContact O-NH1 3.34Å
98	A	49.7	Very low	50.5	Low	65 Å²	65	110.5 Å²	110.5	54%	0.537	64%	0.644	S	S	.	*	H	α-helix	trans	-78.6	-45.1	170.9	0	0	0	0	0	111.5	S96 L100 R101 L102	S96-A98 VanDerWaalsContact C-N 3.29Å; S96-A98 PolarHBondContact O-N 3.48Å; A98-L100 PolarHBondContact O-N 3.39Å; A98-R101 PolarHBondContact O-N 3.29Å; A98-L102 WeakPolarHBondContact O-CB 3.5Å; A98-L102 PolarHBondContact O-N 3.45Å
99	V	52.8	Low	48.6	Very low	80 Å²	80	108.3 Å²	108.3	49%	0.485	66%	0.659	S	S	.	*	H	α-helix	trans	-64	-40	179.9	178	0	0	0	0	111.6	N95 S96 R101 L102 M103	N95-V99 WeakPolarHBondContact O-CG2 3.18Å; S96-V99 PolarHBondContact O-N 2.79Å; V99-R101 VanDerWaalsContact C-N 3.34Å; V99-R101 PolarHBondContact O-N 3.12Å; V99-L102 PolarHBondContact O-N 3.05Å; V99-L102 VanDerWaalsContact O-N 3.15Å; V99-M103 PolarHBondContact O-N 2.92Å
100	L	56.2	Low	47	Very low	127 Å²	127	110.4 Å²	110.4	67%	0.665	68%	0.678	S	S	*	*	H	α-helix	trans	-65.5	-34.7	176.5	-71	168.9	0	0	0	112.7	S96 A98 G104	S96-L100 WeakPolarHBondContact O-CB 3.33Å; S96-L100 WeakPolarHBondContact O-CG 3.26Å; S96-L100 PolarHBondContact O-N 3Å; A98-L100 PolarHBondContact O-N 3.39Å; L100-G104 PolarHBondContact O-N 2.38Å
101	R	60.1	Low	45.6	Very low	200 Å²	200	106.6 Å²	106.6	76%	0.755	68%	0.678	S	S	*	*	H	α-helix	trans	-70.9	-34.2	170.9	-72	-178.9	-178.2	101.6	-11.1	112.3	A97 A98 V99	A97-R101 WeakPolarHBondContact O-CG 3.5Å; A97-R101 PolarHBondContact O-NH1 3.34Å; A98-R101 PolarHBondContact O-N 3.29Å; V99-R101 VanDerWaalsContact C-N 3.34Å; V99-R101 PolarHBondContact O-N 3.12Å
102	L	49.7	Very low	44.3	Very low	154 Å²	154	108.6 Å²	108.6	81%	0.806	69%	0.688	S	S	*	*	H	α-helix	trans	-73.3	-26.3	-179.5	-162.8	67.7	0	0	0	113.3	A98 V99	A98-L102 WeakPolarHBondContact O-CB 3.5Å; A98-L102 PolarHBondContact O-N 3.45Å; V99-L102 PolarHBondContact O-N 3.05Å; V99-L102 VanDerWaalsContact O-N 3.15Å
103	M	44.8	Very low	43.2	Very low	165 Å²	165	108.8 Å²	108.8	81%	0.813	71%	0.706	S	S	*	*	H	α-helix	trans	-104.7	-1.9	178.7	-58.2	-157.9	78.9	0	0	114.7	V99	V99-M103 PolarHBondContact O-N 2.92Å
104	G	38.9	Very low	42.1	Very low	58 Å²	58	108.6 Å²	108.6	60%	0.598	72%	0.716	S	S	*	*			trans	-105.5	85.9	-174.6	0	0	0	0	0	114.7	L100	L100-G104 PolarHBondContact O-N 2.38Å
105	K	39.4	Very low	41.3	Very low	213 Å²	213	109.6 Å²	109.6	93%	0.926	72%	0.723	S	S	*	*			trans	-106.9	94.8	171.4	-175	95.1	78.4	173.5	0	111.1
106	G	31.8	Very low	40.4	Very low	72 Å²	72	109 Å²	109	74%	0.742	72%	0.723	S	S	*	*			trans	149.6	152.3	165.2	0	0	0	0	0	116.3
107	A	31.9	Very low	39.5	Very low	110 Å²	110	119 Å²	119	91%	0.909	76%	0.755	S	S	*	*			trans	65.3	85.6	163	0	0	0	0	0	120.7
108	G	30.9	Very low	38.5	Very low	84 Å²	84	121.2 Å²	121.2	87%	0.866	78%	0.781	S	S	*	*				85.9	53.8	99.8	0	0	0	0	0	123.3
109	G	31.6	Very low	37.6	Very low	76 Å²	76	130.4 Å²	130.4	78%	0.784	80%	0.801	S	S	*	*			trans	67.3	-169.4	151.2	0	0	0	0	0	118.4
110	P	38.6	Very low	36.4	Very low	133 Å²	133	130.2 Å²	130.2	86%	0.864	82%	0.815	S	S	*	*			cis	-111.6	169.4	-6	40.7	-30.6	0	0	0	113.9
111	A	35.9	Very low	35.1	Very low	91 Å²	91	129.2 Å²	129.2	75%	0.752	83%	0.825	S	S	*	*			trans	-102.5	144.3	168.1	0	0	0	0	0	111.5
112	P	32.5	Very low	33.8	Very low	135 Å²	135	124.1 Å²	124.1	88%	0.877	83%	0.826	S	S	*	*			trans	-75.3	145.1	170.7	32.2	-33.6	0	0	0	111
113	A	30.1	Very low	32.9	Very low	108 Å²	108	129 Å²	129	89%	0.893	83%	0.834	S	S	*	*			trans	-137.7	142.5	-172.5	0	0	0	0	0	114.3
114	G	30.3	Very low	32.2	Very low	71 Å²	71	124.9 Å²	124.9	73%	0.732	83%	0.834	S	S	*	*			trans	168.3	139	172.9	0	0	0	0	0	108.4
115	V	31	Very low	31.8	Very low	153 Å²	153	125.8 Å²	125.8	93%	0.927	84%	0.843	S	S	*	*			cis	-131.6	165.3	19.7	174.1	0	0	0	0	111.3
116	V	32.2	Very low	31.4	Very low	129 Å²	129	127.9 Å²	127.9	78%	0.782	85%	0.845	S	S	*	*			trans	-111.5	138.2	-166.7	171.3	0	0	0	0	114.4
117	R	31.6	Very low	31.3	Very low	251 Å²	251	128 Å²	128	95%	0.947	85%	0.846	S	S	*	*			trans	-173.8	142.4	147.5	-106.6	176.7	174.8	99.4	-6.2	108.7
118	G	29.3	Very low	31.3	Very low	71 Å²	71	130.7 Å²	130.7	73%	0.732	85%	0.845	S	S	*	*			cis	178.9	125.8	-13.2	0	0	0	0	0	107.8
119	R	30.3	Very low	31.5	Very low	258 Å²	258	131.3 Å²	131.3	97%	0.974	84%	0.842	S	S	*	*				95.2	91.7	69.5	-167.3	-166.5	-163.1	-151.1	6.4	114.3
120	G	28	Very low	31.5	Very low	75 Å²	75	131 Å²	131	77%	0.773	84%	0.838	S	S	*	*			trans	129.9	161.5	146.7	0	0	0	0	0	117.4
121	A	29	Very low	31.3	Very low	106 Å²	106	137 Å²	137	88%	0.876	84%	0.844	S	S	*	*			cis	-170.7	113	-17.8	0	0	0	0	0	114.3
122	A	32.8	Very low	31	Very low	94 Å²	94	136 Å²	136	78%	0.777	84%	0.843	S	S	*	*			trans	-159.1	132.1	154.8	0	0	0	0	0	108.2
123	R	30.2	Very low	31	Very low	256 Å²	256	142 Å²	142	97%	0.966	85%	0.848	S	S	*	*				54.6	111.2	64.5	-84.1	-173.6	163.4	132.6	-6	113.4
124	G	30.2	Very low	31.1	Very low	79 Å²	79	139.9 Å²	139.9	81%	0.814	84%	0.836	S	S	*	*			cis	136.3	147	-19.9	0	0	0	0	0	116.2
125	G	30.5	Very low	30.9	Very low	76 Å²	76	146.1 Å²	146.1	78%	0.784	85%	0.847	S	S	*	*			trans	82.9	159.3	149.9	0	0	0	0	0	118.5
126	R	31.4	Very low	30.8	Very low	258 Å²	258	142.5 Å²	142.5	97%	0.974	84%	0.841	S	S	*	*			cis	-163.7	150.2	-4.8	-105.7	-162.9	-170.2	-78	3.8	110.9
127	G	28.6	Very low	30.7	Very low	74 Å²	74	140 Å²	140	76%	0.763	84%	0.84	S	S	*	*			trans	141.5	141.6	148.9	0	0	0	0	0	114.5
128	N	32.8	Very low	30.4	Very low	167 Å²	167	136.8 Å²	136.8	89%	0.893	83%	0.834	S	S	*	*			cis	-159.3	174.2	-16.5	-164.2	10.9	0	0	0	110
129	A	34.6	Very low	30.3	Very low	97 Å²	97	141.8 Å²	141.8	80%	0.802	83%	0.832	S	S	*	*			trans	74.4	132.8	179	0	0	0	0	0	116.2
130	G	31.7	Very low	30	Very low	68 Å²	68	135.6 Å²	135.6	70%	0.701	81%	0.814	S	S	*	*			cis	-178.7	161.8	-10.4	0	0	0	0	0	115.2
131	R	33.7	Very low	29.9	Very low	260 Å²	260	141.7 Å²	141.7	98%	0.981	81%	0.814	S	S	*	*			trans	39.2	120.5	155.6	-52.2	178.4	-174.4	-126.3	2.8	118.9
132	G	29.5	Very low	29.7	Very low	71 Å²	71	141.7 Å²	141.7	73%	0.732	81%	0.807	S	S	*	*			cis	134.8	152.2	-8.2	0	0	0	0	0	114.9
133	R	33.8	Very low	29.4	Very low	259 Å²	259	144.2 Å²	144.2	98%	0.977	81%	0.806	S	S	*	*			trans	69	143.7	174.3	-55.9	177.9	177.5	-111.1	1.3	116.3
134	G	32.5	Very low	29.3	Very low	64 Å²	64	140.7 Å²	140.7	66%	0.66	80%	0.8	S	S	*	*			cis	-138.5	169.6	-10.2	0	0	0	0	0	109.3
135	E	25.8	Very low	29.5	Very low	202 Å²	202	143.9 Å²	143.9	94%	0.944	80%	0.799	S	S	*	*			cis	54.1	123.5	46.9	-168.2	-175.1	-121.9	0	0	112.3
136	G	28.4	Very low	29.3	Very low	78 Å²	78	146.2 Å²	146.2	80%	0.804	80%	0.798	S	S	*	*			cis	-163	-168.7	-4.6	0	0	0	0	0	107.9
137	G	30	Very low	29.5	Very low	75 Å²	75	141.8 Å²	141.8	77%	0.773	79%	0.789	S	S	*	*			cis	158.4	111.4	0.1	0	0	0	0	0	111.5
138	F	26	Very low	29.7	Very low	184 Å²	184	144.5 Å²	144.5	81%	0.807	79%	0.79	S	S	*	*			trans	73.2	149.3	162.3	-108.5	-79.3	0	0	0	122.9
139	Y	26	Very low	29.5	Very low	176 Å²	176	139.9 Å²	139.9	69%	0.69	78%	0.782	S	S	*	*			trans	84	101.7	151	-82.4	-52.8	0	0	0	124.2
140	Q	25.7	Very low	29	Very low	129 Å²	129	145.5 Å²	145.5	60%	0.603	79%	0.789	S	S	*	*				93.8	127	114.2	-123.3	175.9	-155.8	0	0	122.2
141	R	24	Very low	28.8	Very low	203 Å²	203	145.3 Å²	145.3	77%	0.766	79%	0.787	S	S	*	*			trans	80.1	111.5	154.6	-44.9	-171.9	-164.2	-100.7	-9.6	120
142	S	25.1	Very low	28.6	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	79%	0.785	S	S	*	*				48.9	124.9	120.9	-161.8	0	0	0	0	121.7
143	I	27.9	Very low	28.4	Very low	147 Å²	147	149.4 Å²	149.4	75%	0.754	79%	0.793	S	S	*	*			trans	52.4	121	147.3	-149.1	165.5	0	0	0	117
144	E	26.4	Very low	28.3	Very low	181 Å²	181	143.6 Å²	143.6	85%	0.846	79%	0.786	S	S	*	*				-169.8	176.1	70.5	-167.4	150.6	-177.1	0	0	111.3
145	D	35	Very low	28.2	Very low	146 Å²	146	151.7 Å²	151.7	78%	0.781	80%	0.796	S	S	*	*			trans	-87.7	152.7	-173.2	-130.5	-49.3	0	0	0	113.5
146	T	27.5	Very low	28.5	Very low	125 Å²	125	150.7 Å²	150.7	77%	0.767	79%	0.792	S	S	*	*			trans	-168.5	109.3	157.2	-72.3	0	0	0	0	112.9
147	E	35.3	Very low	28.6	Very low	166 Å²	166	153.9 Å²	153.9	78%	0.776	79%	0.789	S	S	*	*			trans	47.1	122.4	140.1	-61.3	-158.2	102.1	0	0	125.5
148	V	31.4	Very low	28.5	Very low	130 Å²	130	158.3 Å²	158.3	79%	0.788	79%	0.789	S	S	*	*				69.5	125.3	124.9	180	0	0	0	0	121
149	G	28.6	Very low	28.6	Very low	71 Å²	71	160.8 Å²	160.8	73%	0.732	79%	0.793	S	S	*	*			trans	166.2	72.5	162.8	0	0	0	0	0	116.2
150	F	24.5	Very low	28.8	Very low	214 Å²	214	156.3 Å²	156.3	94%	0.939	79%	0.788	S	S	*	*			trans	-70.1	148	175.2	-70.5	-101.3	0	0	0	111.9
151	G	28.4	Very low	29	Very low	64 Å²	64	159.4 Å²	159.4	66%	0.66	80%	0.802	S	S	*	*			cis	151.8	168.7	-2.8	0	0	0	0	0	111.9
152	R	29.4	Very low	29.3	Very low	251 Å²	251	154 Å²	154	95%	0.947	80%	0.795	S	S	*	*			trans	-159.3	140	161.9	-106	166.4	-154.7	-103.4	0.4	109.8	V154	R152-V154 PolarHBondContact O-N 3.49Å
153	N	25.4	Very low	29.7	Very low	167 Å²	167	160.8 Å²	160.8	89%	0.893	81%	0.805	S	S	*	*			trans	-85.9	111.1	-171.2	-77.9	-4.5	0	0	0	113.1
154	V	30.9	Very low	30	Very low	137 Å²	137	160.3 Å²	160.3	83%	0.83	80%	0.804	S	S	*	*			trans	-134.2	117	142.2	179.4	0	0	0	0	106.2	R152	R152-V154 PolarHBondContact O-N 3.49Å
155	R	31.4	Very low	30.1	Very low	233 Å²	233	159.1 Å²	159.1	88%	0.879	80%	0.803	S	S	*	*			trans	-143.7	122.4	170.2	-84	-166.7	171	161.5	-0.9	110.9
156	E	31.6	Very low	30.2	Very low	182 Å²	182	164.1 Å²	164.1	85%	0.85	81%	0.811	S	S	*	*			trans	-57.5	150.2	160.3	-62.8	136.1	114.2	0	0	110.3
157	I	29.9	Very low	30.5	Very low	145 Å²	145	161.1 Å²	161.1	74%	0.744	81%	0.805	S	S	*	*			trans	-101.1	99.8	175.4	-61.4	176.8	0	0	0	108.3	R159	I157-R159 PolarHBondContact O-N 2.64Å
158	H	28.9	Very low	30.1	Very low	167 Å²	167	160.4 Å²	160.4	77%	0.773	80%	0.801	S	S	*	*			trans	-50.2	128.6	166.1	-117.8	-103.7	0	0	0	110.1	S160	H158-S160 PolarHBondContact ND1-OG 3.2Å
159	R	27.2	Very low	30.1	Very low	236 Å²	236	164.7 Å²	164.7	89%	0.891	80%	0.804	S	S	*	*			trans	-111	78.5	168.8	-91	-166.6	167.3	89	-3.2	110.5	I157	I157-R159 PolarHBondContact O-N 2.64Å
160	S	31.2	Very low	30.1	Very low	83 Å²	83	172 Å²	172	58%	0.58	81%	0.809	S	S	*	*			trans	-151.5	73.7	176.2	59.2	0	0	0	0	110.4	H158	H158-S160 PolarHBondContact ND1-OG 3.2Å
161	Q	28.4	Very low	30.2	Very low	193 Å²	193	170.7 Å²	170.7	90%	0.902	80%	0.803	S	S	*	*			trans	-150.2	146	169.7	-112.3	169.8	18.7	0	0	110.4
162	S	32.1	Very low	30.2	Very low	90 Å²	90	174.5 Å²	174.5	63%	0.629	80%	0.804	S	S	*	*			trans	-70.2	164.1	-175.4	-156.7	0	0	0	0	112.7	D164	S162-D164 PolarHBondContact OG-OD2 3.03Å
163	W	32.1	Very low	30.2	Very low	248 Å²	248	169.6 Å²	169.6	94%	0.939	79%	0.789	S	S	*	*	S	Bend	trans	-84.1	-10.6	-178.9	-87.5	82.2	0	0	0	114.7
164	D	33.8	Very low	30.5	Very low	137 Å²	137	167.2 Å²	167.2	73%	0.733	78%	0.783	S	S	*	*	S	Bend	trans	-85.6	-16.4	-167	-52.6	-83.2	0	0	0	115.1	S162 R166	S162-D164 PolarHBondContact OG-OD2 3.03Å; D164-R166 PolarHBondContact O-N 3.15Å
165	D	29.4	Very low	30.3	Very low	157 Å²	157	168 Å²	168	84%	0.84	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	43.2	-162.3	-118.9	-47	0	0	0	115
166	R	37.6	Very low	30.1	Very low	251 Å²	251	167 Å²	167	95%	0.947	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.4	19.9	172.8	-85.4	-165.3	174.2	-175.9	-0.7	115.9	D164	D164-R166 PolarHBondContact O-N 3.15Å
167	G	33.8	Very low	29.9	Very low	61 Å²	61	168.5 Å²	168.5	63%	0.629	78%	0.776	S	S	*	*	S	Bend	trans	-95.3	129.2	167.7	0	0	0	0	0	113.3
168	E	26.6	Very low	29.6	Very low	151 Å²	151	168.9 Å²	168.9	71%	0.706	78%	0.775	S	S	*	*			trans	65.7	86.7	150.6	-134.2	60.5	-135.3	0	0	120.5
169	R	31.1	Very low	29.6	Very low	221 Å²	221	167 Å²	167	83%	0.834	78%	0.775	S	S	*	*			trans	167.5	144.5	135.3	-95.3	156.7	-84	-142.4	-3.1	112.6
170	R	29.1	Very low	29.6	Very low	224 Å²	224	158.8 Å²	158.8	85%	0.845	76%	0.763	S	S	*	*			cis	-159.5	161.9	-26.8	-129.8	-180	-164.7	163.2	4.8	110.7
171	F	26.9	Very low	29.3	Very low	187 Å²	187	166.2 Å²	166.2	82%	0.82	78%	0.778	S	S	*	*			trans	-56.2	160.2	-179.2	-114.5	-118	0	0	0	117.1
172	E	28.5	Very low	29.9	Very low	144 Å²	144	161.9 Å²	161.9	67%	0.673	77%	0.767	S	S	*	*				-168.6	113.3	108.2	-82.3	-118.6	131.1	0	0	115.4
173	K	27.6	Very low	29.5	Very low	147 Å²	147	162.8 Å²	162.8	64%	0.639	77%	0.773	S	S	*	*			trans	67.5	164.9	138.1	-68.3	170.2	-171.4	153.5	0	119.8
174	P	33.1	Very low	29	Very low	118 Å²	118	159.2 Å²	159.2	77%	0.766	77%	0.765	S	S	*	*			cis	-130.3	141.2	8.4	39	-21.4	0	0	0	119.3
175	L	26.2	Very low	28.7	Very low	153 Å²	153	160.5 Å²	160.5	80%	0.801	77%	0.766	S	S	*	*			trans	45.4	112.6	131.2	-170.9	70.7	0	0	0	123
176	R	26.4	Very low	28.5	Very low	212 Å²	212	161.1 Å²	161.1	80%	0.8	76%	0.764	S	S	*	*				-172.9	129.2	113.9	-115	-172.2	167.4	86.6	-4.8	115.3
177	R	28.1	Very low	28.1	Very low	214 Å²	214	153.8 Å²	153.8	81%	0.808	75%	0.751	S	S	*	*				59.9	139.1	129.9	-155.1	172.8	-162.6	85.2	-3.2	121
178	E	24.3	Very low	27.8	Very low	152 Å²	152	156.9 Å²	156.9	71%	0.71	76%	0.763	S	S	*	*			cis	-174.1	163	-28.4	-104.1	-79.1	-137.8	0	0	108.6
179	V	27.5	Very low	27.9	Very low	129 Å²	129	153 Å²	153	78%	0.782	76%	0.763	S	S	*	*			trans	34.4	136.5	157	179.9	0	0	0	0	121.4
180	G	26.8	Very low	28.1	Very low	62 Å²	62	148.5 Å²	148.5	64%	0.639	76%	0.763	S	S	*	*			cis	141.8	154.4	-6.6	0	0	0	0	0	115.7
181	R	25.9	Very low	28.2	Very low	240 Å²	240	144.7 Å²	144.7	91%	0.906	77%	0.765	S	S	*	*			trans	67.6	172.2	164.9	-72.3	-170.2	179.4	-96.8	3	118
182	P	40.6	Very low	28.3	Very low	102 Å²	102	139.2 Å²	139.2	66%	0.662	76%	0.761	S	S	*	*				-144.2	170.9	-54.7	43.6	-27.7	0	0	0	116.6
183	S	23.4	Very low	28.8	Very low	109 Å²	109	139 Å²	139	76%	0.762	77%	0.772	S	S	*	*			trans	63.3	159	141	-156.1	0	0	0	0	123.6
184	F	22.7	Very low	28.8	Very low	173 Å²	173	136.4 Å²	136.4	76%	0.759	78%	0.778	S	S	*	*			trans	71.3	157.1	155.7	-112.2	-151.8	0	0	0	118.2
185	E	27.9	Very low	28.5	Very low	163 Å²	163	142.3 Å²	142.3	76%	0.762	79%	0.785	S	S	*	*			cis	-143.4	-167.2	-3.6	-157.8	168.9	178.7	0	0	110.2
186	E	25	Very low	28.5	Very low	171 Å²	171	145.2 Å²	145.2	80%	0.799	79%	0.791	S	S	*	*			trans	-113.6	153.6	-164.7	-169	-176.7	141.2	0	0	115.2
187	S	29	Very low	28.5	Very low	97 Å²	97	144.2 Å²	144.2	68%	0.678	80%	0.796	S	S	*	*			trans	91.9	131.3	147.7	-103.5	0	0	0	0	122.9
188	S	27.2	Very low	28.6	Very low	125 Å²	125	144.8 Å²	144.8	87%	0.874	80%	0.799	S	S	*	*			trans	83.9	103.5	154.8	73.9	0	0	0	0	121
189	G	28.6	Very low	28.9	Very low	69 Å²	69	143 Å²	143	71%	0.711	80%	0.799	S	S	*	*			trans	-173	137.7	166.7	0	0	0	0	0	109.5
190	P	36.1	Very low	29	Very low	128 Å²	128	147.1 Å²	147.1	83%	0.831	80%	0.8	S	S	*	*			trans	-92.4	122.3	-148.7	32.7	-36.5	0	0	0	118.4
191	V	29.5	Very low	29	Very low	144 Å²	144	148.1 Å²	148.1	87%	0.873	80%	0.803	S	S	*	*			trans	44.1	83.3	130.9	-163.1	0	0	0	0	120
192	G	30	Very low	28.9	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	80%	0.803	S	S	*	*			trans	66.9	176.1	137.8	0	0	0	0	0	120.4
193	P	38.8	Very low	28.4	Very low	139 Å²	139	144.4 Å²	144.4	90%	0.903	80%	0.802	S	S	*	*			cis	-107.3	-179.8	1.4	41.2	-32.9	0	0	0	114
194	A	27.4	Very low	28.6	Very low	93 Å²	93	146.6 Å²	146.6	77%	0.769	81%	0.806	S	S	*	*			trans	-103.2	171	-171.7	0	0	0	0	0	115.6
195	R	27.8	Very low	28.9	Very low	242 Å²	242	145 Å²	145	91%	0.913	81%	0.805	S	S	*	*			trans	66.6	100.7	163.6	-72.9	-173.1	166.7	-167.5	-4	118.9
196	K	25.2	Very low	29	Very low	214 Å²	214	149.1 Å²	149.1	93%	0.93	81%	0.814	S	S	*	*				-153.9	102.9	125.7	-122.5	176.6	-176.4	177.2	0	110.5
197	E	26.1	Very low	29.2	Very low	191 Å²	191	152.1 Å²	152.1	89%	0.893	82%	0.818	S	S	*	*			trans	-104.4	146.6	172.7	-75.5	178.8	137	0	0	111.2
198	Y	31.6	Very low	29.1	Very low	225 Å²	225	153.5 Å²	153.5	88%	0.882	82%	0.822	S	S	*	*			trans	51.4	85.8	163.5	-111.8	-98.4	0	0	0	119.7	R200	Y198-R200 PolarHBondContact O-N 2.9Å
199	T	29.7	Very low	29.1	Very low	115 Å²	115	156.1 Å²	156.1	71%	0.706	83%	0.825	S	S	*	*			trans	-52	115.3	136.4	-52.5	0	0	0	0	107.7
200	R	29.7	Very low	29.1	Very low	216 Å²	216	161.7 Å²	161.7	82%	0.815	83%	0.825	S	S	*	*				48.1	136.3	97.8	-69.7	-172.7	-177.9	94.2	-3.1	114.8	Y198	Y198-R200 PolarHBondContact O-N 2.9Å
201	A	26.2	Very low	28.8	Very low	83 Å²	83	162 Å²	162	69%	0.686	82%	0.815	S	S	*	*			cis	-162.4	166	-5.8	0	0	0	0	0	110
202	D	24	Very low	28.9	Very low	172 Å²	172	164.1 Å²	164.1	92%	0.92	82%	0.816	S	S	*	*	S	Bend	trans	-143.2	73.4	161.9	-160.6	3.8	0	0	0	109.3
203	S	31.3	Very low	28.6	Very low	92 Å²	92	169 Å²	169	64%	0.643	82%	0.819	S	S	*	*			trans	-166.3	134.4	-178.8	61.6	0	0	0	0	112.3
204	D	25.8	Very low	28.1	Very low	155 Å²	155	169.3 Å²	169.3	83%	0.829	81%	0.808	S	S	*	*			trans	55.8	95	162.8	-71.1	-46.2	0	0	0	119.4
205	N	30.1	Very low	28.1	Very low	139 Å²	139	174 Å²	174	74%	0.743	81%	0.814	S	S	*	*			trans	-154.2	65.9	140.2	-156.2	25.1	0	0	0	114.2
206	W	30.9	Very low	28.1	Very low	250 Å²	250	169.6 Å²	169.6	95%	0.947	81%	0.809	S	S	*	*			trans	-101.8	8.4	-175.7	-85.3	75.5	0	0	0	116.1
207	R	28.6	Very low	28.2	Very low	233 Å²	233	168.3 Å²	168.3	88%	0.879	81%	0.807	S	S	*	*			trans	-153.3	90.5	172.8	-71.8	-165	177.6	92	5.6	114.3
208	T	26.8	Very low	28.1	Very low	126 Å²	126	163 Å²	163	77%	0.773	80%	0.803	S	S	*	*			trans	-172.3	88.5	139.3	31.5	0	0	0	0	112.2
209	L	26.9	Very low	27.8	Very low	180 Å²	180	161.1 Å²	161.1	94%	0.942	80%	0.802	S	S	*	*				-159	175.4	127.8	-147.8	65.1	0	0	0	109.6
210	R	28.8	Very low	28.2	Very low	187 Å²	187	160.5 Å²	160.5	71%	0.706	80%	0.8	S	S	*	*			trans	-131.1	151.7	178.3	-178.1	-173.6	-175	-100.2	-20.6	107.8
211	E	29.4	Very low	28.1	Very low	133 Å²	133	153.2 Å²	153.2	62%	0.621	79%	0.793	S	S	*	*			trans	69.9	159.6	179.5	-96	107.4	-168.4	0	0	116.2
212	E	30.9	Very low	28.1	Very low	189 Å²	189	156 Å²	156	88%	0.883	80%	0.801	S	S	*	*			trans	-99.6	164	-173.5	-59.1	151.7	127.8	0	0	110.2
213	Q	25.5	Very low	28.2	Very low	176 Å²	176	154.9 Å²	154.9	82%	0.822	80%	0.795	S	S	*	*				-172.2	166.3	111.4	-163.8	149.1	13.4	0	0	111.6
214	E	27.4	Very low	27.8	Very low	144 Å²	144	160.7 Å²	160.7	67%	0.673	80%	0.803	S	S	*	*			trans	-66.1	164.9	-160.3	-67.6	147.6	123.6	0	0	120.4
215	E	26.9	Very low	28	Very low	191 Å²	191	164 Å²	164	89%	0.893	80%	0.804	S	S	*	*			trans	75.9	174.5	145.4	-80.5	178.9	171.4	0	0	121.7
216	D	28.4	Very low	27.7	Very low	151 Å²	151	164.8 Å²	164.8	81%	0.807	81%	0.808	S	S	*	*			trans	-141.7	173.6	-131.9	-168.6	19.5	0	0	0	113.6
217	E	27.4	Very low	27.3	Very low	187 Å²	187	158.3 Å²	158.3	87%	0.874	80%	0.799	S	S	*	*			trans	64.6	139.2	179.8	-62.4	-153.6	120.9	0	0	118.2
218	G	24.7	Very low	27	Very low	80 Å²	80	150.6 Å²	150.6	83%	0.825	79%	0.792	S	S	*	*			trans	142.5	54.5	164.9	0	0	0	0	0	119.2
219	E	24.8	Very low	28.5	Very low	184 Å²	184	150.2 Å²	150.2	86%	0.86	79%	0.792	S	S	*	*			trans	-72.5	171.8	159.9	-115.2	-149.3	154.8	0	0	111.4
220	P	38.5	Very low	28.4	Very low	102 Å²	102	153 Å²	153	66%	0.662	79%	0.789	S	S	*	*			cis	-136.2	171.7	-10.8	37.7	-20.5	0	0	0	115.8
221	G	26.8	Very low	28.2	Very low	64 Å²	64	154.3 Å²	154.3	66%	0.66	79%	0.794	S	S	*	*			trans	63.9	120.7	147.4	0	0	0	0	0	119.1
222	T	25.8	Very low	28	Very low	140 Å²	140	154.2 Å²	154.2	86%	0.859	80%	0.798	S	S	*	*				176.6	166.6	71.4	39.7	0	0	0	0	108.1
223	N	26	Very low	27.6	Very low	150 Å²	150	148.8 Å²	148.8	80%	0.802	79%	0.793	S	S	*	*			cis	-145.6	170.6	6.7	-154	-3.1	0	0	0	110.9
224	W	23.1	Very low	27.6	Very low	214 Å²	214	147.5 Å²	147.5	81%	0.811	79%	0.791	S	S	*	*			trans	-110	161.1	179.4	-84	69.1	0	0	0	114
225	R	29.6	Very low	27.5	Very low	223 Å²	223	148.6 Å²	148.6	84%	0.842	79%	0.794	S	S	*	*			trans	76	155.7	167.3	-37.2	-171.4	-166.6	-117.6	-4.7	113.3
226	L	25.4	Very low	27.4	Very low	157 Å²	157	146.3 Å²	146.3	82%	0.822	79%	0.788	S	S	*	*			cis	-141.6	-175.5	26.3	-139.6	114.6	0	0	0	114.4
227	C	22.4	Very low	27.2	Very low	114 Å²	114	146.6 Å²	146.6	77%	0.77	79%	0.786	S	S	*	*			trans	-59.8	153.8	-168	-50.3	0	0	0	0	117.9
228	G	21.9	Very low	27.1	Very low	70 Å²	70	143.7 Å²	143.7	72%	0.722	78%	0.777	S	S	*	*			trans	-92.5	-143.1	150.6	0	0	0	0	0	110.7
229	P	58.8	Low	27.2	Very low	118 Å²	118	146.9 Å²	146.9	77%	0.766	77%	0.773	S	S	*	*			cis	-130.8	-177.3	-23.9	41.9	-28.3	0	0	0	112
230	R	24.7	Very low	27.3	Very low	238 Å²	238	145.4 Å²	145.4	90%	0.898	77%	0.771	S	S	*	*			trans	174.8	138	135	-101.1	164.6	-161	-85.7	2.7	117
231	R	24.4	Very low	26.8	Very low	215 Å²	215	146 Å²	146	81%	0.811	78%	0.777	S	S	*	*			trans	90	122.5	133.6	-158.8	170.7	-165.5	175.3	4.3	122
232	D	24.2	Very low	26.8	Very low	131 Å²	131	145.9 Å²	145.9	70%	0.701	78%	0.775	S	S	*	*			trans	31	117.8	148.7	-41.8	-18.8	0	0	0	122
233	G	22.8	Very low	26.7	Very low	76 Å²	76	149.5 Å²	149.5	78%	0.784	78%	0.779	S	S	*	*				134.1	154.4	117	0	0	0	0	0	120.6
234	L	25	Very low	26.8	Very low	148 Å²	148	147.2 Å²	147.2	78%	0.775	78%	0.781	S	S	*	*			trans	80.6	106.9	151.7	-118.5	67.4	0	0	0	122.2
235	K	26	Very low	27.1	Very low	168 Å²	168	145.1 Å²	145.1	73%	0.73	79%	0.786	S	S	*	*			trans	51	118.7	132.2	-61.7	174.6	-164.2	171.6	0	121.6
236	N	24.8	Very low	27.1	Very low	142 Å²	142	138 Å²	138	76%	0.759	78%	0.782	S	S	*	*				43	143.4	126.1	-57.3	15	0	0	0	122.3
237	M	25.2	Very low	27.4	Very low	157 Å²	157	134.2 Å²	134.2	77%	0.773	78%	0.781	S	S	*	*			trans	73.6	147.5	164	-55.2	-32	-141.6	0	0	114.7
238	D	23.4	Very low	28.3	Very low	127 Å²	127	134.5 Å²	134.5	68%	0.679	78%	0.781	S	S	*	*			cis	-156.8	-175.4	0.4	-133.8	-40.9	0	0	0	112.6
239	I	28.7	Very low	28.5	Very low	147 Å²	147	141.7 Å²	141.7	75%	0.754	79%	0.787	S	S	*	*			trans	82	120.1	158.3	-67.7	147.6	0	0	0	118.6
240	D	26.2	Very low	27.2	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	79%	0.788	S	S	*	*			trans	-103.9	126.6	167.8	163.1	30.7	0	0	0	109.9
241	C	28.5	Very low	27.4	Very low	115 Å²	115	135.5 Å²	135.5	78%	0.777	79%	0.789	S	S	*	*			trans	179.9	148.3	150.5	54.5	0	0	0	0	111.1
242	G	25.3	Very low	27.5	Very low	61 Å²	61	128.4 Å²	128.4	63%	0.629	78%	0.783	S	S	*	*			cis	179.7	141.2	-13	0	0	0	0	0	113.4
243	F	24.6	Very low	27.5	Very low	216 Å²	216	133.2 Å²	133.2	95%	0.947	79%	0.791	S	S	*	*			trans	38.6	123	154.8	-68.5	-94.1	0	0	0	122.8
244	A	28.9	Very low	28	Very low	102 Å²	102	139.2 Å²	139.2	84%	0.843	79%	0.79	S	S	*	*				-179.3	138.6	111.5	0	0	0	0	0	114.6
245	D	28.5	Very low	28.1	Very low	171 Å²	171	137.5 Å²	137.5	91%	0.914	78%	0.782	S	S	*	*			trans	-81.7	165.8	160.3	-86.1	-62.5	0	0	0	110.9
246	G	29.7	Very low	28.4	Very low	74 Å²	74	138.1 Å²	138.1	76%	0.763	79%	0.787	S	S	*	*			cis	157.2	115.3	-3.9	0	0	0	0	0	113.8
247	G	31.3	Very low	28.4	Very low	76 Å²	76	137.5 Å²	137.5	78%	0.784	79%	0.794	S	S	*	*			trans	98.2	166	179.5	0	0	0	0	0	114.9
248	P	42.1	Very low	28.7	Very low	120 Å²	120	133.5 Å²	133.5	78%	0.779	79%	0.793	S	S	*	*			cis	-143.2	166.6	22.9	43.7	-25.3	0	0	0	119.6
249	R	25.5	Very low	29.3	Very low	222 Å²	222	134 Å²	134	84%	0.838	80%	0.803	S	S	*	*			trans	34.4	120.4	140.2	-64.4	176	176.4	-101.2	1.5	124.6
250	S	32.3	Very low	29.3	Very low	115 Å²	115	130.5 Å²	130.5	80%	0.804	80%	0.803	S	S	*	*				72.5	130.3	119.3	-56.4	0	0	0	0	124.2
251	A	29.2	Very low	29.3	Very low	110 Å²	110	133.3 Å²	133.3	91%	0.909	81%	0.812	S	S	*	*			trans	-128.9	175.4	152.4	0	0	0	0	0	108.5
252	G	26.1	Very low	29.3	Very low	67 Å²	67	131.2 Å²	131.2	69%	0.691	81%	0.809	S	S	*	*			cis	-170.5	167.2	-2.9	0	0	0	0	0	108
253	W	23.6	Very low	29.5	Very low	231 Å²	231	137.9 Å²	137.9	88%	0.875	82%	0.816	S	S	*	*			trans	-126.4	163	-168.2	-85.1	77.7	0	0	0	114.9
254	R	32.8	Very low	29.7	Very low	202 Å²	202	139.1 Å²	139.1	76%	0.762	81%	0.814	S	S	*	*			trans	86.1	155.6	161	-52.3	-150.3	176.4	-72.8	-1.8	117.8
255	D	28.6	Very low	29.9	Very low	112 Å²	112	144 Å²	144	60%	0.599	81%	0.811	S	S	*	*			cis	-161.4	173.2	-33.7	-103.9	-54.5	0	0	0	108.5
256	H	30.3	Very low	29.9	Very low	182 Å²	182	144.8 Å²	144.8	84%	0.843	81%	0.806	S	S	*	*			trans	-70.4	151.6	-171.3	-56.2	-94.2	0	0	0	116.8
257	S	25.9	Very low	29.6	Very low	128 Å²	128	149.6 Å²	149.6	90%	0.895	81%	0.806	S	S	*	*			trans	-170.1	159.6	131.4	48.5	0	0	0	0	113.1
258	G	31.3	Very low	29.3	Very low	73 Å²	73	152.6 Å²	152.6	75%	0.753	80%	0.804	S	S	*	*			trans	-162.5	158	170.7	0	0	0	0	0	110.7
259	P	36.5	Very low	28.7	Very low	137 Å²	137	155.1 Å²	155.1	89%	0.89	80%	0.803	S	S	*	*			trans	-127.8	155.1	-178	39.5	-26.4	0	0	0	115.6
260	G	27.9	Very low	28.7	Very low	74 Å²	74	151.9 Å²	151.9	76%	0.763	80%	0.803	S	S	*	*			trans	134.6	75.6	151.6	0	0	0	0	0	120.5
261	E	26.8	Very low	28.6	Very low	211 Å²	211	154 Å²	154	99%	0.986	80%	0.798	S	S	*	*			trans	63.3	158.9	140.2	-161.7	157.6	-130.7	0	0	122.4
262	G	28.7	Very low	28.5	Very low	71 Å²	71	159.6 Å²	159.6	73%	0.732	80%	0.795	S	S	*	*			trans	118.3	116.6	167.4	0	0	0	0	0	116.3
263	R	29.6	Very low	28.6	Very low	202 Å²	202	162.6 Å²	162.6	76%	0.762	80%	0.795	S	S	*	*			trans	-120.7	143.5	-177.9	-63.1	-179.1	-177.2	-91.7	9.5	114.6
264	R	29.1	Very low	28.8	Very low	242 Å²	242	155.7 Å²	155.7	91%	0.913	78%	0.783	S	S	*	*			trans	176.5	128	138.2	-92.4	149.9	-157.8	-90.9	5.9	106.5
265	R	31.9	Very low	28.5	Very low	204 Å²	204	155.2 Å²	155.2	77%	0.77	79%	0.789	S	S	*	*			cis	62	128.7	39	-66.3	-176.5	173.7	172.3	-3.9	112.4
266	K	29.5	Very low	28.5	Very low	187 Å²	187	153.7 Å²	153.7	81%	0.813	80%	0.8	S	S	*	*			cis	-151.8	-176.5	22.5	-142	-169.4	172.4	-145	0	113.6
267	F	23.1	Very low	28.5	Very low	176 Å²	176	154.7 Å²	154.7	77%	0.772	81%	0.805	S	S	*	*			trans	-74.9	168.5	179.2	-109.3	-122	0	0	0	114.4
268	D	24.3	Very low	28.6	Very low	139 Å²	139	152.4 Å²	152.4	74%	0.743	80%	0.801	S	S	*	*				-176.4	172.8	100	-87.3	-47.7	0	0	0	112.6
269	F	28.8	Very low	28.5	Very low	172 Å²	172	154.3 Å²	154.3	75%	0.754	81%	0.81	S	S	*	*			trans	-150.8	144.9	-167.8	170.5	-77.6	0	0	0	110.7
270	D	26.9	Very low	28.2	Very low	155 Å²	155	151.8 Å²	151.8	83%	0.829	81%	0.809	S	S	*	*			trans	-159.3	173.3	161.8	-134.8	-33.5	0	0	0	114.7
271	F	29.5	Very low	28.2	Very low	159 Å²	159	159.3 Å²	159.3	70%	0.697	81%	0.814	S	S	*	*			trans	-141	166.1	-161.4	-167.4	-90.2	0	0	0	113.4
272	R	27.6	Very low	28.3	Very low	227 Å²	227	159.7 Å²	159.7	86%	0.857	81%	0.807	S	S	*	*			trans	132.4	158.5	163.9	-78.5	171.5	77.7	-172.7	4	114.2
273	D	27.9	Very low	28.3	Very low	130 Å²	130	168 Å²	168	70%	0.695	82%	0.816	S	S	*	*			cis	-171.7	176.1	-33.9	-146.9	-20.5	0	0	0	111.1
274	S	27.8	Very low	28.2	Very low	87 Å²	87	163.2 Å²	163.2	61%	0.608	82%	0.819	S	S	*	*			trans	76.3	101.8	161.4	-69.8	0	0	0	0	123.5
275	E	26.8	Very low	28.1	Very low	191 Å²	191	155.1 Å²	155.1	89%	0.893	81%	0.811	S	S	*	*				47.1	135.8	113.4	-59.9	169.3	123.2	0	0	124.3
276	G	28.8	Very low	27.9	Very low	81 Å²	81	150.5 Å²	150.5	84%	0.835	81%	0.81	S	S	*	*			trans	171.8	117.4	160.5	0	0	0	0	0	119
277	H	29.2	Very low	27.8	Very low	203 Å²	203	149.8 Å²	149.8	94%	0.94	81%	0.81	S	S	*	*			trans	-55.9	160.4	-176.3	-56.3	-93.3	0	0	0	121.3
278	G	27.8	Very low	28.1	Very low	80 Å²	80	145 Å²	145	83%	0.825	81%	0.81	S	S	*	*				137.3	103.4	123	0	0	0	0	0	123
279	A	30.3	Very low	28.6	Very low	113 Å²	113	145.8 Å²	145.8	93%	0.934	81%	0.813	S	S	*	*			trans	-24.5	155.6	164.2	0	0	0	0	0	124
280	G	29.3	Very low	28.8	Very low	84 Å²	84	146 Å²	146	87%	0.866	82%	0.817	S	S	*	*			trans	175.7	145.2	159.8	0	0	0	0	0	118.7
281	R	29.6	Very low	29.4	Very low	231 Å²	231	145.2 Å²	145.2	87%	0.872	81%	0.813	S	S	*	*			trans	-95.2	140.4	-168.4	-64.7	176.7	174	-150.1	-0.7	118.1
282	R	27.6	Very low	29.9	Very low	220 Å²	220	145.6 Å²	145.6	83%	0.83	82%	0.822	S	S	*	*			trans	57.5	149.2	133.9	-63.7	-171.4	-178.3	-83.8	8.2	124.6
283	R	28.8	Very low	30.9	Very low	246 Å²	246	143 Å²	143	93%	0.928	81%	0.812	S	S	*	*			trans	86.2	157	159.9	-66.7	178.7	172.1	168.4	-4.3	117.7
284	A	28.8	Very low	32.1	Very low	100 Å²	100	144.4 Å²	144.4	83%	0.826	82%	0.82	S	S	*	*			cis	-179.8	149.9	-32	0	0	0	0	0	111.2
285	G	25.8	Very low	33	Very low	73 Å²	73	143.6 Å²	143.6	75%	0.753	82%	0.824	S	S	*	*			trans	120	138.2	179.4	0	0	0	0	0	112
286	S	27.2	Very low	34.5	Very low	106 Å²	106	139.9 Å²	139.9	74%	0.741	81%	0.81	S	S	*	*			cis	69	126	37.2	-142.5	0	0	0	0	112.1
287	E	27.7	Very low	35.5	Very low	173 Å²	173	139.8 Å²	139.8	81%	0.808	80%	0.795	S	S	*	*			cis	-157.2	174.1	-5.9	56.7	-77.3	133.2	0	0	109.2
288	G	29.5	Very low	36.3	Very low	75 Å²	75	137.7 Å²	137.7	77%	0.773	79%	0.786	S	S	*	*			cis	155	125.3	-7.1	0	0	0	0	0	111.8
289	L	35.2	Very low	37.4	Very low	156 Å²	156	145.1 Å²	145.1	82%	0.817	79%	0.789	S	S	*	*			trans	-165.2	100.9	-178.2	178.6	67.9	0	0	0	113.8
290	E	32.5	Very low	38.3	Very low	176 Å²	176	144 Å²	144	82%	0.822	77%	0.773	S	S	*	*			trans	-145.4	22.5	174.1	-66.1	-69.5	168.9	0	0	112.9	D292	E290-D292 PolarHBondContact O-N 3.46Å
291	D	39.8	Very low	39.1	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	31.8	-165.6	-160.3	35.3	0	0	0	115.5
292	D	41	Very low	40.1	Very low	166 Å²	166	140 Å²	140	89%	0.888	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	16.9	-171.1	-98.7	-53.5	0	0	0	113.5	E290	E290-D292 PolarHBondContact O-N 3.46Å
293	R	48.1	Very low	40.7	Very low	174 Å²	174	137.9 Å²	137.9	66%	0.657	75%	0.751	S	S	*	*			trans	-114.8	-7.8	179.7	-73.1	-157.6	176.7	-147.5	6.2	116.9	G295	R293-G295 PolarHBondContact O-N 2.72Å
294	D	52.4	Low	41.6	Very low	159 Å²	159	134.8 Å²	134.8	85%	0.85	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	49.9	-174.5	-75.5	18.1	0	0	0	113.9
295	G	46.8	Very low	42.6	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	-1.4	177.8	0	0	0	0	0	114.8	R293	R293-G295 PolarHBondContact O-N 2.72Å
296	L	58.9	Low	43.4	Very low	113 Å²	113	137 Å²	137	59%	0.592	74%	0.743	S	S	*	*	S	Bend	trans	-112.2	148.7	174.3	-88.4	66.9	0	0	0	110.1	C300	L296-C300 HydrophobicContact CB-CB 4.35Å; L296-C300 HydrophobicContact CD2-CB 3.93Å
297	P	50.1	Low	44.7	Very low	80 Å²	80	140 Å²	140	52%	0.519	75%	0.745	S	S	.	*			trans	-59	142.5	169	-21.4	33.2	0	0	0	111.2	W299 C300	P297-W299 HydrophobicContact CB-CE3 4.38Å; P297-W299 PolarHBondContact O-N 3.12Å; P297-C300 PolarHBondContact O-N 3.02Å
298	E	45.8	Very low	46.1	Very low	159 Å²	159	139.8 Å²	139.8	74%	0.743	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-49.4	-29.3	-174.3	-60.5	170.5	149.1	0	0	113.8	C300 T301	E298-C300 PolarHBondContact O-N 3.39Å; E298-T301 PolarHBondContact O-N 3.09Å; E298-T301 PolarHBondContact O-OG1 2.85Å
299	W	51.4	Low	47.6	Very low	235 Å²	235	137 Å²	137	89%	0.89	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-66.1	-2.1	176.8	-37	-37.9	0	0	0	114.7	P297	P297-W299 HydrophobicContact CB-CE3 4.38Å; P297-W299 PolarHBondContact O-N 3.12Å
300	C	47.8	Very low	49.5	Very low	89 Å²	89	133.9 Å²	133.9	60%	0.601	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-118.5	3.4	178.1	-68.8	0	0	0	0	113.4	L296 P297 E298	L296-C300 HydrophobicContact CB-CB 4.35Å; L296-C300 HydrophobicContact CD2-CB 3.93Å; P297-C300 PolarHBondContact O-N 3.02Å; E298-C300 PolarHBondContact O-N 3.39Å
301	T	46	Very low	51.1	Low	52 Å²	52	132 Å²	132	32%	0.319	70%	0.695	S	S	.	*			trans	-108.2	107	170.2	41.3	0	0	0	0	108.8	E298 E303	E298-T301 PolarHBondContact O-N 3.09Å; E298-T301 PolarHBondContact O-OG1 2.85Å; T301-E303 PolarHBondContact O-N 2.89Å
302	D	51	Low	52.8	Low	179 Å²	179	128.8 Å²	128.8	96%	0.957	68%	0.678	S	S	*	*			trans	-83.5	51.5	-176.1	-140.8	-12.5	0	0	0	110.5
303	E	40.8	Very low	53.5	Low	177 Å²	177	127.6 Å²	127.6	83%	0.827	68%	0.682	S	S	*	*			trans	-104	149.8	177.2	-63.7	-143.2	149.3	0	0	112	T301	T301-E303 PolarHBondContact O-N 2.89Å
304	E	48	Very low	53.9	Low	181 Å²	181	123.9 Å²	123.9	85%	0.846	68%	0.683	S	S	*	*			trans	-94.6	167.1	-162.6	-145.8	162.8	175.9	0	0	112.4
305	D	49.1	Very low	54.5	Low	153 Å²	153	118.9 Å²	118.9	82%	0.818	67%	0.669	S	S	*	*			trans	70.1	27.8	169.1	-62.5	-23.2	0	0	0	120.4	E307	D305-E307 PolarHBondContact O-N 3.26Å; D305-E307 VanDerWaalsContact O-N 3.13Å
306	G	41.7	Very low	54.7	Low	66 Å²	66	117.8 Å²	117.8	68%	0.68	65%	0.653	S	S	*	*			trans	-77.2	79.3	164.4	0	0	0	0	0	114.6	M308	G306-M308 PolarHBondContact O-N 3.03Å
307	E	55.1	Low	54.4	Low	168 Å²	168	118 Å²	118	79%	0.785	65%	0.649	S	S	*	*			trans	-69.7	95.8	-179.8	-167.5	170.3	-148	0	0	112.5	D305	D305-E307 PolarHBondContact O-N 3.26Å; D305-E307 VanDerWaalsContact O-N 3.13Å
308	M	56.7	Low	54.4	Low	170 Å²	170	119.8 Å²	119.8	84%	0.837	65%	0.652	S	S	*	*			trans	-66.6	143.8	-171.1	-64.3	-176	179.9	0	0	114.2	G306	G306-M308 PolarHBondContact O-N 3.03Å
309	G	61.9	Low	54.8	Low	17 Å²	17	116.8 Å²	116.8	18%	0.175	65%	0.646	C	S	.	*			trans	-62.9	164.5	177.3	0	0	0	0	0	114.9	F317 M318	G309-F317 WeakPolarHBondContact O-CE2 3.44Å; G309-M318 CarbonylContact C-O 3.59Å; G309-M318 VanDerWaalsContact CA-O 3.24Å; G309-M318 WeakPolarHBondContact CA-O 3.26Å
310	T	73.9	Confident	54.6	Low	89 Å²	89	110.9 Å²	110.9	55%	0.546	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.5	155.1	-176.3	55.9	0	0	0	0	112.2	M318	T310-M318 PolarHBondContact N-O 3.32Å; T310-M318 VanDerWaalsContact N-O 3.13Å; T310-M318 PolarHBondContact O-N 3.22Å
311	F	67.3	Low	54.4	Low	138 Å²	138	116.1 Å²	116.1	61%	0.605	64%	0.644	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.3	139.7	167.8	-92.4	-81.4	0	0	0	110.6	G315 A316 F317	F311-G315 VanDerWaalsContact CD1-C 3.47Å; F311-G315 VanDerWaalsContact CE1-O 3.26Å; F311-G315 WeakPolarHBondContact CE1-O 3.27Å; F311-A316 WeakPolarHBondContact CA-O 3.36Å; F311-A316 VanDerWaalsContact CD1-O 3.31Å; F311-A316 WeakPolarHBondContact CD1-O 3.42Å; F311-F317 HydrophobicContact CD1-CB 4.23Å; F311-F317 AromaticContact CD2-CD2 3.68Å; F311-F317 HydrophobicContact CD2-CD2 3.68Å; F311-F317 HydrophobicContact CD2-CE2 4.44Å; F311-F317 HydrophobicContact CE1-CB 3.81Å; F311-F317 HydrophobicContact CE2-CB 4.19Å; F311-F317 AromaticContact CE2-CD2 3.59Å; F311-F317 HydrophobicContact CE2-CD2 3.59Å; F311-F317 HydrophobicContact CE2-CE2 4.41Å; F311-F317 HydrophobicContact CE2-CG 4.29Å; F311-F317 HydrophobicContact CG-CD2 4.25Å; F311-F317 HydrophobicContact CZ-CB 3.79Å; F311-F317 HydrophobicContact CZ-CD2 4.1Å; F311-F317 HydrophobicContact CZ-CG 4.35Å
312	D	74.6	Confident	54.3	Low	71 Å²	71	123.7 Å²	123.7	38%	0.38	67%	0.673	S	S	.	*			trans	-82.5	176.6	171.5	83.7	-8.3	0	0	0	112.3	S314 G315 A316	D312-S314 VanDerWaalsContact CG-OG 3.28Å; D312-S314 PolarHBondContact O-N 2.71Å; D312-S314 WeakPolarHBondContact OD1-CA 3.32Å; D312-S314 WeakPolarHBondContact OD1-CB 3.33Å; D312-S314 PolarHBondContact OD1-N 3.22Å; D312-S314 PolarHBondContact OD1-OG 2.97Å; D312-S314 PolarHBondContact OD2-OG 2.81Å; D312-S314 VanDerWaalsContact OD2-OG 3.12Å; D312-G315 PolarHBondContact O-N 2.97Å; D312-G315 PolarHBondContact OD1-N 3.02Å; D312-A316 PolarHBondContact N-O 3.05Å; D312-A316 PolarHBondContact OD1-N 3.01Å
313	S	55.4	Low	53.3	Low	140 Å²	140	118.6 Å²	118.6	98%	0.979	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-1.6	179.3	-52.1	0	0	0	0	115
314	S	56.7	Low	52.6	Low	97 Å²	97	113.7 Å²	113.7	68%	0.678	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-16.2	170.7	79.9	0	0	0	0	112.9	D312	D312-S314 VanDerWaalsContact CG-OG 3.28Å; D312-S314 PolarHBondContact O-N 2.71Å; D312-S314 WeakPolarHBondContact OD1-CA 3.32Å; D312-S314 WeakPolarHBondContact OD1-CB 3.33Å; D312-S314 PolarHBondContact OD1-N 3.22Å; D312-S314 PolarHBondContact OD1-OG 2.97Å; D312-S314 PolarHBondContact OD2-OG 2.81Å; D312-S314 VanDerWaalsContact OD2-OG 3.12Å
315	G	66.2	Low	52.1	Low	54 Å²	54	115.1 Å²	115.1	56%	0.557	66%	0.663	S	S	*	*	S	Bend	trans	88.4	27.1	-170.4	0	0	0	0	0	113.4	F311 D312	F311-G315 VanDerWaalsContact CD1-C 3.47Å; F311-G315 VanDerWaalsContact CE1-O 3.26Å; F311-G315 WeakPolarHBondContact CE1-O 3.27Å; D312-G315 PolarHBondContact O-N 2.97Å; D312-G315 PolarHBondContact OD1-N 3.02Å
316	A	51.3	Low	51	Low	45 Å²	45	116.5 Å²	116.5	37%	0.372	67%	0.665	S	S	.	*			trans	-100.8	140.6	169.2	0	0	0	0	0	111.5	F311 D312	F311-A316 WeakPolarHBondContact CA-O 3.36Å; F311-A316 VanDerWaalsContact CD1-O 3.31Å; F311-A316 WeakPolarHBondContact CD1-O 3.42Å; D312-A316 PolarHBondContact N-O 3.05Å; D312-A316 PolarHBondContact OD1-N 3.01Å
317	F	51.8	Low	50.3	Low	117 Å²	117	118.1 Å²	118.1	51%	0.513	66%	0.661	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.8	127.2	-178.4	-171.7	-109.4	0	0	0	111.6	G309 F311	G309-F317 WeakPolarHBondContact O-CE2 3.44Å; F311-F317 HydrophobicContact CD1-CB 4.23Å; F311-F317 AromaticContact CD2-CD2 3.68Å; F311-F317 HydrophobicContact CD2-CD2 3.68Å; F311-F317 HydrophobicContact CD2-CE2 4.44Å; F311-F317 HydrophobicContact CE1-CB 3.81Å; F311-F317 HydrophobicContact CE2-CB 4.19Å; F311-F317 AromaticContact CE2-CD2 3.59Å; F311-F317 HydrophobicContact CE2-CD2 3.59Å; F311-F317 HydrophobicContact CE2-CE2 4.41Å; F311-F317 HydrophobicContact CE2-CG 4.29Å; F311-F317 HydrophobicContact CG-CD2 4.25Å; F311-F317 HydrophobicContact CZ-CB 3.79Å; F311-F317 HydrophobicContact CZ-CD2 4.1Å; F311-F317 HydrophobicContact CZ-CG 4.35Å
318	M	50	Low	48.9	Very low	118 Å²	118	117.2 Å²	117.2	58%	0.581	66%	0.661	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-115.3	107.8	179.1	-64.8	-144	75.8	0	0	111.6	G309 T310	G309-M318 CarbonylContact C-O 3.59Å; G309-M318 VanDerWaalsContact CA-O 3.24Å; G309-M318 WeakPolarHBondContact CA-O 3.26Å; T310-M318 PolarHBondContact N-O 3.32Å; T310-M318 VanDerWaalsContact N-O 3.13Å; T310-M318 PolarHBondContact O-N 3.22Å
319	P	54.8	Low	47.5	Very low	96 Å²	96	115.2 Å²	115.2	62%	0.623	65%	0.653	S	S	*	*			trans	-71.8	134.9	173.1	29.2	-33.4	0	0	0	111.4	K321	P319-K321 PolarHBondContact O-N 3.12Å
320	L	46.7	Very low	45.9	Very low	111 Å²	111	121.1 Å²	121.1	58%	0.581	68%	0.675	S	S	*	*			trans	-72.9	89	178	-105.9	69.7	0	0	0	111.3
321	K	43.2	Very low	43.7	Very low	199 Å²	199	124.6 Å²	124.6	87%	0.865	69%	0.686	S	S	*	*			trans	-88.7	114	174.5	-170.5	169.7	-175.9	172.6	0	111.3	P319	P319-K321 PolarHBondContact O-N 3.12Å
322	K	43.6	Very low	42	Very low	211 Å²	211	124.7 Å²	124.7	92%	0.917	69%	0.693	S	S	*	*			trans	-122.9	115.9	-177.4	-170.4	176.1	-176.5	177.2	0	112.4
323	G	31.2	Very low	40	Very low	73 Å²	73	128.5 Å²	128.5	75%	0.753	71%	0.712	S	S	*	*			trans	133.2	134.1	171.1	0	0	0	0	0	113.7
324	G	26.3	Very low	38.6	Very low	74 Å²	74	129.6 Å²	129.6	76%	0.763	71%	0.707	S	S	*	*			cis	171.8	147.4	-11.9	0	0	0	0	0	115.7
325	K	35.6	Very low	37.1	Very low	210 Å²	210	133.3 Å²	133.3	91%	0.913	71%	0.711	S	S	*	*			trans	51	110.9	154.4	-63	-180	179.9	175.8	0	120.7
326	E	27.5	Very low	35.2	Very low	182 Å²	182	139.9 Å²	139.9	85%	0.85	73%	0.725	S	S	*	*			trans	-148.1	155.3	131.8	-72.3	-153.5	-73.2	0	0	107.7
327	T	26.8	Very low	34.1	Very low	100 Å²	100	140.8 Å²	140.8	61%	0.613	74%	0.738	S	S	*	*			cis	-166.8	151.5	-33.5	39	0	0	0	0	107.7
328	I	24.7	Very low	33	Very low	150 Å²	150	142.6 Å²	142.6	77%	0.769	75%	0.751	S	S	*	*			trans	68.6	136.3	150.3	-74	164.6	0	0	0	115.3
329	L	27.5	Very low	32	Very low	128 Å²	128	145.4 Å²	145.4	67%	0.67	76%	0.763	S	S	*	*			cis	-154.5	176.6	1.7	-113.5	175.3	0	0	0	111.9
330	E	28.3	Very low	30.9	Very low	140 Å²	140	148 Å²	148	65%	0.654	77%	0.771	S	S	*	*			trans	2.1	142.5	157.9	-78.7	151.6	-173.4	0	0	123.9
331	E	28.7	Very low	30.2	Very low	163 Å²	163	151 Å²	151	76%	0.762	78%	0.783	S	S	*	*			trans	70.8	148.5	138.8	-66.4	164.1	-179.3	0	0	119.1
332	D	31.6	Very low	29.8	Very low	140 Å²	140	148.6 Å²	148.6	75%	0.749	78%	0.779	S	S	*	*			cis	-146.1	179.7	12.7	-144.7	-19.9	0	0	0	113.6
333	L	31.4	Very low	29.3	Very low	150 Å²	150	147.3 Å²	147.3	79%	0.785	78%	0.777	S	S	*	*			trans	-76.6	154.6	174.2	-62.6	155.5	0	0	0	112.2
334	D	27.6	Very low	29.2	Very low	164 Å²	164	150.4 Å²	150.4	88%	0.877	78%	0.776	S	S	*	*				-178.6	178	100.9	-130.9	-40.3	0	0	0	114.3
335	F	25.2	Very low	29.3	Very low	174 Å²	174	154.4 Å²	154.4	76%	0.763	78%	0.78	S	S	*	*			trans	-133	113.4	-160.3	177.2	-84.7	0	0	0	113.8
336	K	26.3	Very low	28.8	Very low	193 Å²	193	148.3 Å²	148.3	84%	0.839	78%	0.776	S	S	*	*			trans	-173.8	153.6	155.3	-119.6	75.3	169.5	-172.1	0	108.8
337	G	26.8	Very low	28.5	Very low	63 Å²	63	148.5 Å²	148.5	65%	0.649	77%	0.774	S	S	*	*			cis	112.2	69	-6.3	0	0	0	0	0	115.2
338	I	29	Very low	28.5	Very low	156 Å²	156	150.2 Å²	150.2	80%	0.8	78%	0.779	S	S	*	*			trans	-152.3	142.7	150.9	-141.9	71.6	0	0	0	109.7
339	E	29.5	Very low	28.5	Very low	177 Å²	177	150.4 Å²	150.4	83%	0.827	78%	0.782	S	S	*	*			trans	-93.4	163.6	160.1	-63.7	159.6	133.9	0	0	107.3
340	D	31.2	Very low	28.6	Very low	149 Å²	149	148 Å²	148	80%	0.797	78%	0.781	S	S	*	*			trans	-175.7	99.5	151.9	-91.5	-24	0	0	0	110.8
341	E	33.1	Very low	28.8	Very low	176 Å²	176	148.1 Å²	148.1	82%	0.822	78%	0.781	S	S	*	*			trans	31.7	110	143.9	-55.4	-176.9	159.9	0	0	122.4
342	D	33.2	Very low	28.9	Very low	147 Å²	147	150.1 Å²	150.1	79%	0.786	78%	0.782	S	S	*	*				57.5	142.7	121.3	-60.5	-31.4	0	0	0	125.7
343	E	34.7	Very low	28.6	Very low	185 Å²	185	150.3 Å²	150.3	86%	0.864	78%	0.783	S	S	*	*			trans	63.3	134.3	156.7	-70.5	175.8	-174.7	0	0	118.9
344	D	28.9	Very low	28.5	Very low	138 Å²	138	150.7 Å²	150.7	74%	0.738	79%	0.786	S	S	*	*			cis	-159.3	-173.9	-2	-157	-10.8	0	0	0	109.9
345	D	27.2	Very low	28.4	Very low	158 Å²	158	146.5 Å²	146.5	85%	0.845	78%	0.781	S	S	*	*			trans	71.4	157.9	160.9	-75.1	-36.1	0	0	0	121.5
346	G	25.6	Very low	28.5	Very low	81 Å²	81	146.5 Å²	146.5	84%	0.835	79%	0.789	S	S	*	*			trans	124.6	62.7	142.1	0	0	0	0	0	120.7
347	F	21.6	Very low	28.6	Very low	186 Å²	186	140.2 Å²	140.2	82%	0.816	78%	0.779	S	S	*	*			trans	-95.9	137.1	177.4	-174	-127.8	0	0	0	113.7
348	L	26.6	Very low	28.6	Very low	137 Å²	137	143.2 Å²	143.2	72%	0.717	78%	0.78	S	S	*	*			trans	75.5	124.7	167.9	-59.2	170.5	0	0	0	121.5
349	D	24.3	Very low	28.8	Very low	154 Å²	154	143.9 Å²	143.9	82%	0.824	78%	0.777	S	S	*	*				-162.3	135.3	112.3	-127.2	17.2	0	0	0	108
350	A	30.9	Very low	28.7	Very low	78 Å²	78	140.7 Å²	140.7	65%	0.645	77%	0.766	S	S	*	*				72.2	152.1	81.2	0	0	0	0	0	115.3
351	E	31.4	Very low	28.6	Very low	141 Å²	141	142.2 Å²	142.2	66%	0.659	77%	0.765	S	S	*	*			cis	-170.1	160.5	-28.3	-167.2	-162.8	108.1	0	0	107
352	R	30.4	Very low	28.2	Very low	206 Å²	206	137.1 Å²	137.1	78%	0.777	76%	0.76	S	S	*	*			trans	75.2	161.8	169.8	-44.2	179	179.3	138.1	23.1	114.9
353	N	26.2	Very low	27.9	Very low	144 Å²	144	139.5 Å²	139.5	77%	0.77	77%	0.767	S	S	*	*			cis	-146.5	177.1	8.2	-158.1	3	0	0	0	112.6
354	N	29.5	Very low	27.5	Very low	158 Å²	158	140.4 Å²	140.4	85%	0.845	77%	0.771	S	S	*	*			trans	-82.5	160.5	-173.8	-72	-67.6	0	0	0	117.2
355	G	25.6	Very low	27.2	Very low	76 Å²	76	140.7 Å²	140.7	78%	0.784	77%	0.773	S	S	*	*			trans	131.9	152.9	156.1	0	0	0	0	0	114.3
356	D	26.7	Very low	27.5	Very low	173 Å²	173	141 Å²	141	93%	0.925	77%	0.773	S	S	*	*			cis	-166.7	160	-17.3	-177.3	31.7	0	0	0	109.4
357	G	28.1	Very low	27.4	Very low	61 Å²	61	145 Å²	145	63%	0.629	77%	0.77	S	S	*	*			trans	78.8	133.3	175.2	0	0	0	0	0	115.4
358	D	27.8	Very low	27.9	Very low	127 Å²	127	140.5 Å²	140.5	68%	0.679	76%	0.762	S	S	*	*			cis	72.4	92.4	34.9	-174	45.5	0	0	0	116.2
359	K	32.1	Very low	28.1	Very low	170 Å²	170	142.4 Å²	142.4	74%	0.739	76%	0.764	S	S	*	*				-178.8	129.5	118	-99.8	163.7	-165.3	70.8	0	117.2
360	D	28.2	Very low	28.2	Very low	110 Å²	110	141.1 Å²	141.1	59%	0.588	76%	0.758	S	S	*	*				73.3	127.6	121.6	-148.6	5.5	0	0	0	121.9
361	K	28.2	Very low	27.9	Very low	180 Å²	180	143.3 Å²	143.3	78%	0.783	77%	0.768	S	S	*	*			trans	64.3	152	166.8	-68.3	132.6	-170.5	161	0	119.2
362	G	25.6	Very low	27.8	Very low	70 Å²	70	144.7 Å²	144.7	72%	0.722	78%	0.779	S	S	*	*			cis	168	136.9	-5.7	0	0	0	0	0	112.3
363	E	26.4	Very low	28.5	Very low	197 Å²	197	140.6 Å²	140.6	92%	0.921	78%	0.779	S	S	*	*			trans	-59.8	146.6	-171.7	-56	161	115.8	0	0	114.3
364	Q	25.4	Very low	28.5	Very low	204 Å²	204	138.5 Å²	138.5	95%	0.953	78%	0.781	S	S	*	*			trans	-138.1	105.1	148.9	-70.8	-163	4.5	0	0	111.5
365	N	24.4	Very low	28.6	Very low	144 Å²	144	136 Å²	136	77%	0.77	78%	0.783	S	S	*	*			trans	-131.5	126.2	154.5	170.4	15.1	0	0	0	105.8
366	L	33.1	Very low	28.7	Very low	164 Å²	164	135.5 Å²	135.5	86%	0.859	78%	0.778	S	S	*	*			trans	159.5	138.1	150.5	-90.7	160.8	0	0	0	110.5
367	E	23.1	Very low	28.8	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	78%	0.777	S	S	*	*			trans	-146	114.2	155.3	-172.5	64.2	104.7	0	0	109.7
368	S	33	Very low	29	Very low	91 Å²	91	139.9 Å²	139.9	64%	0.636	78%	0.776	S	S	*	*			trans	6.9	153.6	149.2	-39.7	0	0	0	0	120.5
369	K	29.8	Very low	29	Very low	176 Å²	176	141 Å²	141	77%	0.765	78%	0.775	S	S	*	*			cis	-170.7	148.5	33.8	-165.9	151.3	177	168.4	0	116.6
370	D	25.6	Very low	28.7	Very low	128 Å²	128	139.8 Å²	139.8	68%	0.684	77%	0.774	S	S	*	*			trans	42.8	117	154.9	-58.8	-11.3	0	0	0	124.4
371	S	25.1	Very low	28.5	Very low	123 Å²	123	144.1 Å²	144.1	86%	0.86	79%	0.787	S	S	*	*				178.4	154.8	109.2	-76.4	0	0	0	0	114.1
372	L	29.6	Very low	29.4	Very low	171 Å²	171	141.1 Å²	141.1	90%	0.895	79%	0.786	S	S	*	*			trans	-116.5	169.2	-173.4	-82.2	171.1	0	0	0	112.1
373	P	45.4	Very low	29.6	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	79%	0.785	S	S	*	*			cis	-124	-159	19.7	38	-16.1	0	0	0	112.9
374	A	26.8	Very low	30.4	Very low	99 Å²	99	138.4 Å²	138.4	82%	0.818	78%	0.78	S	S	*	*			cis	-151.2	-128.7	16.5	0	0	0	0	0	114.6
375	A	30.3	Very low	31.6	Very low	105 Å²	105	134.2 Å²	134.2	87%	0.868	77%	0.77	S	S	*	*			trans	-134.6	159.5	-166.1	0	0	0	0	0	113.3
376	G	27.3	Very low	32.7	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	77%	0.768	S	S	*	*			cis	169.6	167.1	-7	0	0	0	0	0	115
377	E	30.1	Very low	32.5	Very low	196 Å²	196	129 Å²	129	92%	0.916	76%	0.762	S	S	*	*			trans	65.5	134.1	161.1	-53.9	-173.7	152.7	0	0	119.2
378	E	31.4	Very low	32.7	Very low	131 Å²	131	129.8 Å²	129.8	61%	0.612	77%	0.765	S	S	*	*			cis	-149.1	-152.2	-7.7	-141.3	-152.7	119.6	0	0	109
379	K	27.6	Very low	32.1	Very low	151 Å²	151	131.1 Å²	131.1	66%	0.657	77%	0.773	S	S	*	*			cis	-147.1	-124.4	12.6	-166.1	126.8	-165	75.3	0	114
380	M	26.3	Very low	31.8	Very low	144 Å²	144	127.2 Å²	127.2	71%	0.709	77%	0.773	S	S	*	*			trans	-135	147.4	-165.1	-63.6	152.4	176.1	0	0	111.7
381	K	24.1	Very low	33	Very low	201 Å²	201	126.8 Å²	126.8	87%	0.874	78%	0.778	S	S	*	*			cis	81.9	152.5	46.7	-119.8	-163.6	175	-177.2	0	114.5
382	P	47.5	Very low	33.3	Very low	116 Å²	116	127 Å²	127	75%	0.753	78%	0.776	S	S	*	*				-133.4	-162.8	-63.4	39.1	-20.3	0	0	0	115.6
383	A	28.8	Very low	33	Very low	85 Å²	85	123.5 Å²	123.5	70%	0.702	77%	0.766	S	S	*	*			trans	-82	-174.6	177.2	0	0	0	0	0	115.5
384	P	43.3	Very low	32.1	Very low	125 Å²	125	124.8 Å²	124.8	81%	0.812	77%	0.765	S	S	*	*				-156	-142.5	90.1	49.3	-26.9	0	0	0	116.4
385	P	52.1	Low	31.8	Very low	116 Å²	116	127.4 Å²	127.4	75%	0.753	76%	0.761	S	S	*	*			trans	-126	-135.5	-138	35.5	-6.1	0	0	0	113.3
386	P	47.1	Very low	31.6	Very low	112 Å²	112	129.2 Å²	129.2	73%	0.727	76%	0.755	S	S	*	*			cis	-143.5	158.8	-18	40.1	-19.4	0	0	0	120.5
387	A	28.5	Very low	31.4	Very low	87 Å²	87	133.6 Å²	133.6	72%	0.719	76%	0.758	S	S	*	*			trans	66.6	155	134.1	0	0	0	0	0	128.4
388	H	27.2	Very low	31.6	Very low	183 Å²	183	130.5 Å²	130.5	85%	0.847	76%	0.755	S	S	*	*			trans	91.9	175	154.4	-75	-60.4	0	0	0	123.6
389	C	21.2	Very low	31.3	Very low	119 Å²	119	127.3 Å²	127.3	80%	0.804	76%	0.757	S	S	*	*			trans	-107	172.6	-138.5	-52.2	0	0	0	0	117.6
390	A	23.5	Very low	31.2	Very low	93 Å²	93	126 Å²	126	77%	0.769	77%	0.767	S	S	*	*			trans	-65.8	173.2	174.9	0	0	0	0	0	114.2
391	P	48.8	Very low	31.2	Very low	120 Å²	120	124.1 Å²	124.1	78%	0.779	77%	0.774	S	S	*	*			cis	-124.3	-146.5	10.4	44.7	-25.4	0	0	0	111
392	P	33.4	Very low	31.4	Very low	128 Å²	128	117.9 Å²	117.9	83%	0.831	77%	0.767	S	S	*	*			cis	-129.1	-104.1	2.6	38	-14	0	0	0	116.7
393	S	21.7	Very low	30.5	Very low	97 Å²	97	121.2 Å²	121.2	68%	0.678	77%	0.772	S	S	*	*			trans	-155	174.3	-164.8	-171.5	0	0	0	0	112.3
394	L	26.3	Very low	30.3	Very low	146 Å²	146	123.6 Å²	123.6	76%	0.764	78%	0.778	S	S	*	*			trans	74.1	146.6	175.5	-49.8	-179.4	0	0	0	116.5
395	E	21.5	Very low	29.5	Very low	155 Å²	155	124.9 Å²	124.9	72%	0.724	78%	0.775	S	S	*	*			cis	-165.5	177.6	-26.4	-160	175.2	103.3	0	0	109.2
396	L	25.2	Very low	28.1	Very low	142 Å²	142	126.3 Å²	126.3	74%	0.743	77%	0.772	S	S	*	*			trans	79.9	84.9	161.5	-55.8	177.1	0	0	0	120.6
397	Q	24.5	Very low	27.1	Very low	159 Å²	159	126.7 Å²	126.7	74%	0.743	77%	0.767	S	S	*	*				25.2	143.1	107.7	-74.2	-72.1	-16.7	0	0	119.1
398	P	33	Very low	26.9	Very low	130 Å²	130	127.4 Å²	127.4	84%	0.844	77%	0.767	S	S	*	*				-146	137.3	59.7	37.6	-17.6	0	0	0	119.7
399	G	25.4	Very low	26.5	Very low	65 Å²	65	126.6 Å²	126.6	67%	0.67	76%	0.764	S	S	*	*				85.5	101.9	110.3	0	0	0	0	0	121.1
400	S	25.8	Very low	26.6	Very low	124 Å²	124	127.8 Å²	127.8	87%	0.867	76%	0.759	S	S	*	*			trans	-154.4	127.5	140.7	-178.9	0	0	0	0	110.3
401	A	26.2	Very low	26.5	Very low	103 Å²	103	130.4 Å²	130.4	85%	0.851	76%	0.76	S	S	*	*			trans	-42	153.2	-170.9	0	0	0	0	0	117.4
402	G	27.8	Very low	25.3	Very low	70 Å²	70	131.5 Å²	131.5	72%	0.722	76%	0.76	S	S	*	*			cis	148.2	159.6	5.4	0	0	0	0	0	109.5
403	Q	28.1	Very low	24.8	Very low	186 Å²	186	129.4 Å²	129.4	87%	0.869	75%	0.748	S	S	*	*			cis	-138.5	131.3	5.3	-74.2	172.8	-53.6	0	0	107.2
404	V	26	Very low	25	Very low	135 Å²	135	133.4 Å²	133.4	82%	0.818	76%	0.756	S	S	*	*				64.2	125.8	78.1	170.9	0	0	0	0	111.7
405	M	27.2	Very low	25	Very low	152 Å²	152	131.6 Å²	131.6	75%	0.749	76%	0.755	S	S	*	*			cis	-169.3	122.7	-5.8	177.6	170.2	-173.7	0	0	106.9
406	E	22.3	Very low	25.3	Very low	147 Å²	147	130.1 Å²	130.1	69%	0.687	76%	0.756	S	S	*	*				73.4	132.2	93.1	-145.5	-157.1	114	0	0	117.6
407	N	25.5	Very low	25.4	Very low	119 Å²	119	132.7 Å²	132.7	64%	0.636	76%	0.762	S	S	*	*			trans	62.5	114.1	150.8	-97.5	-34.3	0	0	0	124.3
408	S	23.5	Very low	25.4	Very low	102 Å²	102	130 Å²	130	71%	0.713	77%	0.767	S	S	*	*				68.6	142.3	117.1	-69.1	0	0	0	0	124.6
409	Q	20.5	Very low	25	Very low	166 Å²	166	126.9 Å²	126.9	78%	0.776	76%	0.758	S	S	*	*			trans	95.7	146.1	142.2	-141.7	-177.9	-10.4	0	0	119.9
410	M	21.5	Very low	25.1	Very low	144 Å²	144	130 Å²	130	71%	0.709	77%	0.77	S	S	*	*			trans	84.5	136.1	160.6	-47.7	-173.3	-160.4	0	0	119.6
411	N	22.9	Very low	25.1	Very low	148 Å²	148	128.1 Å²	128.1	79%	0.791	76%	0.762	S	S	*	*			trans	64.3	117.5	163.2	-54.1	-27.8	0	0	0	117.3
412	N	22.3	Very low	25	Very low	144 Å²	144	128.9 Å²	128.9	77%	0.77	76%	0.761	S	S	*	*			cis	80.6	129.8	47.5	-165.7	22	0	0	0	114
413	S	23.5	Very low	25.1	Very low	84 Å²	84	129.8 Å²	129.8	59%	0.587	76%	0.761	S	S	*	*			trans	62.7	108.2	163.7	50.3	0	0	0	0	121.2
414	H	25.4	Very low	24.9	Very low	181 Å²	181	128.5 Å²	128.5	84%	0.838	76%	0.76	S	S	*	*			trans	71.7	107.5	131.6	-64.1	-58.8	0	0	0	124
415	S	27.2	Very low	25.4	Very low	107 Å²	107	128 Å²	128	75%	0.748	76%	0.757	S	S	*	*				89.2	169.6	115.1	-151.4	0	0	0	0	121.6
416	V	26.4	Very low	25.5	Very low	124 Å²	124	125.4 Å²	125.4	75%	0.752	75%	0.754	S	S	*	*			trans	63.2	92.6	168.4	-64.9	0	0	0	0	122.2
417	K	27.2	Very low	25.8	Very low	196 Å²	196	124.7 Å²	124.7	85%	0.852	76%	0.755	S	S	*	*				66.9	121.9	108.2	-168.8	176.1	-177	174.9	0	121.1
418	A	24.7	Very low	26.2	Very low	104 Å²	104	126.2 Å²	126.2	86%	0.86	76%	0.762	S	S	*	*			trans	71.7	149.7	162.2	0	0	0	0	0	117.9
419	G	25.2	Very low	26.3	Very low	64 Å²	64	124.9 Å²	124.9	66%	0.66	76%	0.758	S	S	*	*			cis	155.6	168.4	-12.9	0	0	0	0	0	115.3
420	S	27.2	Very low	26.5	Very low	130 Å²	130	122.4 Å²	122.4	91%	0.909	76%	0.759	S	S	*	*			trans	74.3	170.6	163.1	78.5	0	0	0	0	120.4
421	A	26.6	Very low	26.9	Very low	85 Å²	85	122.3 Å²	122.3	70%	0.702	77%	0.766	S	S	*	*			trans	70.5	121	-174.6	0	0	0	0	0	116.4
422	S	24.3	Very low	27	Very low	119 Å²	119	118.9 Å²	118.9	83%	0.832	77%	0.766	S	S	*	*			cis	81.7	142.2	22.3	95.3	0	0	0	0	114.9
423	A	30	Very low	27.3	Very low	88 Å²	88	115.6 Å²	115.6	73%	0.727	77%	0.765	S	S	*	*			cis	-157.6	177.2	7.8	0	0	0	0	0	110.8
424	D	22.6	Very low	27.6	Very low	159 Å²	159	117.3 Å²	117.3	85%	0.85	78%	0.778	S	S	*	*			trans	-155.8	147.3	130.5	-115.7	-19.9	0	0	0	114.5
425	V	36.8	Very low	27.6	Very low	124 Å²	124	118.2 Å²	118.2	75%	0.752	78%	0.779	S	S	*	*			trans	-53.2	163.1	-171	-105.9	0	0	0	0	118.7
426	S	30.2	Very low	27.6	Very low	98 Å²	98	117.9 Å²	117.9	69%	0.685	78%	0.783	S	S	*	*			cis	-139.9	-157.1	0.9	-70.4	0	0	0	0	109.6
427	D	28.4	Very low	27.4	Very low	132 Å²	132	120.4 Å²	120.4	71%	0.706	79%	0.787	S	S	*	*			cis	-166.3	165.5	-2.8	-135.3	34.5	0	0	0	105.3
428	L	33.4	Very low	27.4	Very low	151 Å²	151	118.4 Å²	118.4	79%	0.791	78%	0.784	S	S	*	*			cis	-156.4	-163.4	-12.4	-154.9	61.4	0	0	0	103.6
429	A	26.8	Very low	27.1	Very low	75 Å²	75	118.4 Å²	118.4	62%	0.62	78%	0.778	S	S	*	*			cis	-160.9	175.6	-1	0	0	0	0	0	109.5
430	S	24.7	Very low	28.2	Very low	113 Å²	113	120.8 Å²	120.8	79%	0.79	78%	0.782	S	S	*	*			trans	53.3	106.2	169	-77	0	0	0	0	118.4
431	V	28.7	Very low	28	Very low	143 Å²	143	119.4 Å²	119.4	87%	0.867	77%	0.772	S	S	*	*				69.4	129.6	70.5	176.8	0	0	0	0	113.6
432	G	25.5	Very low	28.1	Very low	76 Å²	76	121.8 Å²	121.8	78%	0.784	78%	0.778	S	S	*	*			cis	123.9	140.1	-3.9	0	0	0	0	0	114.3
433	G	29.1	Very low	28.2	Very low	74 Å²	74	120.6 Å²	120.6	76%	0.763	78%	0.775	S	S	*	*			cis	158.5	111.4	-10.2	0	0	0	0	0	114.9
434	S	28.3	Very low	28	Very low	121 Å²	121	121.1 Å²	121.1	85%	0.846	78%	0.779	S	S	*	*			trans	-171.9	159.6	170.8	-83.3	0	0	0	0	112.2
435	K	27.2	Very low	28.1	Very low	199 Å²	199	116.9 Å²	116.9	87%	0.865	77%	0.773	S	S	*	*			cis	104.2	96.6	6.6	-174.1	-161.2	169.5	-175.1	0	117.1
436	A	26.7	Very low	27.6	Very low	100 Å²	100	117.7 Å²	117.7	83%	0.826	78%	0.778	S	S	*	*			trans	-171.6	122	154.3	0	0	0	0	0	117.6
437	Q	22.4	Very low	27.3	Very low	178 Å²	178	117.4 Å²	117.4	83%	0.832	78%	0.782	S	S	*	*				62.2	102.8	120.4	-155.2	167.5	-49.5	0	0	126.2
438	L	25.7	Very low	27.4	Very low	153 Å²	153	115.5 Å²	115.5	80%	0.801	79%	0.785	S	S	*	*			trans	57.2	140	130.5	-60.5	175.8	0	0	0	126.6
439	S	20.2	Very low	27.7	Very low	104 Å²	104	113.5 Å²	113.5	73%	0.727	78%	0.781	S	S	*	*			trans	81	160.1	142.8	-72.1	0	0	0	0	121.6
440	P	46.4	Very low	27.6	Very low	115 Å²	115	116.9 Å²	116.9	75%	0.747	79%	0.788	S	S	*	*			cis	-146.8	175.2	-35.9	40.9	-23	0	0	0	117.7
441	S	24.2	Very low	27.8	Very low	100 Å²	100	119 Å²	119	70%	0.699	79%	0.789	S	S	*	*			trans	95.6	131.9	136.5	-136.9	0	0	0	0	124.2
442	V	28	Very low	28.8	Very low	136 Å²	136	117.5 Å²	117.5	82%	0.824	78%	0.782	S	S	*	*			trans	46.6	148.4	152.2	-64.5	0	0	0	0	122.5
443	A	27.5	Very low	29.6	Very low	93 Å²	93	119.7 Å²	119.7	77%	0.769	78%	0.783	S	S	*	*			cis	-173.8	-167.8	-21.5	0	0	0	0	0	106.9
444	A	26.2	Very low	29.9	Very low	99 Å²	99	121.9 Å²	121.9	82%	0.818	79%	0.787	S	S	*	*			cis	-160.1	164.8	3.1	0	0	0	0	0	111
445	G	24.8	Very low	30.2	Very low	70 Å²	70	120 Å²	120	72%	0.722	79%	0.786	S	S	*	*			trans	90.1	141.6	165	0	0	0	0	0	116.2
446	T	25.5	Very low	30.5	Very low	141 Å²	141	114 Å²	114	87%	0.865	78%	0.781	S	S	*	*			cis	-154.6	138.2	-2	-36.2	0	0	0	0	112.4
447	A	23	Very low	31.4	Very low	93 Å²	93	115.8 Å²	115.8	77%	0.769	78%	0.776	S	S	*	*			trans	36.8	126.8	154.1	0	0	0	0	0	123.3
448	A	30.9	Very low	32.4	Very low	91 Å²	91	111.4 Å²	111.4	75%	0.752	76%	0.763	S	S	*	*			trans	-86	165.1	135	0	0	0	0	0	108.6
449	P	40.1	Very low	33.5	Very low	109 Å²	109	112.6 Å²	112.6	71%	0.708	77%	0.765	S	S	*	*				-164.4	-165.4	72	45.7	-23	0	0	0	117.9
450	L	24.8	Very low	35.2	Very low	146 Å²	146	115.1 Å²	115.1	76%	0.764	77%	0.77	S	S	*	*			trans	69.4	118.4	151.9	-66.2	176.1	0	0	0	123.3
451	L	28	Very low	35.5	Very low	157 Å²	157	115.6 Å²	115.6	82%	0.822	77%	0.767	S	S	*	*				46.6	153.6	122.5	-67.8	-179.3	0	0	0	123.5
452	P	50.9	Low	36.9	Very low	112 Å²	112	118 Å²	118	73%	0.727	77%	0.767	S	S	*	*			trans	-89.5	164.2	-167.7	39.8	-39.6	0	0	0	114.2
453	P	42.7	Very low	38.3	Very low	123 Å²	123	114 Å²	114	80%	0.799	75%	0.753	S	S	*	*				-148.2	156.4	94.7	40	-24.4	0	0	0	117.3
454	S	35.3	Very low	39.7	Very low	120 Å²	120	116.2 Å²	116.2	84%	0.839	75%	0.751	S	S	*	*			trans	11.7	121.7	145	178.3	0	0	0	0	121.2
455	G	34.7	Very low	41.3	Very low	80 Å²	80	119.2 Å²	119.2	83%	0.825	75%	0.746	S	S	*	*			trans	110.2	122.5	131.1	0	0	0	0	0	117
456	G	33	Very low	42.6	Very low	74 Å²	74	121.4 Å²	121.4	76%	0.763	74%	0.737	S	S	*	*			trans	143.9	102.1	175.9	0	0	0	0	0	111.2	P458	G456-P458 WeakPolarHBondContact O-CD 3.36Å
457	D	44.8	Very low	44.4	Very low	137 Å²	137	119.8 Å²	119.8	73%	0.733	72%	0.723	S	S	*	*			trans	-70.7	133.2	169.7	137.4	42.9	0	0	0	110.2	E459	D457-E459 WeakPolarHBondContact OD1-CG 3.43Å; D457-E459 PolarHBondContact OD1-N 3.02Å
458	P	45	Very low	46.4	Very low	86 Å²	86	120.7 Å²	120.7	56%	0.558	71%	0.711	S	S	*	*			trans	-136.6	108.8	135	34.7	-20.6	0	0	0	112.5	G456 D460	G456-P458 WeakPolarHBondContact O-CD 3.36Å; P458-D460 PolarHBondContact O-N 3.27Å
459	E	48.8	Very low	48	Very low	178 Å²	178	122.9 Å²	122.9	83%	0.832	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	14.6	-178.3	-56.2	-164.8	116.5	0	0	117.4	D457	D457-E459 WeakPolarHBondContact OD1-CG 3.43Å; D457-E459 PolarHBondContact OD1-N 3.02Å
460	D	55.3	Low	48.9	Very low	158 Å²	158	121.5 Å²	121.5	85%	0.845	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-23.5	-177.1	-88	-54.2	0	0	0	115.3	P458	P458-D460 PolarHBondContact O-N 3.27Å
461	D	51.5	Low	50.7	Low	125 Å²	125	116.1 Å²	116.1	67%	0.668	67%	0.666	S	S	*	*	S	Bend	trans	-84.6	-20.6	179.9	-95.3	-46.5	0	0	0	113.3	G463	D461-G463 VanDerWaalsContact C-N 3.29Å; D461-G463 PolarHBondContact O-N 2.83Å
462	E	54.2	Low	52.3	Low	150 Å²	150	113.7 Å²	113.7	70%	0.701	65%	0.651	S	S	*	*	H	α-helix	trans	-69.9	-25.1	-177.8	-61.2	-155.1	145.8	0	0	112.9	L464 K465 H466	E462-L464 PolarHBondContact O-N 2.94Å; E462-K465 PolarHBondContact O-N 2.9Å; E462-K465 VanDerWaalsContact O-N 3.13Å; E462-H466 WeakPolarHBondContact O-CB 3.47Å; E462-H466 PolarHBondContact O-N 2.94Å
463	G	57.3	Low	52.7	Low	52 Å²	52	116.1 Å²	116.1	54%	0.536	65%	0.649	S	S	.	*	H	α-helix	trans	-61.5	-39	178.2	0	0	0	0	0	113.8	D461 L467	D461-G463 VanDerWaalsContact C-N 3.29Å; D461-G463 PolarHBondContact O-N 2.83Å; G463-L467 PolarHBondContact O-N 3.38Å
464	L	57.8	Low	53.6	Low	139 Å²	139	114 Å²	114	73%	0.728	63%	0.63	S	S	*	*	H	α-helix	trans	-73.3	-32.7	174.4	-104.2	64.6	0	0	0	112	E462 Q468	E462-L464 PolarHBondContact O-N 2.94Å; L464-Q468 PolarHBondContact O-N 3.48Å; L464-Q468 VanDerWaalsContact O-N 3.16Å
465	K	60	Low	54.7	Low	162 Å²	162	112.5 Å²	112.5	70%	0.704	62%	0.615	S	S	*	*	H	α-helix	trans	-78.1	-37.7	-176.9	-146.4	172.9	-172.3	176.5	0	112.5	E462 Q468 Q469	E462-K465 PolarHBondContact O-N 2.9Å; E462-K465 VanDerWaalsContact O-N 3.13Å; K465-Q468 PolarHBondContact O-N 3.38Å; K465-Q469 WeakPolarHBondContact O-CB 3.33Å; K465-Q469 PolarHBondContact O-N 3.39Å
466	H	51	Low	55.5	Low	117 Å²	117	110.9 Å²	110.9	54%	0.542	59%	0.594	S	S	.	*	H	α-helix	trans	-62.2	-44.7	171	-173.8	-79.1	0	0	0	110.8	E462 Q468 Q469 E470	E462-H466 WeakPolarHBondContact O-CB 3.47Å; E462-H466 PolarHBondContact O-N 2.94Å; H466-Q468 PolarHBondContact O-N 2.89Å; H466-Q469 CarbonylContact O-C 3.6Å; H466-Q469 PolarHBondContact O-N 3.01Å; H466-E470 IonicContact CE1-OE2 3.22Å; H466-E470 PolarHBondContact CE1-OE2 2.7Å; H466-E470 IonicContact ND1-OE2 3.25Å; H466-E470 PolarHBondContact ND1-OE2 2.88Å; H466-E470 WeakPolarHBondContact O-CB 3.47Å; H466-E470 PolarHBondContact O-N 2.97Å
467	L	64.2	Low	56.3	Low	107 Å²	107	111 Å²	111	56%	0.56	58%	0.584	S	S	*	*	H	α-helix	trans	-62	-41.3	178.4	-176.8	60.9	0	0	0	112.4	G463 A471	G463-L467 PolarHBondContact O-N 3.38Å; L467-A471 WeakPolarHBondContact O-CB 3.45Å; L467-A471 PolarHBondContact O-N 3.06Å
468	Q	64.4	Low	56.6	Low	112 Å²	112	111.2 Å²	111.2	52%	0.523	58%	0.584	S	S	.	*	H	α-helix	trans	-62.2	-45	173.3	-177.1	65.6	31.6	0	0	111.6	L464 K465 H466 A471 E472	L464-Q468 PolarHBondContact O-N 3.48Å; L464-Q468 VanDerWaalsContact O-N 3.16Å; K465-Q468 PolarHBondContact O-N 3.38Å; H466-Q468 PolarHBondContact O-N 2.89Å; Q468-A471 PolarHBondContact O-N 3.33Å; Q468-E472 WeakPolarHBondContact CG-OE1 3.43Å; Q468-E472 PolarHBondContact NE2-OE1 3.22Å; Q468-E472 WeakPolarHBondContact O-CG 3.4Å; Q468-E472 PolarHBondContact O-N 2.91Å
469	Q	65	Low	56.7	Low	136 Å²	136	113.7 Å²	113.7	64%	0.636	59%	0.588	S	S	*	*	H	α-helix	trans	-72.7	-28.6	-179	-164.9	165.8	54.6	0	0	113	K465 H466 K473	K465-Q469 WeakPolarHBondContact O-CB 3.33Å; K465-Q469 PolarHBondContact O-N 3.39Å; H466-Q469 CarbonylContact O-C 3.6Å; H466-Q469 PolarHBondContact O-N 3.01Å; Q469-K473 WeakPolarHBondContact O-CB 3.45Å; Q469-K473 PolarHBondContact O-N 3.23Å
470	E	59.3	Low	56.2	Low	81 Å²	81	111.6 Å²	111.6	38%	0.379	58%	0.583	S	S	.	*	H	α-helix	trans	-72.2	-36.3	172.6	-175.3	161.5	-156	0	0	111.4	H466 M474	H466-E470 IonicContact CE1-OE2 3.22Å; H466-E470 PolarHBondContact CE1-OE2 2.7Å; H466-E470 IonicContact ND1-OE2 3.25Å; H466-E470 PolarHBondContact ND1-OE2 2.88Å; H466-E470 WeakPolarHBondContact O-CB 3.47Å; H466-E470 PolarHBondContact O-N 2.97Å; E470-M474 HydrophobicContact CG-CE 3.91Å; E470-M474 WeakPolarHBondContact O-CG 3.28Å; E470-M474 PolarHBondContact O-N 2.96Å
471	A	62.2	Low	55.3	Low	32 Å²	32	108.4 Å²	108.4	26%	0.264	57%	0.569	S	S	.	*	H	α-helix	trans	-65.7	-47.9	169	0	0	0	0	0	112.3	L467 Q468 K473 M474 V475 W903	L467-A471 WeakPolarHBondContact O-CB 3.45Å; L467-A471 PolarHBondContact O-N 3.06Å; Q468-A471 PolarHBondContact O-N 3.33Å; A471-K473 VanDerWaalsContact C-N 3.31Å; A471-K473 PolarHBondContact O-N 3.46Å; A471-M474 PolarHBondContact O-N 3.29Å; A471-V475 WeakPolarHBondContact O-CG2 3.31Å; A471-V475 PolarHBondContact O-N 3.47Å; A471-W903 HydrophobicContact CB-CH2 4.39Å
472	E	60.3	Low	54.9	Low	107 Å²	107	107.3 Å²	107.3	50%	0.5	57%	0.571	S	S	.	*	H	α-helix	trans	-61.2	-38.4	177.5	-74.9	168.4	-166	0	0	112	Q468 V475 A476	Q468-E472 WeakPolarHBondContact CG-OE1 3.43Å; Q468-E472 PolarHBondContact NE2-OE1 3.22Å; Q468-E472 WeakPolarHBondContact O-CG 3.4Å; Q468-E472 PolarHBondContact O-N 2.91Å; E472-V475 PolarHBondContact O-N 3Å; E472-A476 WeakPolarHBondContact O-CB 3.47Å; E472-A476 PolarHBondContact O-N 3.47Å
473	K	60.7	Low	54	Low	162 Å²	162	108.7 Å²	108.7	70%	0.704	58%	0.58	S	S	*	*	H	α-helix	trans	-63.3	-39.2	174.6	-177.7	179.6	177.1	-174.5	0	113	Q469 A471 S477	Q469-K473 WeakPolarHBondContact O-CB 3.45Å; Q469-K473 PolarHBondContact O-N 3.23Å; A471-K473 VanDerWaalsContact C-N 3.31Å; A471-K473 PolarHBondContact O-N 3.46Å; K473-S477 PolarHBondContact O-N 3.07Å
474	M	60.3	Low	53.3	Low	80 Å²	80	113.8 Å²	113.8	39%	0.394	59%	0.589	S	S	.	*	H	α-helix	trans	-70.8	-37.3	175	-69.1	-168	-143.4	0	0	112.1	E470 A471 S477 W903	E470-M474 HydrophobicContact CG-CE 3.91Å; E470-M474 WeakPolarHBondContact O-CG 3.28Å; E470-M474 PolarHBondContact O-N 2.96Å; A471-M474 PolarHBondContact O-N 3.29Å; M474-S477 PolarHBondContact O-N 2.84Å; M474-S477 PolarHBondContact O-OG 3.49Å; M474-W903 HydrophobicContact CE-CE3 4.37Å; M474-W903 HydrophobicContact CE-CH2 3.67Å; M474-W903 HydrophobicContact CE-CZ3 3.4Å; M474-W903 VanDerWaalsContact CE-CZ3 3.4Å; M474-W903 HydrophobicContact CG-CH2 4.4Å; M474-W903 HydrophobicContact SD-CH2 3.51Å; M474-W903 VanDerWaalsContact SD-CH2 3.51Å; M474-W903 HydrophobicContact SD-CZ2 4.23Å; M474-W903 HydrophobicContact SD-CZ3 3.76Å
475	V	59.7	Low	52.6	Low	87 Å²	87	113.5 Å²	113.5	53%	0.527	59%	0.585	S	S	.	*	H	α-helix	trans	-66.7	-43.2	176.3	174	0	0	0	0	111.8	A471 E472 S477 L478	A471-V475 WeakPolarHBondContact O-CG2 3.31Å; A471-V475 PolarHBondContact O-N 3.47Å; E472-V475 PolarHBondContact O-N 3Å; V475-S477 VanDerWaalsContact C-N 3.31Å; V475-S477 PolarHBondContact O-N 3.25Å; V475-L478 PolarHBondContact O-N 3.4Å; V475-L478 VanDerWaalsContact O-N 3.11Å
476	A	50.4	Low	51.8	Low	46 Å²	46	114 Å²	114	38%	0.38	59%	0.589	S	S	.	*	H	α-helix	trans	-60	-40.7	176.6	0	0	0	0	0	112.2	E472 L478 Q479 D480	E472-A476 WeakPolarHBondContact O-CB 3.47Å; E472-A476 PolarHBondContact O-N 3.47Å; A476-L478 PolarHBondContact O-N 3.45Å; A476-Q479 PolarHBondContact O-N 3.12Å; A476-D480 PolarHBondContact O-N 2.81Å
477	S	50.1	Low	51.2	Low	78 Å²	78	113.6 Å²	113.6	55%	0.545	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.3	-10.3	177.4	72.7	0	0	0	0	115.1	K473 M474 V475	K473-S477 PolarHBondContact O-N 3.07Å; M474-S477 PolarHBondContact O-N 2.84Å; M474-S477 PolarHBondContact O-OG 3.49Å; V475-S477 VanDerWaalsContact C-N 3.31Å; V475-S477 PolarHBondContact O-N 3.25Å
478	L	51.5	Low	49.8	Very low	141 Å²	141	115 Å²	115	74%	0.738	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	2.9	176.9	-68.6	169.9	0	0	0	113.5	V475 A476	V475-L478 PolarHBondContact O-N 3.4Å; V475-L478 VanDerWaalsContact O-N 3.11Å; A476-L478 PolarHBondContact O-N 3.45Å
479	Q	46.9	Very low	48.5	Very low	137 Å²	137	112.8 Å²	112.8	64%	0.64	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	-38	177.2	-67.1	-168.8	-18.4	0	0	113.1	A476 T481 S482	A476-Q479 PolarHBondContact O-N 3.12Å; Q479-T481 VanDerWaalsContact C-N 3.26Å; Q479-T481 PolarHBondContact O-N 2.79Å; Q479-S482 VanDerWaalsContact O-CB 3.26Å; Q479-S482 WeakPolarHBondContact O-CB 3.25Å; Q479-S482 PolarHBondContact O-N 3.49Å; Q479-S482 VanDerWaalsContact O-N 3.14Å
480	D	37.3	Very low	47.4	Very low	135 Å²	135	113.3 Å²	113.3	72%	0.722	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-5.1	-175.8	-78	-23.5	0	0	0	115.1	A476 S482	A476-D480 PolarHBondContact O-N 2.81Å; D480-S482 VanDerWaalsContact C-N 3.34Å
481	T	36.6	Very low	46.3	Very low	90 Å²	90	112.5 Å²	112.5	55%	0.552	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-11.2	168.8	61.8	0	0	0	0	113.4	Q479 M483	Q479-T481 VanDerWaalsContact C-N 3.26Å; Q479-T481 PolarHBondContact O-N 2.79Å; T481-M483 VanDerWaalsContact C-N 3.31Å; T481-M483 PolarHBondContact O-N 2.93Å
482	S	43.2	Very low	45.4	Very low	102 Å²	102	113.9 Å²	113.9	71%	0.713	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-4.7	-168.8	-158.1	0	0	0	0	115	Q479 D480	Q479-S482 VanDerWaalsContact O-CB 3.26Å; Q479-S482 WeakPolarHBondContact O-CB 3.25Å; Q479-S482 PolarHBondContact O-N 3.49Å; Q479-S482 VanDerWaalsContact O-N 3.14Å; D480-S482 VanDerWaalsContact C-N 3.34Å
483	M	35.2	Very low	44.3	Very low	180 Å²	180	114.1 Å²	114.1	89%	0.887	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.7	14.2	-176.4	-143	-176.5	72.1	0	0	115.7	T481	T481-M483 VanDerWaalsContact C-N 3.31Å; T481-M483 PolarHBondContact O-N 2.93Å
484	E	42.3	Very low	43.3	Very low	158 Å²	158	113.7 Å²	113.7	74%	0.738	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-19.8	164.6	-64.1	-164.2	-125.8	0	0	112.2	E486 C487	E484-E486 PolarHBondContact O-N 2.96Å; E484-E486 VanDerWaalsContact O-N 3.08Å; E484-C487 PolarHBondContact O-N 2.77Å
485	E	44.3	Very low	42.4	Very low	134 Å²	134	115.4 Å²	115.4	63%	0.626	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	13.1	-177.1	-67.3	-161.3	127.6	0	0	115.7	T489	E485-T489 VanDerWaalsContact O-CB 3.3Å; E485-T489 WeakPolarHBondContact O-CB 3.38Å; E485-T489 WeakPolarHBondContact O-CG2 3.37Å; E485-T489 PolarHBondContact O-OG1 3.29Å
486	E	43.7	Very low	41.4	Very low	172 Å²	172	114.5 Å²	114.5	80%	0.804	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-18.8	168.8	-70.6	-156.3	149.7	0	0	114.3	E484 T489	E484-E486 PolarHBondContact O-N 2.96Å; E484-E486 VanDerWaalsContact O-N 3.08Å; E486-T489 WeakPolarHBondContact CA-OG1 3.32Å
487	C	38.8	Very low	40.5	Very low	108 Å²	108	118.9 Å²	118.9	73%	0.73	61%	0.614	S	S	*	*	H	α-helix	trans	-92	-37.1	175.3	-163.5	0	0	0	0	112.2	E484 S491	E484-C487 PolarHBondContact O-N 2.77Å; C487-S491 PolarHBondContact O-OG 2.56Å
488	F	33.2	Very low	39.8	Very low	138 Å²	138	119.3 Å²	119.3	61%	0.605	62%	0.617	S	S	*	*	H	α-helix	trans	-72.9	-32.9	173	-169.1	-116	0	0	0	112	S491 L492	F488-S491 PolarHBondContact O-N 2.86Å; F488-S491 PolarHBondContact O-OG 2.89Å; F488-L492 HydrophobicContact CD1-CD2 4.41Å; F488-L492 HydrophobicContact CE1-CB 4.36Å; F488-L492 HydrophobicContact CE1-CD1 4.41Å; F488-L492 HydrophobicContact CE1-CD2 3.93Å; F488-L492 HydrophobicContact CE1-CG 4.47Å; F488-L492 HydrophobicContact CZ-CD1 4.29Å; F488-L492 WeakPolarHBondContact O-CB 3.3Å; F488-L492 PolarHBondContact O-N 3Å
489	T	37.9	Very low	39	Very low	65 Å²	65	120 Å²	120	40%	0.399	61%	0.609	S	S	.	*	H	α-helix	trans	-70.5	-35.8	176.6	51.8	0	0	0	0	113.4	E485 E486 S491 L492 Q493	E485-T489 VanDerWaalsContact O-CB 3.3Å; E485-T489 WeakPolarHBondContact O-CB 3.38Å; E485-T489 WeakPolarHBondContact O-CG2 3.37Å; E485-T489 PolarHBondContact O-OG1 3.29Å; E486-T489 WeakPolarHBondContact CA-OG1 3.32Å; T489-S491 VanDerWaalsContact C-N 3.26Å; T489-S491 PolarHBondContact O-N 3.23Å; T489-L492 PolarHBondContact O-N 2.88Å; T489-Q493 WeakPolarHBondContact O-CB 3.16Å; T489-Q493 PolarHBondContact O-N 2.91Å
490	H	41.5	Very low	38.6	Very low	146 Å²	146	119.1 Å²	119.1	68%	0.676	61%	0.61	S	S	*	*	H	α-helix	trans	-65.7	-30.1	175.9	-166.8	-65.2	0	0	0	112.6
491	S	36.2	Very low	38.5	Very low	64 Å²	64	116.8 Å²	116.8	45%	0.448	60%	0.6	S	S	.	*	H	α-helix	trans	-82.7	-40.3	175.1	41.9	0	0	0	0	112.1	C487 F488 T489 Q495	C487-S491 PolarHBondContact O-OG 2.56Å; F488-S491 PolarHBondContact O-N 2.86Å; F488-S491 PolarHBondContact O-OG 2.89Å; T489-S491 VanDerWaalsContact C-N 3.26Å; T489-S491 PolarHBondContact O-N 3.23Å; S491-Q495 PolarHBondContact O-N 3.24Å
492	L	42.9	Very low	38.4	Very low	61 Å²	61	115.6 Å²	115.6	32%	0.319	60%	0.6	S	S	.	*	H	α-helix	trans	-69.7	-39.8	177.1	-170.1	69.2	0	0	0	112.3	F488 T489 Q494 Q495 Q496	F488-L492 HydrophobicContact CD1-CD2 4.41Å; F488-L492 HydrophobicContact CE1-CB 4.36Å; F488-L492 HydrophobicContact CE1-CD1 4.41Å; F488-L492 HydrophobicContact CE1-CD2 3.93Å; F488-L492 HydrophobicContact CE1-CG 4.47Å; F488-L492 HydrophobicContact CZ-CD1 4.29Å; F488-L492 WeakPolarHBondContact O-CB 3.3Å; F488-L492 PolarHBondContact O-N 3Å; T489-L492 PolarHBondContact O-N 2.88Å; L492-Q494 PolarHBondContact O-N 3.22Å; L492-Q495 CarbonylContact O-C 3.57Å; L492-Q495 WeakPolarHBondContact O-CA 3.3Å; L492-Q495 PolarHBondContact O-N 2.84Å; L492-Q496 VanDerWaalsContact O-CB 3.29Å; L492-Q496 WeakPolarHBondContact O-CB 3.29Å; L492-Q496 PolarHBondContact O-N 3.11Å
493	Q	38.2	Very low	38.1	Very low	112 Å²	112	115.6 Å²	115.6	52%	0.523	61%	0.605	S	S	.	*	H	α-helix	trans	-58.7	-45.6	-179.7	-176.2	68.7	26.8	0	0	111.3	T489 Q495 Q496 E497	T489-Q493 WeakPolarHBondContact O-CB 3.16Å; T489-Q493 PolarHBondContact O-N 2.91Å; Q493-Q495 PolarHBondContact O-N 2.65Å; Q493-Q496 PolarHBondContact O-N 2.66Å; Q493-Q496 VanDerWaalsContact O-N 3.13Å; Q493-E497 PolarHBondContact O-N 3.27Å; Q493-E497 VanDerWaalsContact O-N 3.09Å
494	Q	39.5	Very low	38.1	Very low	153 Å²	153	111.6 Å²	111.6	72%	0.715	60%	0.601	S	S	*	*	H	α-helix	trans	-65.1	-27.8	175.9	-175.1	164.4	84.6	0	0	112.5	L492	L492-Q494 PolarHBondContact O-N 3.22Å
495	Q	40.6	Very low	37.5	Very low	117 Å²	117	109.8 Å²	109.8	55%	0.547	60%	0.596	S	S	.	*	H	α-helix	trans	-83.3	-27.3	172.5	-155.6	169.9	29.4	0	0	112.8	S491 L492 Q493 S498	S491-Q495 PolarHBondContact O-N 3.24Å; L492-Q495 CarbonylContact O-C 3.57Å; L492-Q495 WeakPolarHBondContact O-CA 3.3Å; L492-Q495 PolarHBondContact O-N 2.84Å; Q493-Q495 PolarHBondContact O-N 2.65Å; Q495-S498 PolarHBondContact O-N 2.76Å; Q495-S498 PolarHBondContact O-OG 3.41Å
496	Q	40.3	Very low	37.1	Very low	68 Å²	68	108.9 Å²	108.9	32%	0.318	60%	0.601	S	S	.	*	H	α-helix	trans	-77	-37.3	-176.9	-159.7	73	26.7	0	0	112	L492 Q493 S498 R499 N500	L492-Q496 VanDerWaalsContact O-CB 3.29Å; L492-Q496 WeakPolarHBondContact O-CB 3.29Å; L492-Q496 PolarHBondContact O-N 3.11Å; Q493-Q496 PolarHBondContact O-N 2.66Å; Q493-Q496 VanDerWaalsContact O-N 3.13Å; Q496-S498 PolarHBondContact O-N 3.29Å; Q496-R499 PolarHBondContact O-N 2.94Å; Q496-N500 PolarHBondContact NE2-ND2 3.16Å; Q496-N500 VanDerWaalsContact NE2-ND2 3.11Å; Q496-N500 PolarHBondContact NE2-OD1 3.43Å; Q496-N500 VanDerWaalsContact NE2-OD1 3.15Å; Q496-N500 PolarHBondContact O-N 3.31Å
497	E	31	Very low	37.1	Very low	137 Å²	137	107.2 Å²	107.2	64%	0.64	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-24.7	172.4	-71.4	-172	142.9	0	0	112.2	Q493 R499	Q493-E497 PolarHBondContact O-N 3.27Å; Q493-E497 VanDerWaalsContact O-N 3.09Å; E497-R499 VanDerWaalsContact C-N 3.3Å; E497-R499 PolarHBondContact O-N 3.45Å
498	S	35.9	Very low	37.2	Very low	88 Å²	88	106.1 Å²	106.1	62%	0.615	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-7.2	171.8	83.3	0	0	0	0	114.7	Q495 Q496	Q495-S498 PolarHBondContact O-N 2.76Å; Q495-S498 PolarHBondContact O-OG 3.41Å; Q496-S498 PolarHBondContact O-N 3.29Å
499	R	34.8	Very low	38	Very low	154 Å²	154	106.7 Å²	106.7	58%	0.581	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.3	-33.6	-174.3	-92.3	-175.8	150.6	158.2	-2.6	115.9	Q496 E497 T501	Q496-R499 PolarHBondContact O-N 2.94Å; E497-R499 VanDerWaalsContact C-N 3.3Å; E497-R499 PolarHBondContact O-N 3.45Å; R499-T501 PolarHBondContact O-N 3.06Å
500	N	37.8	Very low	38.7	Very low	120 Å²	120	109.6 Å²	109.6	64%	0.642	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	5.2	-171.3	-84.3	11.8	0	0	0	115.6	Q496	Q496-N500 PolarHBondContact NE2-ND2 3.16Å; Q496-N500 VanDerWaalsContact NE2-ND2 3.11Å; Q496-N500 PolarHBondContact NE2-OD1 3.43Å; Q496-N500 VanDerWaalsContact NE2-OD1 3.15Å; Q496-N500 PolarHBondContact O-N 3.31Å
501	T	34	Very low	39.5	Very low	85 Å²	85	104.9 Å²	104.9	52%	0.521	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.3	-11.1	-178.7	45.7	0	0	0	0	114.7	R499 A503	R499-T501 PolarHBondContact O-N 3.06Å; T501-A503 PolarHBondContact O-N 3.46Å
502	A	34.8	Very low	40.5	Very low	66 Å²	66	103.2 Å²	103.2	55%	0.545	58%	0.581	S	S	.	*	S	Bend	trans	-80.1	-12.2	-167.4	0	0	0	0	0	116.6
503	A	36.6	Very low	41.4	Very low	101 Å²	101	104.4 Å²	104.4	84%	0.835	59%	0.585	S	S	*	*	S	Bend	trans	-117.4	-20.8	-163.4	0	0	0	0	0	117.1	T501	T501-A503 PolarHBondContact O-N 3.46Å
504	A	35.1	Very low	43.6	Very low	96 Å²	96	102.5 Å²	102.5	79%	0.793	58%	0.575	S	S	*	*	S	Bend	trans	-152.1	22.5	-166.8	0	0	0	0	0	116.2
505	L	31	Very low	45.8	Very low	121 Å²	121	95.6 Å²	95.6	63%	0.634	54%	0.543	S	S	*	.	S	Bend	trans	-118.8	152.9	173.1	-72.1	176.9	0	0	0	110.8	L507	L505-L507 PolarHBondContact O-N 3.12Å
506	P	35.7	Very low	48.1	Very low	114 Å²	114	92.7 Å²	92.7	74%	0.74	53%	0.529	S	S	*	.			trans	-59.3	139.5	172.4	26.8	-34.8	0	0	0	109.6	S508	P506-S508 PolarHBondContact O-N 2.65Å
507	L	42.7	Very low	50.5	Low	138 Å²	138	91.6 Å²	91.6	72%	0.723	52%	0.522	S	S	*	.			trans	-64.4	97.7	176	-71.6	83.5	0	0	0	109	L505 H509 A512	L505-L507 PolarHBondContact O-N 3.12Å; L507-H509 PolarHBondContact O-N 3.32Å; L507-A512 HydrophobicContact CD2-CB 4.46Å
508	S	42.7	Very low	53.3	Low	84 Å²	84	88.9 Å²	88.9	59%	0.587	51%	0.508	S	S	*	.			trans	-61.5	130.5	161.4	60.8	0	0	0	0	107.3	P506 E510	P506-S508 PolarHBondContact O-N 2.65Å; S508-E510 PolarHBondContact O-N 3.16Å
509	H	48.3	Very low	55.6	Low	151 Å²	151	85.9 Å²	85.9	70%	0.699	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.4	-164.3	-168.5	63.3	0	0	0	114	L507 M513	L507-H509 PolarHBondContact O-N 3.32Å; H509-M513 VanDerWaalsContact CE1-CE 3.49Å; H509-M513 WeakPolarHBondContact CE1-CE 3.27Å; H509-M513 WeakPolarHBondContact O-CG 3.25Å
510	E	53.5	Low	57.7	Low	125 Å²	125	84.5 Å²	84.5	58%	0.584	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-37.8	-168.5	-142.3	-168.5	123.9	0	0	114.4	S508 K514	S508-E510 PolarHBondContact O-N 3.16Å; E510-K514 WeakPolarHBondContact O-CG 3.36Å; E510-K514 WeakPolarHBondContact OE1-CE 3.33Å; E510-K514 IonicContact OE1-NZ 3.12Å; E510-K514 PolarHBondContact OE1-NZ 3.19Å
511	A	58.1	Low	59.5	Low	48 Å²	48	86.3 Å²	86.3	40%	0.397	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-32.2	-174.1	0	0	0	0	0	112.9	M513	A511-M513 VanDerWaalsContact C-N 3.34Å
512	A	58.1	Low	61.6	Low	28 Å²	28	83.4 Å²	83.4	23%	0.231	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-14.4	177	0	0	0	0	0	113.6	L507	L507-A512 HydrophobicContact CD2-CB 4.46Å
513	M	61.8	Low	64	Low	86 Å²	86	86.5 Å²	86.5	42%	0.424	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-10.4	176.6	-74	-67.5	-173.1	0	0	113.7	H509 A511 T530	H509-M513 VanDerWaalsContact CE1-CE 3.49Å; H509-M513 WeakPolarHBondContact CE1-CE 3.27Å; H509-M513 WeakPolarHBondContact O-CG 3.25Å; A511-M513 VanDerWaalsContact C-N 3.34Å; M513-T530 PolarHBondContact O-N 3.36Å; M513-T530 PolarHBondContact O-OG1 3.06Å
514	K	82.6	Confident	66.6	Low	72 Å²	72	86.2 Å²	86.2	31%	0.313	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128.6	-179	-73.3	173.4	-174.2	176.8	0	110.8	E510 P527 F528 G551	E510-K514 WeakPolarHBondContact O-CG 3.36Å; E510-K514 WeakPolarHBondContact OE1-CE 3.33Å; E510-K514 IonicContact OE1-NZ 3.12Å; E510-K514 PolarHBondContact OE1-NZ 3.19Å; K514-P527 HydrophobicContact CB-CB 3.86Å; K514-P527 HydrophobicContact CD-CB 3.93Å; K514-P527 HydrophobicContact CD-CG 4.34Å; K514-P527 HydrophobicContact CG-CB 3.88Å; K514-F528 CarbonylContact C-O 3.59Å; K514-F528 WeakPolarHBondContact CA-O 3.3Å; K514-G551 PolarHBondContact O-N 3.49Å
515	W	86.3	Confident	68.9	Low	8 Å²	8	85 Å²	85	3%	0.03	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	150.4	-179.8	-72.9	90.7	0	0	0	111.5	P527 F528 T530 M533 R550 W566 P570 F571	W515-P527 WeakPolarHBondContact O-CA 3.5Å; W515-F528 PolarHBondContact N-O 3.05Å; W515-F528 PolarHBondContact O-N 3.01Å; W515-T530 PolarHBondContact NE1-OG1 3.14Å; W515-M533 HydrophobicContact CB-CE 4.09Å; W515-M533 HydrophobicContact CB-CG 3.59Å; W515-M533 HydrophobicContact CB-SD 4.03Å; W515-M533 HydrophobicContact CG-CG 3.89Å; W515-R550 HydrophobicContact CD2-CG 3.92Å; W515-R550 HydrophobicContact CE3-CG 3.69Å; W515-R550 HydrophobicContact CH2-CG 3.31Å; W515-R550 HydrophobicContact CZ2-CG 3.56Å; W515-R550 HydrophobicContact CZ3-CG 3.39Å; W515-W566 AromaticContact CH2-CH2 3.87Å; W515-W566 HydrophobicContact CH2-CH2 3.87Å; W515-W566 AromaticContact CH2-CZ3 3.86Å; W515-W566 HydrophobicContact CH2-CZ3 3.86Å; W515-W566 HydrophobicContact CZ2-CZ3 4.48Å; W515-P570 HydrophobicContact CH2-CB 3.63Å; W515-P570 HydrophobicContact CZ2-CB 4.19Å; W515-P570 HydrophobicContact CZ3-CB 4.28Å; W515-F571 AromaticContact CD2-CD1 4Å; W515-F571 HydrophobicContact CD2-CD1 4Å; W515-F571 AromaticContact CD2-CE1 3.7Å; W515-F571 HydrophobicContact CD2-CE1 3.7Å; W515-F571 AromaticContact CE2-CD1 3.75Å; W515-F571 AromaticContact CE2-CE1 3.9Å; W515-F571 HydrophobicContact CE3-CD1 4.35Å; W515-F571 AromaticContact CE3-CE1 3.64Å; W515-F571 HydrophobicContact CE3-CE1 3.64Å; W515-F571 HydrophobicContact CG-CE1 4.35Å; W515-F571 HydrophobicContact CH2-CD1 4.26Å; W515-F571 AromaticContact CH2-CE1 3.98Å; W515-F571 HydrophobicContact CH2-CE1 3.98Å; W515-F571 AromaticContact CZ2-CD1 3.9Å; W515-F571 HydrophobicContact CZ2-CD1 3.9Å; W515-F571 HydrophobicContact CZ2-CE1 4.04Å; W515-F571 HydrophobicContact CZ3-CD1 4.47Å; W515-F571 AromaticContact CZ3-CE1 3.78Å; W515-F571 HydrophobicContact CZ3-CE1 3.78Å
516	F	88.8	Confident	71.6	Confident	56 Å²	56	80.8 Å²	80.8	25%	0.246	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	142.5	172.5	-58.5	-91.3	0	0	0	108.6	I524 Q525 P527 V548 K549 F556	F516-I524 HydrophobicContact CB-CG2 4.13Å; F516-I524 HydrophobicContact CD1-CG2 4.05Å; F516-I524 HydrophobicContact CG-CG2 4.46Å; F516-Q525 CarbonylContact C-O 3.58Å; F516-Q525 VanDerWaalsContact CA-O 3.27Å; F516-Q525 WeakPolarHBondContact CA-O 3.5Å; F516-P527 HydrophobicContact CE1-CB 3.9Å; F516-P527 HydrophobicContact CE2-CB 4.4Å; F516-P527 HydrophobicContact CZ-CB 3.72Å; F516-P527 HydrophobicContact CZ-CG 4.5Å; F516-V548 CarbonylContact O-C 3.54Å; F516-V548 WeakPolarHBondContact O-CA 3.5Å; F516-K549 PolarHBondContact N-O 3.37Å; F516-K549 PolarHBondContact O-N 2.67Å; F516-F556 HydrophobicContact CB-CE1 4.1Å; F516-F556 HydrophobicContact CB-CZ 4.27Å
517	Y	90.4	Very high	74	Confident	45 Å²	45	78.9 Å²	78.9	18%	0.176	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	154.1	166.5	69.6	-98.7	0	0	0	110.7	D519 Q525 F528 M533 W536 F542 L546 L547	Y517-D519 HydrophobicContact CD2-CB 4.48Å; Y517-D519 HydrophobicContact CE2-CB 4.11Å; Y517-Q525 HydrophobicContact CD1-CB 4.25Å; Y517-Q525 HydrophobicContact CD2-CB 4.07Å; Y517-Q525 HydrophobicContact CD2-CG 4.28Å; Y517-Q525 HydrophobicContact CE1-CB 3.91Å; Y517-Q525 HydrophobicContact CE2-CB 3.7Å; Y517-Q525 HydrophobicContact CE2-CG 3.68Å; Y517-Q525 HydrophobicContact CG-CB 4.33Å; Y517-Q525 PolarHBondContact N-O 2.88Å; Y517-Q525 PolarHBondContact O-N 3.38Å; Y517-F528 AromaticContact CD1-CD2 3.93Å; Y517-F528 HydrophobicContact CD1-CD2 3.93Å; Y517-F528 AromaticContact CD1-CE2 3.71Å; Y517-F528 HydrophobicContact CD1-CE2 3.71Å; Y517-F528 AromaticContact CE1-CD2 3.81Å; Y517-F528 HydrophobicContact CE1-CD2 3.81Å; Y517-F528 AromaticContact CE1-CE2 3.29Å; Y517-F528 HydrophobicContact CE1-CE2 3.29Å; Y517-F528 HydrophobicContact CE1-CZ 4.13Å; Y517-M533 HydrophobicContact CD1-CE 3.99Å; Y517-M533 HydrophobicContact CD1-SD 3.87Å; Y517-M533 HydrophobicContact CE1-SD 4.42Å; Y517-W536 HydrophobicContact CE1-CE3 4.32Å; Y517-W536 HydrophobicContact CE1-CZ3 4.07Å; Y517-F542 HydrophobicContact CD1-CE1 4.01Å; Y517-F542 AromaticContact CD1-CZ 3.84Å; Y517-F542 HydrophobicContact CD1-CZ 3.84Å; Y517-F542 AromaticContact CE1-CE1 3.89Å; Y517-F542 HydrophobicContact CE1-CE1 3.89Å; Y517-F542 AromaticContact CE1-CZ 3.97Å; Y517-F542 HydrophobicContact CE1-CZ 3.97Å; Y517-F542 HydrophobicContact CG-CE1 4.44Å; Y517-L546 HydrophobicContact CD2-CD1 4.05Å; Y517-L546 HydrophobicContact CD2-CD2 4.24Å; Y517-L546 HydrophobicContact CD2-CG 4.48Å; Y517-L546 HydrophobicContact CG-CD2 4.16Å; Y517-L547 CarbonylContact C-O 3.59Å; Y517-L547 VanDerWaalsContact CA-O 3.25Å; Y517-L547 WeakPolarHBondContact CA-O 3.42Å
518	K	89.8	Confident	76	Confident	81 Å²	81	74.2 Å²	74.2	35%	0.352	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120.1	170.7	-152	-172.9	-178.2	-167.7	0	108.1	G522 E523 I524 L546 L547 F556	K518-G522 VanDerWaalsContact CE-C 3.48Å; K518-G522 WeakPolarHBondContact CE-O 3.5Å; K518-E523 VanDerWaalsContact CA-O 3.31Å; K518-E523 WeakPolarHBondContact CA-O 3.23Å; K518-I524 HydrophobicContact CG-CG1 4.46Å; K518-L546 VanDerWaalsContact O-CD1 3.25Å; K518-L546 WeakPolarHBondContact O-CD1 3.5Å; K518-L547 HydrophobicContact CB-CB 3.84Å; K518-L547 HydrophobicContact CB-CD1 4.46Å; K518-L547 HydrophobicContact CD-CD1 4.04Å; K518-L547 PolarHBondContact N-O 2.93Å; K518-F556 HydrophobicContact CB-CD1 4.47Å; K518-F556 HydrophobicContact CB-CE1 4.48Å
519	D	85.4	Confident	78.1	Confident	25 Å²	25	73.4 Å²	73.4	13%	0.134	39%	0.391	C	S	.	.			trans	-73.6	171.2	178.8	64.5	28.3	0	0	0	112	Y517 Q521 G522 E523 Q525	Y517-D519 HydrophobicContact CD2-CB 4.48Å; Y517-D519 HydrophobicContact CE2-CB 4.11Å; D519-Q521 PolarHBondContact O-N 3.11Å; D519-Q521 WeakPolarHBondContact OD1-CA 3.21Å; D519-Q521 WeakPolarHBondContact OD1-CB 3.29Å; D519-Q521 PolarHBondContact OD1-N 3.01Å; D519-Q521 VanDerWaalsContact OD1-N 3.11Å; D519-Q521 PolarHBondContact OD1-OE1 3.42Å; D519-G522 PolarHBondContact O-N 2.94Å; D519-G522 VanDerWaalsContact O-N 3.07Å; D519-G522 PolarHBondContact OD1-N 2.87Å; D519-E523 PolarHBondContact N-O 3.2Å; D519-E523 PolarHBondContact OD1-N 3.28Å; D519-Q525 HydrophobicContact CB-CG 4.24Å; D519-Q525 PolarHBondContact OD2-NE2 3.04Å
520	P	78	Confident	79.9	Confident	124 Å²	124	67.5 Å²	67.5	81%	0.805	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.5	177.7	-26.3	36.7	0	0	0	114.9	G522	P520-G522 VanDerWaalsContact C-N 3.34Å
521	Q	75.2	Confident	81.3	Confident	158 Å²	158	65.8 Å²	65.8	74%	0.738	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-26.8	175.9	-65.4	74.5	6.4	0	0	111.2	D519	D519-Q521 PolarHBondContact O-N 3.11Å; D519-Q521 WeakPolarHBondContact OD1-CA 3.21Å; D519-Q521 WeakPolarHBondContact OD1-CB 3.29Å; D519-Q521 PolarHBondContact OD1-N 3.01Å; D519-Q521 VanDerWaalsContact OD1-N 3.11Å; D519-Q521 PolarHBondContact OD1-OE1 3.42Å
522	G	79.6	Confident	82.7	Confident	25 Å²	25	67 Å²	67	26%	0.258	36%	0.361	S	S	.	.	S	Bend	trans	107.4	8.3	176.2	0	0	0	0	0	114.3	K518 D519 P520	K518-G522 VanDerWaalsContact CE-C 3.48Å; K518-G522 WeakPolarHBondContact CE-O 3.5Å; D519-G522 PolarHBondContact O-N 2.94Å; D519-G522 VanDerWaalsContact O-N 3.07Å; D519-G522 PolarHBondContact OD1-N 2.87Å; P520-G522 VanDerWaalsContact C-N 3.34Å
523	E	85.2	Confident	84	Confident	130 Å²	130	65.7 Å²	65.7	61%	0.607	35%	0.35	S	S	*	.			trans	-84.8	149.7	177.3	-65.7	-56	146.8	0	0	111.5	K518 D519	K518-E523 VanDerWaalsContact CA-O 3.31Å; K518-E523 WeakPolarHBondContact CA-O 3.23Å; D519-E523 PolarHBondContact N-O 3.2Å; D519-E523 PolarHBondContact OD1-N 3.28Å
524	I	89.4	Confident	85.2	Confident	96 Å²	96	62.5 Å²	62.5	49%	0.492	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	104.7	-179.7	-63.8	172	0	0	0	108.7	F516 K518 F556	F516-I524 HydrophobicContact CB-CG2 4.13Å; F516-I524 HydrophobicContact CD1-CG2 4.05Å; F516-I524 HydrophobicContact CG-CG2 4.46Å; K518-I524 HydrophobicContact CG-CG1 4.46Å; I524-F556 HydrophobicContact CB-CZ 4.41Å; I524-F556 HydrophobicContact CD1-CE2 3.8Å; I524-F556 HydrophobicContact CD1-CZ 3.82Å; I524-F556 HydrophobicContact CG1-CE2 4.2Å; I524-F556 HydrophobicContact CG1-CZ 3.8Å; I524-F556 HydrophobicContact CG2-CE1 4.47Å; I524-F556 HydrophobicContact CG2-CZ 3.77Å
525	Q	84.8	Confident	85.4	Confident	70 Å²	70	64.3 Å²	64.3	33%	0.327	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.3	177.8	-55.2	-61.9	-15.4	0	0	110	F516 Y517 D519 F528	F516-Q525 CarbonylContact C-O 3.58Å; F516-Q525 VanDerWaalsContact CA-O 3.27Å; F516-Q525 WeakPolarHBondContact CA-O 3.5Å; Y517-Q525 HydrophobicContact CD1-CB 4.25Å; Y517-Q525 HydrophobicContact CD2-CB 4.07Å; Y517-Q525 HydrophobicContact CD2-CG 4.28Å; Y517-Q525 HydrophobicContact CE1-CB 3.91Å; Y517-Q525 HydrophobicContact CE2-CB 3.7Å; Y517-Q525 HydrophobicContact CE2-CG 3.68Å; Y517-Q525 HydrophobicContact CG-CB 4.33Å; Y517-Q525 PolarHBondContact N-O 2.88Å; Y517-Q525 PolarHBondContact O-N 3.38Å; D519-Q525 HydrophobicContact CB-CG 4.24Å; D519-Q525 PolarHBondContact OD2-NE2 3.04Å; Q525-F528 HydrophobicContact CB-CE2 3.65Å; Q525-F528 HydrophobicContact CB-CZ 3.95Å; Q525-F528 WeakPolarHBondContact O-CE2 3.5Å
526	G	86.8	Confident	85.4	Confident	32 Å²	32	67.4 Å²	67.4	33%	0.33	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	147.1	-178.5	177.4	0	0	0	0	0	112.7	F528	G526-F528 VanDerWaalsContact CA-CE2 3.5Å; G526-F528 VanDerWaalsContact N-CE2 3.32Å
527	P	85.6	Confident	85.2	Confident	75 Å²	75	67 Å²	67	49%	0.487	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-81	129	4.4	30.4	-33.2	0	0	0	113.4	K514 W515 F516	K514-P527 HydrophobicContact CB-CB 3.86Å; K514-P527 HydrophobicContact CD-CB 3.93Å; K514-P527 HydrophobicContact CD-CG 4.34Å; K514-P527 HydrophobicContact CG-CB 3.88Å; W515-P527 WeakPolarHBondContact O-CA 3.5Å; F516-P527 HydrophobicContact CE1-CB 3.9Å; F516-P527 HydrophobicContact CE2-CB 4.4Å; F516-P527 HydrophobicContact CZ-CB 3.72Å; F516-P527 HydrophobicContact CZ-CG 4.5Å
528	F	86.6	Confident	84.9	Confident	39 Å²	39	71.8 Å²	71.8	17%	0.171	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	156.4	172.5	-54.3	-62.3	0	0	0	111.6	K514 W515 Y517 Q525 G526 M533 W536	K514-F528 CarbonylContact C-O 3.59Å; K514-F528 WeakPolarHBondContact CA-O 3.3Å; W515-F528 PolarHBondContact N-O 3.05Å; W515-F528 PolarHBondContact O-N 3.01Å; Y517-F528 AromaticContact CD1-CD2 3.93Å; Y517-F528 HydrophobicContact CD1-CD2 3.93Å; Y517-F528 AromaticContact CD1-CE2 3.71Å; Y517-F528 HydrophobicContact CD1-CE2 3.71Å; Y517-F528 AromaticContact CE1-CD2 3.81Å; Y517-F528 HydrophobicContact CE1-CD2 3.81Å; Y517-F528 AromaticContact CE1-CE2 3.29Å; Y517-F528 HydrophobicContact CE1-CE2 3.29Å; Y517-F528 HydrophobicContact CE1-CZ 4.13Å; Q525-F528 HydrophobicContact CB-CE2 3.65Å; Q525-F528 HydrophobicContact CB-CZ 3.95Å; Q525-F528 WeakPolarHBondContact O-CE2 3.5Å; G526-F528 VanDerWaalsContact CA-CE2 3.5Å; G526-F528 VanDerWaalsContact N-CE2 3.32Å; F528-M533 HydrophobicContact CB-CG 4.01Å; F528-M533 HydrophobicContact CB-SD 3.98Å; F528-M533 HydrophobicContact CD2-SD 3.87Å; F528-M533 HydrophobicContact CG-SD 4.31Å; F528-W536 HydrophobicContact CB-CZ3 4.13Å; F528-W536 AromaticContact CD1-CH2 3.54Å; F528-W536 HydrophobicContact CD1-CH2 3.54Å; F528-W536 AromaticContact CD1-CZ3 3.73Å; F528-W536 HydrophobicContact CD1-CZ3 3.73Å; F528-W536 HydrophobicContact CD2-CH2 4.33Å; F528-W536 AromaticContact CD2-CZ3 3.72Å; F528-W536 HydrophobicContact CD2-CZ3 3.72Å; F528-W536 AromaticContact CE1-CH2 3.63Å; F528-W536 HydrophobicContact CE1-CH2 3.63Å; F528-W536 HydrophobicContact CE1-CZ3 4.02Å; F528-W536 HydrophobicContact CE2-CH2 4.38Å; F528-W536 AromaticContact CE2-CZ3 3.98Å; F528-W536 HydrophobicContact CE2-CZ3 3.98Å; F528-W536 AromaticContact CG-CH2 3.91Å; F528-W536 HydrophobicContact CG-CH2 3.91Å; F528-W536 AromaticContact CG-CZ3 3.57Å; F528-W536 HydrophobicContact CG-CZ3 3.57Å; F528-W536 HydrophobicContact CZ-CH2 4.05Å; F528-W536 HydrophobicContact CZ-CZ3 4.13Å
529	T	86	Confident	84.6	Confident	67 Å²	67	71 Å²	71	41%	0.411	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	158.9	172.1	67.8	0	0	0	0	111.6	V531 E532 M533	T529-V531 PolarHBondContact O-N 3.39Å; T529-V531 VanDerWaalsContact O-N 3.17Å; T529-V531 PolarHBondContact OG1-N 3.03Å; T529-E532 WeakPolarHBondContact CA-OE2 3.48Å; T529-E532 VanDerWaalsContact CB-OE2 3.22Å; T529-E532 WeakPolarHBondContact CB-OE2 3.49Å; T529-E532 VanDerWaalsContact CG2-OE2 3.31Å; T529-E532 WeakPolarHBondContact CG2-OE2 3.26Å; T529-E532 PolarHBondContact N-OE2 2.95Å; T529-E532 PolarHBondContact O-N 2.85Å; T529-E532 WeakPolarHBondContact OG1-CG 3.21Å; T529-E532 PolarHBondContact OG1-N 3.3Å; T529-E532 PolarHBondContact OG1-OE2 3.4Å; T529-M533 WeakPolarHBondContact O-CG 3.3Å; T529-M533 PolarHBondContact O-N 2.81Å
530	T	85.3	Confident	84.6	Confident	28 Å²	28	72.7 Å²	72.7	17%	0.172	41%	0.412	C	S	.	.	H	α-helix	trans	-56.4	-25.4	169.8	-55.6	0	0	0	0	113	M513 W515 C534 F571	M513-T530 PolarHBondContact O-N 3.36Å; M513-T530 PolarHBondContact O-OG1 3.06Å; W515-T530 PolarHBondContact NE1-OG1 3.14Å; T530-C534 WeakPolarHBondContact O-CB 3.32Å; T530-C534 PolarHBondContact O-N 3.44Å; T530-F571 HydrophobicContact CG2-CB 4.47Å; T530-F571 WeakPolarHBondContact CG2-O 3.45Å
531	V	84	Confident	84.8	Confident	89 Å²	89	75.3 Å²	75.3	54%	0.539	41%	0.407	S	S	.	.	H	α-helix	trans	-77.3	-51.9	-179.5	-176.9	0	0	0	0	111.2	T529 M533 C534 E535	T529-V531 PolarHBondContact O-N 3.39Å; T529-V531 VanDerWaalsContact O-N 3.17Å; T529-V531 PolarHBondContact OG1-N 3.03Å; V531-M533 VanDerWaalsContact C-N 3.29Å; V531-M533 PolarHBondContact O-N 3.35Å; V531-C534 CarbonylContact O-C 3.55Å; V531-C534 WeakPolarHBondContact O-CA 3.47Å; V531-C534 VanDerWaalsContact O-CB 3.26Å; V531-C534 WeakPolarHBondContact O-CB 3.46Å; V531-C534 PolarHBondContact O-N 3.48Å; V531-E535 PolarHBondContact O-N 3.42Å
532	E	87.3	Confident	85.3	Confident	74 Å²	74	68.7 Å²	68.7	35%	0.346	38%	0.375	S	S	.	.	H	α-helix	trans	-57.2	-43.2	178.9	-67	154.7	123.3	0	0	111.4	T529 C534 E535 W536	T529-E532 WeakPolarHBondContact CA-OE2 3.48Å; T529-E532 VanDerWaalsContact CB-OE2 3.22Å; T529-E532 WeakPolarHBondContact CB-OE2 3.49Å; T529-E532 VanDerWaalsContact CG2-OE2 3.31Å; T529-E532 WeakPolarHBondContact CG2-OE2 3.26Å; T529-E532 PolarHBondContact N-OE2 2.95Å; T529-E532 PolarHBondContact O-N 2.85Å; T529-E532 WeakPolarHBondContact OG1-CG 3.21Å; T529-E532 PolarHBondContact OG1-N 3.3Å; T529-E532 PolarHBondContact OG1-OE2 3.4Å; E532-C534 VanDerWaalsContact C-N 3.25Å; E532-C534 PolarHBondContact O-N 3.28Å; E532-E535 PolarHBondContact O-N 2.98Å; E532-W536 HydrophobicContact CB-CE3 4.44Å; E532-W536 HydrophobicContact CB-CH2 4.23Å; E532-W536 HydrophobicContact CB-CZ2 4.42Å; E532-W536 HydrophobicContact CB-CZ3 4.23Å; E532-W536 PolarHBondContact O-N 3.4Å
533	M	85.9	Confident	85.5	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-63.2	-30.2	174.6	-62.6	-69.8	-68.1	0	0	113	W515 Y517 F528 T529 V531 W536 F537 F542 V548 F571	W515-M533 HydrophobicContact CB-CE 4.09Å; W515-M533 HydrophobicContact CB-CG 3.59Å; W515-M533 HydrophobicContact CB-SD 4.03Å; W515-M533 HydrophobicContact CG-CG 3.89Å; Y517-M533 HydrophobicContact CD1-CE 3.99Å; Y517-M533 HydrophobicContact CD1-SD 3.87Å; Y517-M533 HydrophobicContact CE1-SD 4.42Å; F528-M533 HydrophobicContact CB-CG 4.01Å; F528-M533 HydrophobicContact CB-SD 3.98Å; F528-M533 HydrophobicContact CD2-SD 3.87Å; F528-M533 HydrophobicContact CG-SD 4.31Å; T529-M533 WeakPolarHBondContact O-CG 3.3Å; T529-M533 PolarHBondContact O-N 2.81Å; V531-M533 VanDerWaalsContact C-N 3.29Å; V531-M533 PolarHBondContact O-N 3.35Å; M533-W536 HydrophobicContact SD-CE3 4.15Å; M533-W536 HydrophobicContact SD-CZ3 4.21Å; M533-F537 WeakPolarHBondContact O-CB 3.18Å; M533-F537 PolarHBondContact O-N 3.48Å; M533-F537 VanDerWaalsContact O-N 3.14Å; M533-F542 HydrophobicContact CB-CE2 4.22Å; M533-F542 HydrophobicContact CE-CE2 3.51Å; M533-F542 HydrophobicContact CE-CZ 3.61Å; M533-F542 WeakPolarHBondContact O-CE2 3.37Å; M533-F542 HydrophobicContact SD-CE2 3.89Å; M533-F542 HydrophobicContact SD-CZ 3.62Å; M533-V548 HydrophobicContact CE-CG1 4.27Å; M533-F571 HydrophobicContact CB-CB 4.32Å; M533-F571 HydrophobicContact CB-CD1 3.38Å; M533-F571 HydrophobicContact CB-CD2 4.16Å; M533-F571 HydrophobicContact CB-CE1 3.62Å; M533-F571 HydrophobicContact CB-CE2 4.37Å; M533-F571 HydrophobicContact CB-CG 3.67Å; M533-F571 HydrophobicContact CB-CZ 4.12Å; M533-F571 HydrophobicContact CE-CE1 3.7Å; M533-F571 HydrophobicContact CE-CZ 3.7Å; M533-F571 HydrophobicContact CG-CD1 4.25Å; M533-F571 HydrophobicContact CG-CE1 4.19Å; M533-F571 VanDerWaalsContact O-CD2 3.26Å; M533-F571 WeakPolarHBondContact O-CD2 3.32Å
534	C	85.3	Confident	85.5	Confident	18 Å²	18	70.2 Å²	70.2	12%	0.122	38%	0.383	C	S	.	.	H	α-helix	trans	-75.3	-38.8	175.4	-158.2	0	0	0	0	111.5	T530 V531 E532 Q538 F571	T530-C534 WeakPolarHBondContact O-CB 3.32Å; T530-C534 PolarHBondContact O-N 3.44Å; V531-C534 CarbonylContact O-C 3.55Å; V531-C534 WeakPolarHBondContact O-CA 3.47Å; V531-C534 VanDerWaalsContact O-CB 3.26Å; V531-C534 WeakPolarHBondContact O-CB 3.46Å; V531-C534 PolarHBondContact O-N 3.48Å; E532-C534 VanDerWaalsContact C-N 3.25Å; E532-C534 PolarHBondContact O-N 3.28Å; C534-Q538 WeakPolarHBondContact O-CB 3.07Å; C534-Q538 VanDerWaalsContact O-CG 3.27Å; C534-Q538 WeakPolarHBondContact O-CG 3.44Å; C534-Q538 PolarHBondContact O-N 2.94Å; C534-Q538 PolarHBondContact O-NE2 3.4Å; C534-F571 HydrophobicContact CB-CB 3.5Å; C534-F571 VanDerWaalsContact CB-CB 3.5Å
535	E	87.8	Confident	85.3	Confident	111 Å²	111	70.9 Å²	70.9	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-65.1	-46.3	175.1	-69.9	175.5	-174.6	0	0	111.1	V531 E532 F537 Q538 A539	V531-E535 PolarHBondContact O-N 3.42Å; E532-E535 PolarHBondContact O-N 2.98Å; E535-F537 VanDerWaalsContact C-N 3.32Å; E535-F537 PolarHBondContact O-N 2.9Å; E535-Q538 PolarHBondContact O-N 3.11Å; E535-A539 WeakPolarHBondContact O-CB 3.25Å; E535-A539 PolarHBondContact O-N 3.19Å
536	W	86.7	Confident	85.5	Confident	73 Å²	73	68.2 Å²	68.2	28%	0.277	38%	0.379	S	S	.	.	H	α-helix	trans	-66.8	-31.1	177	-63.6	-30.2	0	0	0	113.8	Y517 F528 E532 M533 G540 Y541 F542	Y517-W536 HydrophobicContact CE1-CE3 4.32Å; Y517-W536 HydrophobicContact CE1-CZ3 4.07Å; F528-W536 HydrophobicContact CB-CZ3 4.13Å; F528-W536 AromaticContact CD1-CH2 3.54Å; F528-W536 HydrophobicContact CD1-CH2 3.54Å; F528-W536 AromaticContact CD1-CZ3 3.73Å; F528-W536 HydrophobicContact CD1-CZ3 3.73Å; F528-W536 HydrophobicContact CD2-CH2 4.33Å; F528-W536 AromaticContact CD2-CZ3 3.72Å; F528-W536 HydrophobicContact CD2-CZ3 3.72Å; F528-W536 AromaticContact CE1-CH2 3.63Å; F528-W536 HydrophobicContact CE1-CH2 3.63Å; F528-W536 HydrophobicContact CE1-CZ3 4.02Å; F528-W536 HydrophobicContact CE2-CH2 4.38Å; F528-W536 AromaticContact CE2-CZ3 3.98Å; F528-W536 HydrophobicContact CE2-CZ3 3.98Å; F528-W536 AromaticContact CG-CH2 3.91Å; F528-W536 HydrophobicContact CG-CH2 3.91Å; F528-W536 AromaticContact CG-CZ3 3.57Å; F528-W536 HydrophobicContact CG-CZ3 3.57Å; F528-W536 HydrophobicContact CZ-CH2 4.05Å; F528-W536 HydrophobicContact CZ-CZ3 4.13Å; E532-W536 HydrophobicContact CB-CE3 4.44Å; E532-W536 HydrophobicContact CB-CH2 4.23Å; E532-W536 HydrophobicContact CB-CZ2 4.42Å; E532-W536 HydrophobicContact CB-CZ3 4.23Å; E532-W536 PolarHBondContact O-N 3.4Å; M533-W536 HydrophobicContact SD-CE3 4.15Å; M533-W536 HydrophobicContact SD-CZ3 4.21Å; W536-G540 PolarHBondContact O-N 3.3Å; W536-Y541 HydrophobicContact CB-CD2 4.41Å; W536-Y541 PolarHBondContact O-N 3.17Å; W536-F542 HydrophobicContact CB-CD1 4.26Å; W536-F542 HydrophobicContact CB-CD2 4.38Å; W536-F542 HydrophobicContact CB-CE1 3.91Å; W536-F542 HydrophobicContact CB-CE2 4.02Å; W536-F542 HydrophobicContact CB-CZ 3.81Å; W536-F542 HydrophobicContact CD2-CZ 4.42Å; W536-F542 HydrophobicContact CE3-CE1 4.22Å; W536-F542 AromaticContact CE3-CZ 3.72Å; W536-F542 HydrophobicContact CE3-CZ 3.72Å
537	F	83.9	Confident	85.6	Confident	48 Å²	48	69.7 Å²	69.7	21%	0.211	38%	0.379	C	S	.	.	H	α-helix	trans	-66.9	-47.3	169.6	-176.6	-99.9	0	0	0	112.1	M533 E535 A539 G540 F542 L559 I563 V569 F571	M533-F537 WeakPolarHBondContact O-CB 3.18Å; M533-F537 PolarHBondContact O-N 3.48Å; M533-F537 VanDerWaalsContact O-N 3.14Å; E535-F537 VanDerWaalsContact C-N 3.32Å; E535-F537 PolarHBondContact O-N 2.9Å; F537-A539 VanDerWaalsContact C-N 3.34Å; F537-A539 PolarHBondContact O-N 2.91Å; F537-G540 PolarHBondContact O-N 3.36Å; F537-G540 VanDerWaalsContact O-N 3.14Å; F537-F542 HydrophobicContact CB-CD2 4.05Å; F537-F542 HydrophobicContact CD2-CB 4.29Å; F537-L559 HydrophobicContact CD2-CD2 3.8Å; F537-L559 HydrophobicContact CE2-CD2 4.01Å; F537-I563 HydrophobicContact CE2-CD1 3.79Å; F537-I563 HydrophobicContact CZ-CD1 3.91Å; F537-V569 HydrophobicContact CD1-CB 4.45Å; F537-V569 HydrophobicContact CD1-CG1 3.47Å; F537-V569 VanDerWaalsContact CD1-CG1 3.47Å; F537-V569 HydrophobicContact CD1-CG2 4.07Å; F537-V569 HydrophobicContact CE1-CB 4.22Å; F537-V569 HydrophobicContact CE1-CG1 3.67Å; F537-V569 HydrophobicContact CE1-CG2 3.43Å; F537-V569 VanDerWaalsContact CE1-CG2 3.43Å; F537-V569 HydrophobicContact CG-CG1 4Å; F537-V569 HydrophobicContact CZ-CG1 4.33Å; F537-V569 HydrophobicContact CZ-CG2 4.04Å; F537-F571 HydrophobicContact CB-CD2 3.95Å; F537-F571 HydrophobicContact CB-CE2 4.2Å; F537-F571 HydrophobicContact CG-CD2 4.37Å
538	Q	84.1	Confident	85.7	Confident	145 Å²	145	66.3 Å²	66.3	68%	0.678	36%	0.357	S	S	*	.	H	α-helix	trans	-65.5	-35.9	179.4	-74.7	168.6	100.9	0	0	112.7	C534 E535 G540	C534-Q538 WeakPolarHBondContact O-CB 3.07Å; C534-Q538 VanDerWaalsContact O-CG 3.27Å; C534-Q538 WeakPolarHBondContact O-CG 3.44Å; C534-Q538 PolarHBondContact O-N 2.94Å; C534-Q538 PolarHBondContact O-NE2 3.4Å; E535-Q538 PolarHBondContact O-N 3.11Å; Q538-G540 PolarHBondContact O-N 2.99Å
539	A	84.7	Confident	85.7	Confident	65 Å²	65	66.6 Å²	66.6	54%	0.537	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	1.8	175.1	0	0	0	0	0	113.9	E535 F537 Y541	E535-A539 WeakPolarHBondContact O-CB 3.25Å; E535-A539 PolarHBondContact O-N 3.19Å; F537-A539 VanDerWaalsContact C-N 3.34Å; F537-A539 PolarHBondContact O-N 2.91Å; A539-Y541 VanDerWaalsContact C-N 3.34Å; A539-Y541 HydrophobicContact CB-CD2 3.66Å; A539-Y541 HydrophobicContact CB-CE2 3.55Å; A539-Y541 PolarHBondContact O-N 3.46Å
540	G	83.9	Confident	85.5	Confident	60 Å²	60	63.9 Å²	63.9	62%	0.619	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	8.1	173.2	0	0	0	0	0	116	W536 F537 Q538 F542	W536-G540 PolarHBondContact O-N 3.3Å; F537-G540 PolarHBondContact O-N 3.36Å; F537-G540 VanDerWaalsContact O-N 3.14Å; Q538-G540 PolarHBondContact O-N 2.99Å; G540-F542 PolarHBondContact O-N 2.87Å
541	Y	82.1	Confident	85.1	Confident	179 Å²	179	64.5 Å²	64.5	70%	0.702	35%	0.352	S	S	*	.			trans	-69	-17.8	177.9	-64.8	-68.8	0	0	0	113.3	W536 A539	W536-Y541 HydrophobicContact CB-CD2 4.41Å; W536-Y541 PolarHBondContact O-N 3.17Å; A539-Y541 VanDerWaalsContact C-N 3.34Å; A539-Y541 HydrophobicContact CB-CD2 3.66Å; A539-Y541 HydrophobicContact CB-CE2 3.55Å; A539-Y541 PolarHBondContact O-N 3.46Å
542	F	86.2	Confident	84.5	Confident	18 Å²	18	61.9 Å²	61.9	8%	0.079	34%	0.338	C	S	.	.	S	Bend	trans	-101.4	118.4	-177.4	-70.8	-10.4	0	0	0	112.6	Y517 M533 W536 F537 G540 L546 L559 F571	Y517-F542 HydrophobicContact CD1-CE1 4.01Å; Y517-F542 AromaticContact CD1-CZ 3.84Å; Y517-F542 HydrophobicContact CD1-CZ 3.84Å; Y517-F542 AromaticContact CE1-CE1 3.89Å; Y517-F542 HydrophobicContact CE1-CE1 3.89Å; Y517-F542 AromaticContact CE1-CZ 3.97Å; Y517-F542 HydrophobicContact CE1-CZ 3.97Å; Y517-F542 HydrophobicContact CG-CE1 4.44Å; M533-F542 HydrophobicContact CB-CE2 4.22Å; M533-F542 HydrophobicContact CE-CE2 3.51Å; M533-F542 HydrophobicContact CE-CZ 3.61Å; M533-F542 WeakPolarHBondContact O-CE2 3.37Å; M533-F542 HydrophobicContact SD-CE2 3.89Å; M533-F542 HydrophobicContact SD-CZ 3.62Å; W536-F542 HydrophobicContact CB-CD1 4.26Å; W536-F542 HydrophobicContact CB-CD2 4.38Å; W536-F542 HydrophobicContact CB-CE1 3.91Å; W536-F542 HydrophobicContact CB-CE2 4.02Å; W536-F542 HydrophobicContact CB-CZ 3.81Å; W536-F542 HydrophobicContact CD2-CZ 4.42Å; W536-F542 HydrophobicContact CE3-CE1 4.22Å; W536-F542 AromaticContact CE3-CZ 3.72Å; W536-F542 HydrophobicContact CE3-CZ 3.72Å; F537-F542 HydrophobicContact CB-CD2 4.05Å; F537-F542 HydrophobicContact CD2-CB 4.29Å; G540-F542 PolarHBondContact O-N 2.87Å; F542-L546 HydrophobicContact CB-CD2 3.88Å; F542-L546 HydrophobicContact CD1-CD2 3.3Å; F542-L546 HydrophobicContact CD2-CD2 4.07Å; F542-L546 HydrophobicContact CE1-CD2 3.66Å; F542-L546 HydrophobicContact CE2-CD2 4.39Å; F542-L546 HydrophobicContact CG-CD2 3.5Å; F542-L546 VanDerWaalsContact CG-CD2 3.5Å; F542-L546 HydrophobicContact CZ-CD2 4.18Å; F542-L559 HydrophobicContact CB-CD2 3.78Å; F542-L559 HydrophobicContact CD2-CD2 4.18Å; F542-L559 HydrophobicContact CG-CD2 4.4Å; F542-F571 HydrophobicContact CD2-CE2 4.05Å; F542-F571 HydrophobicContact CD2-CZ 4.5Å; F542-F571 HydrophobicContact CE2-CE2 4.12Å; F542-F571 HydrophobicContact CE2-CZ 4.27Å
543	T	84	Confident	83.9	Confident	77 Å²	77	59.2 Å²	59.2	47%	0.472	33%	0.325	S	S	.	.			trans	-72.7	154.2	172.1	66.2	0	0	0	0	111.4	T545 L546	T543-T545 PolarHBondContact O-N 2.73Å; T543-T545 VanDerWaalsContact O-N 3.09Å; T543-T545 PolarHBondContact OG1-OG1 3.47Å; T543-L546 VanDerWaalsContact O-CB 3.23Å; T543-L546 WeakPolarHBondContact O-CB 3.46Å; T543-L546 PolarHBondContact O-N 2.83Å; T543-L546 PolarHBondContact OG1-N 3.26Å; T543-L546 VanDerWaalsContact OG1-N 3.17Å
544	M	84.5	Confident	83.3	Confident	111 Å²	111	64 Å²	64	55%	0.547	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-14.7	174.1	-151.2	59.2	61.3	0	0	113.1	G560 I563	M544-G560 WeakPolarHBondContact O-CA 3.43Å; M544-G560 PolarHBondContact O-N 3.11Å; M544-G560 VanDerWaalsContact SD-CA 3.52Å; M544-I563 HydrophobicContact CE-CD1 4.42Å; M544-I563 HydrophobicContact SD-CD1 3.65Å
545	T	85.9	Confident	83.1	Confident	109 Å²	109	65 Å²	65	67%	0.669	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-9.3	175.3	50.3	0	0	0	0	114	T543 L547	T543-T545 PolarHBondContact O-N 2.73Å; T543-T545 VanDerWaalsContact O-N 3.09Å; T543-T545 PolarHBondContact OG1-OG1 3.47Å; T545-L547 PolarHBondContact O-N 3.34Å
546	L	88.4	Confident	83	Confident	14 Å²	14	62.8 Å²	62.8	7%	0.073	35%	0.35	C	S	.	.			trans	-58.3	124.9	-175.4	-172.6	74.3	0	0	0	110.7	Y517 K518 F542 T543 V548 P558 L559	Y517-L546 HydrophobicContact CD2-CD1 4.05Å; Y517-L546 HydrophobicContact CD2-CD2 4.24Å; Y517-L546 HydrophobicContact CD2-CG 4.48Å; Y517-L546 HydrophobicContact CG-CD2 4.16Å; K518-L546 VanDerWaalsContact O-CD1 3.25Å; K518-L546 WeakPolarHBondContact O-CD1 3.5Å; F542-L546 HydrophobicContact CB-CD2 3.88Å; F542-L546 HydrophobicContact CD1-CD2 3.3Å; F542-L546 HydrophobicContact CD2-CD2 4.07Å; F542-L546 HydrophobicContact CE1-CD2 3.66Å; F542-L546 HydrophobicContact CE2-CD2 4.39Å; F542-L546 HydrophobicContact CG-CD2 3.5Å; F542-L546 VanDerWaalsContact CG-CD2 3.5Å; F542-L546 HydrophobicContact CZ-CD2 4.18Å; T543-L546 VanDerWaalsContact O-CB 3.23Å; T543-L546 WeakPolarHBondContact O-CB 3.46Å; T543-L546 PolarHBondContact O-N 2.83Å; T543-L546 PolarHBondContact OG1-N 3.26Å; T543-L546 VanDerWaalsContact OG1-N 3.17Å; L546-V548 HydrophobicContact CD2-CG1 4.03Å; L546-V548 HydrophobicContact CG-CG1 4.22Å; L546-V548 PolarHBondContact O-N 3.45Å; L546-P558 CarbonylContact O-C 3.54Å; L546-P558 WeakPolarHBondContact O-CA 3.36Å; L546-L559 HydrophobicContact CB-CB 4.41Å; L546-L559 WeakPolarHBondContact O-CB 3.36Å; L546-L559 PolarHBondContact O-N 3.26Å
547	L	88.8	Confident	82.9	Confident	64 Å²	64	62 Å²	62	34%	0.335	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	109.7	-179.7	-74.8	175.8	0	0	0	109.6	Y517 K518 T545 F556 Q557 P558	Y517-L547 CarbonylContact C-O 3.59Å; Y517-L547 VanDerWaalsContact CA-O 3.25Å; Y517-L547 WeakPolarHBondContact CA-O 3.42Å; K518-L547 HydrophobicContact CB-CB 3.84Å; K518-L547 HydrophobicContact CB-CD1 4.46Å; K518-L547 HydrophobicContact CD-CD1 4.04Å; K518-L547 PolarHBondContact N-O 2.93Å; T545-L547 PolarHBondContact O-N 3.34Å; L547-F556 HydrophobicContact CB-CB 4.14Å; L547-F556 HydrophobicContact CB-CD1 4.39Å; L547-F556 HydrophobicContact CD2-CB 4.49Å; L547-Q557 CarbonylContact C-O 3.51Å; L547-Q557 WeakPolarHBondContact CA-O 3.49Å; L547-P558 HydrophobicContact CD2-CB 4.37Å
548	V	89.1	Confident	83.2	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.018	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	156.4	-178.8	-60.8	0	0	0	0	111.8	F516 M533 L546 Q557 L559 V562 F571	F516-V548 CarbonylContact O-C 3.54Å; F516-V548 WeakPolarHBondContact O-CA 3.5Å; M533-V548 HydrophobicContact CE-CG1 4.27Å; L546-V548 HydrophobicContact CD2-CG1 4.03Å; L546-V548 HydrophobicContact CG-CG1 4.22Å; L546-V548 PolarHBondContact O-N 3.45Å; V548-Q557 PolarHBondContact N-O 2.97Å; V548-Q557 PolarHBondContact O-N 3.27Å; V548-L559 HydrophobicContact CG1-CB 4.25Å; V548-L559 HydrophobicContact CG1-CD1 4.37Å; V548-L559 HydrophobicContact CG2-CB 4.17Å; V548-L559 HydrophobicContact CG2-CD1 3.98Å; V548-V562 HydrophobicContact CG2-CG2 3.92Å; V548-F571 HydrophobicContact CG1-CZ 4.37Å
549	K	86.5	Confident	83.3	Confident	46 Å²	46	54.8 Å²	54.8	20%	0.2	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	141.5	-175.9	177.2	174.7	178.3	-178.8	0	111	F516 D553 E554 G555 F556	F516-K549 PolarHBondContact N-O 3.37Å; F516-K549 PolarHBondContact O-N 2.67Å; K549-D553 WeakPolarHBondContact CE-O 3.12Å; K549-D553 HydrophobicContact CG-CB 4.35Å; K549-D553 PolarHBondContact NZ-O 2.92Å; K549-D553 VanDerWaalsContact NZ-O 3.07Å; K549-E554 WeakPolarHBondContact CE-O 3.39Å; K549-E554 PolarHBondContact NZ-O 2.87Å; K549-G555 WeakPolarHBondContact CG-O 3.39Å; K549-F556 HydrophobicContact CB-CD1 3.5Å; K549-F556 VanDerWaalsContact CB-CD1 3.5Å; K549-F556 HydrophobicContact CB-CE1 3.65Å; K549-F556 HydrophobicContact CB-CG 3.96Å; K549-F556 HydrophobicContact CB-CZ 4.21Å; K549-F556 HydrophobicContact CD-CD1 4.45Å; K549-F556 HydrophobicContact CD-CD2 4Å; K549-F556 HydrophobicContact CD-CE1 4.36Å; K549-F556 HydrophobicContact CD-CE2 3.89Å; K549-F556 HydrophobicContact CD-CG 4.27Å; K549-F556 HydrophobicContact CD-CZ 4.07Å
550	R	80.4	Confident	83.4	Confident	10 Å²	10	52.4 Å²	52.4	4%	0.038	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	155.6	165.5	-59.8	174	-68.1	177.6	1.9	110.9	W515 C552 D553 P577 P578	W515-R550 HydrophobicContact CD2-CG 3.92Å; W515-R550 HydrophobicContact CE3-CG 3.69Å; W515-R550 HydrophobicContact CH2-CG 3.31Å; W515-R550 HydrophobicContact CZ2-CG 3.56Å; W515-R550 HydrophobicContact CZ3-CG 3.39Å; R550-C552 PolarHBondContact O-N 2.63Å; R550-D553 VanDerWaalsContact CB-OD2 3.32Å; R550-D553 WeakPolarHBondContact CB-OD2 3.32Å; R550-D553 IonicContact CZ-OD1 2.63Å; R550-D553 IonicContact CZ-OD2 3.21Å; R550-D553 PolarHBondContact N-OD2 3.43Å; R550-D553 IonicContact NE-OD1 3.05Å; R550-D553 IonicContact NE-OD2 2.7Å; R550-D553 PolarHBondContact NE-OD2 3.2Å; R550-D553 IonicContact NH2-OD1 2.86Å; R550-D553 PolarHBondContact NH2-OD1 3.06Å; R550-D553 IonicContact NH2-OD2 2.62Å; R550-D553 PolarHBondContact NH2-OD2 3.01Å; R550-D553 PolarHBondContact O-N 3.5Å; R550-P577 PolarHBondContact NH1-O 3.41Å; R550-P578 PolarHBondContact NH2-O 3.05Å
551	G	76.9	Confident	83.5	Confident	40 Å²	40	53.1 Å²	53.1	41%	0.412	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-13.9	171.9	0	0	0	0	0	115	K514	K514-G551 PolarHBondContact O-N 3.49Å
552	C	72.3	Confident	83.6	Confident	35 Å²	35	44.8 Å²	44.8	24%	0.236	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-3.7	175.7	62.3	0	0	0	0	115.5	R550	R550-C552 PolarHBondContact O-N 2.63Å
553	D	74.8	Confident	83.5	Confident	17 Å²	17	45.6 Å²	45.6	9%	0.091	26%	0.264	C	S	.	.			trans	-93	162.3	173.4	-63.7	-53.1	0	0	0	110.6	K549 R550 L580	K549-D553 WeakPolarHBondContact CE-O 3.12Å; K549-D553 HydrophobicContact CG-CB 4.35Å; K549-D553 PolarHBondContact NZ-O 2.92Å; K549-D553 VanDerWaalsContact NZ-O 3.07Å; R550-D553 VanDerWaalsContact CB-OD2 3.32Å; R550-D553 WeakPolarHBondContact CB-OD2 3.32Å; R550-D553 IonicContact CZ-OD1 2.63Å; R550-D553 IonicContact CZ-OD2 3.21Å; R550-D553 PolarHBondContact N-OD2 3.43Å; R550-D553 IonicContact NE-OD1 3.05Å; R550-D553 IonicContact NE-OD2 2.7Å; R550-D553 PolarHBondContact NE-OD2 3.2Å; R550-D553 IonicContact NH2-OD1 2.86Å; R550-D553 PolarHBondContact NH2-OD1 3.06Å; R550-D553 IonicContact NH2-OD2 2.62Å; R550-D553 PolarHBondContact NH2-OD2 3.01Å; R550-D553 PolarHBondContact O-N 3.5Å; D553-L580 PolarHBondContact OD1-N 3.18Å
554	E	73.4	Confident	83.4	Confident	100 Å²	100	49.7 Å²	49.7	47%	0.467	28%	0.276	S	S	.	.	S	Bend	trans	-92	-40.2	175.3	-71.9	-159.3	112.1	0	0	113.4	K549	K549-E554 WeakPolarHBondContact CE-O 3.39Å; K549-E554 PolarHBondContact NZ-O 2.87Å
555	G	81	Confident	82.9	Confident	41 Å²	41	49.4 Å²	49.4	42%	0.423	27%	0.274	S	S	.	.	S	Bend	trans	-106.4	159.8	-176.1	0	0	0	0	0	114.5	K549	K549-G555 WeakPolarHBondContact CG-O 3.39Å
556	F	85.9	Confident	82.4	Confident	63 Å²	63	46.6 Å²	46.6	28%	0.276	25%	0.251	S	S	.	.			trans	-84.3	145.2	163.5	-72.8	-92.8	0	0	0	110.5	F516 K518 I524 L547 K549	F516-F556 HydrophobicContact CB-CE1 4.1Å; F516-F556 HydrophobicContact CB-CZ 4.27Å; K518-F556 HydrophobicContact CB-CD1 4.47Å; K518-F556 HydrophobicContact CB-CE1 4.48Å; I524-F556 HydrophobicContact CB-CZ 4.41Å; I524-F556 HydrophobicContact CD1-CE2 3.8Å; I524-F556 HydrophobicContact CD1-CZ 3.82Å; I524-F556 HydrophobicContact CG1-CE2 4.2Å; I524-F556 HydrophobicContact CG1-CZ 3.8Å; I524-F556 HydrophobicContact CG2-CE1 4.47Å; I524-F556 HydrophobicContact CG2-CZ 3.77Å; L547-F556 HydrophobicContact CB-CB 4.14Å; L547-F556 HydrophobicContact CB-CD1 4.39Å; L547-F556 HydrophobicContact CD2-CB 4.49Å; K549-F556 HydrophobicContact CB-CD1 3.5Å; K549-F556 VanDerWaalsContact CB-CD1 3.5Å; K549-F556 HydrophobicContact CB-CE1 3.65Å; K549-F556 HydrophobicContact CB-CG 3.96Å; K549-F556 HydrophobicContact CB-CZ 4.21Å; K549-F556 HydrophobicContact CD-CD1 4.45Å; K549-F556 HydrophobicContact CD-CD2 4Å; K549-F556 HydrophobicContact CD-CE1 4.36Å; K549-F556 HydrophobicContact CD-CE2 3.89Å; K549-F556 HydrophobicContact CD-CG 4.27Å; K549-F556 HydrophobicContact CD-CZ 4.07Å
557	Q	84.6	Confident	81.5	Confident	57 Å²	57	49.5 Å²	49.5	27%	0.266	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	145.6	177.8	-68.2	178.8	-10.5	0	0	110.3	L547 V548 L559 V562	L547-Q557 CarbonylContact C-O 3.51Å; L547-Q557 WeakPolarHBondContact CA-O 3.49Å; V548-Q557 PolarHBondContact N-O 2.97Å; V548-Q557 PolarHBondContact O-N 3.27Å; Q557-L559 PolarHBondContact O-N 3.08Å; Q557-V562 HydrophobicContact CB-CG2 3.67Å
558	P	90.1	Very high	80.9	Confident	41 Å²	41	49.6 Å²	49.6	27%	0.266	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	135	178.9	27.8	-32.7	0	0	0	109.7	L546 L547 G560 D561 V562	L546-P558 CarbonylContact O-C 3.54Å; L546-P558 WeakPolarHBondContact O-CA 3.36Å; L547-P558 HydrophobicContact CD2-CB 4.37Å; P558-G560 PolarHBondContact O-N 3.25Å; P558-G560 VanDerWaalsContact O-N 3.07Å; P558-D561 HydrophobicContact CG-CB 4.09Å; P558-D561 WeakPolarHBondContact CG-OD2 3.11Å; P558-D561 PolarHBondContact O-N 2.96Å; P558-V562 PolarHBondContact O-N 3.28Å
559	L	85.9	Confident	80.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-52.6	-36.7	-171	178	55.3	0	0	0	112.8	F537 F542 L546 V548 Q557 V562 I563 P570 F571	F537-L559 HydrophobicContact CD2-CD2 3.8Å; F537-L559 HydrophobicContact CE2-CD2 4.01Å; F542-L559 HydrophobicContact CB-CD2 3.78Å; F542-L559 HydrophobicContact CD2-CD2 4.18Å; F542-L559 HydrophobicContact CG-CD2 4.4Å; L546-L559 HydrophobicContact CB-CB 4.41Å; L546-L559 WeakPolarHBondContact O-CB 3.36Å; L546-L559 PolarHBondContact O-N 3.26Å; V548-L559 HydrophobicContact CG1-CB 4.25Å; V548-L559 HydrophobicContact CG1-CD1 4.37Å; V548-L559 HydrophobicContact CG2-CB 4.17Å; V548-L559 HydrophobicContact CG2-CD1 3.98Å; Q557-L559 PolarHBondContact O-N 3.08Å; L559-V562 PolarHBondContact O-N 3.37Å; L559-I563 HydrophobicContact CD1-CD1 3.99Å; L559-I563 HydrophobicContact CD1-CG1 4.16Å; L559-I563 HydrophobicContact CG-CD1 3.81Å; L559-I563 HydrophobicContact CG-CG1 4.45Å; L559-I563 WeakPolarHBondContact O-CB 3.44Å; L559-I563 WeakPolarHBondContact O-CD1 3.45Å; L559-I563 VanDerWaalsContact O-CG1 3.25Å; L559-I563 WeakPolarHBondContact O-CG1 3.27Å; L559-I563 PolarHBondContact O-N 3.48Å; L559-P570 HydrophobicContact CD1-CG 3.84Å; L559-F571 HydrophobicContact CD1-CE2 3.76Å; L559-F571 HydrophobicContact CD1-CZ 3.82Å; L559-F571 HydrophobicContact CD2-CE2 4.35Å
560	G	86.1	Confident	79.6	Confident	15 Å²	15	49.3 Å²	49.3	16%	0.155	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-40	173.8	0	0	0	0	0	114.7	M544 P558 K564	M544-G560 WeakPolarHBondContact O-CA 3.43Å; M544-G560 PolarHBondContact O-N 3.11Å; M544-G560 VanDerWaalsContact SD-CA 3.52Å; P558-G560 PolarHBondContact O-N 3.25Å; P558-G560 VanDerWaalsContact O-N 3.07Å; G560-K564 WeakPolarHBondContact O-CB 3.41Å; G560-K564 PolarHBondContact O-N 2.91Å
561	D	86.8	Confident	79.4	Confident	75 Å²	75	49 Å²	49	40%	0.401	28%	0.282	S	S	.	.	H	α-helix	trans	-73.1	-33.2	175.4	-77.8	-34.5	0	0	0	111.4	P558 K564 M565	P558-D561 HydrophobicContact CG-CB 4.09Å; P558-D561 WeakPolarHBondContact CG-OD2 3.11Å; P558-D561 PolarHBondContact O-N 2.96Å; D561-K564 PolarHBondContact O-N 3.17Å; D561-K564 IonicContact OD1-NZ 3.62Å; D561-M565 VanDerWaalsContact O-CB 3.31Å; D561-M565 WeakPolarHBondContact O-CB 3.47Å; D561-M565 VanDerWaalsContact O-CG 3.28Å; D561-M565 WeakPolarHBondContact O-CG 3.5Å; D561-M565 PolarHBondContact O-N 3.22Å
562	V	83.3	Confident	79.1	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-66.7	-46.2	174	-166	0	0	0	0	110.8	V548 Q557 P558 L559 K564 M565 W566 P570	V548-V562 HydrophobicContact CG2-CG2 3.92Å; Q557-V562 HydrophobicContact CB-CG2 3.67Å; P558-V562 PolarHBondContact O-N 3.28Å; L559-V562 PolarHBondContact O-N 3.37Å; V562-K564 VanDerWaalsContact C-N 3.33Å; V562-K564 PolarHBondContact O-N 3.02Å; V562-M565 PolarHBondContact O-N 3.41Å; V562-W566 HydrophobicContact CG1-CD2 3.72Å; V562-W566 HydrophobicContact CG1-CE3 3.8Å; V562-W566 HydrophobicContact CG1-CG 4.48Å; V562-W566 HydrophobicContact CG1-CH2 3.73Å; V562-W566 HydrophobicContact CG1-CZ2 3.62Å; V562-W566 HydrophobicContact CG1-CZ3 3.84Å; V562-W566 WeakPolarHBondContact O-CB 3.27Å; V562-W566 VanDerWaalsContact O-CG 3.32Å; V562-W566 PolarHBondContact O-N 2.92Å; V562-P570 HydrophobicContact CB-CG 3.98Å; V562-P570 HydrophobicContact CG1-CB 4.27Å; V562-P570 HydrophobicContact CG1-CG 3.62Å
563	I	84.5	Confident	78.2	Confident	35 Å²	35	53.3 Å²	53.3	18%	0.179	31%	0.305	C	S	.	.	H	α-helix	trans	-56	-47.7	172.5	-71	162.4	0	0	0	110.6	F537 M544 L559 W566 G567 R568 P570	F537-I563 HydrophobicContact CE2-CD1 3.79Å; F537-I563 HydrophobicContact CZ-CD1 3.91Å; M544-I563 HydrophobicContact CE-CD1 4.42Å; M544-I563 HydrophobicContact SD-CD1 3.65Å; L559-I563 HydrophobicContact CD1-CD1 3.99Å; L559-I563 HydrophobicContact CD1-CG1 4.16Å; L559-I563 HydrophobicContact CG-CD1 3.81Å; L559-I563 HydrophobicContact CG-CG1 4.45Å; L559-I563 WeakPolarHBondContact O-CB 3.44Å; L559-I563 WeakPolarHBondContact O-CD1 3.45Å; L559-I563 VanDerWaalsContact O-CG1 3.25Å; L559-I563 WeakPolarHBondContact O-CG1 3.27Å; L559-I563 PolarHBondContact O-N 3.48Å; I563-W566 PolarHBondContact O-N 3.22Å; I563-G567 WeakPolarHBondContact O-CA 3.42Å; I563-G567 PolarHBondContact O-N 3.14Å; I563-R568 PolarHBondContact O-N 3.09Å; I563-P570 HydrophobicContact CG1-CG 4.13Å
564	K	83	Confident	77.1	Confident	164 Å²	164	54.8 Å²	54.8	71%	0.713	32%	0.324	S	S	*	.	H	α-helix	trans	-69.5	-35.4	-176.7	179.2	-179.5	176.1	-173.3	0	113.5	G560 D561 V562	G560-K564 WeakPolarHBondContact O-CB 3.41Å; G560-K564 PolarHBondContact O-N 2.91Å; D561-K564 PolarHBondContact O-N 3.17Å; D561-K564 IonicContact OD1-NZ 3.62Å; V562-K564 VanDerWaalsContact C-N 3.33Å; V562-K564 PolarHBondContact O-N 3.02Å
565	M	73.3	Confident	76	Confident	105 Å²	105	56.1 Å²	56.1	52%	0.517	34%	0.341	S	S	.	.	H	α-helix	trans	-72.6	-32.5	174	-76.9	-169.8	-68.2	0	0	112.4	D561 V562 L580	D561-M565 VanDerWaalsContact O-CB 3.31Å; D561-M565 WeakPolarHBondContact O-CB 3.47Å; D561-M565 VanDerWaalsContact O-CG 3.28Å; D561-M565 WeakPolarHBondContact O-CG 3.5Å; D561-M565 PolarHBondContact O-N 3.22Å; V562-M565 PolarHBondContact O-N 3.41Å; M565-L580 HydrophobicContact CE-CD1 4.06Å
566	W	75.3	Confident	74.5	Confident	49 Å²	49	58.2 Å²	58.2	19%	0.186	35%	0.349	C	S	.	.	H	α-helix	trans	-99	-8.7	-175.1	-60	-3.8	0	0	0	113.8	W515 V562 I563 R568 P570 P577 L580	W515-W566 AromaticContact CH2-CH2 3.87Å; W515-W566 HydrophobicContact CH2-CH2 3.87Å; W515-W566 AromaticContact CH2-CZ3 3.86Å; W515-W566 HydrophobicContact CH2-CZ3 3.86Å; W515-W566 HydrophobicContact CZ2-CZ3 4.48Å; V562-W566 HydrophobicContact CG1-CD2 3.72Å; V562-W566 HydrophobicContact CG1-CE3 3.8Å; V562-W566 HydrophobicContact CG1-CG 4.48Å; V562-W566 HydrophobicContact CG1-CH2 3.73Å; V562-W566 HydrophobicContact CG1-CZ2 3.62Å; V562-W566 HydrophobicContact CG1-CZ3 3.84Å; V562-W566 WeakPolarHBondContact O-CB 3.27Å; V562-W566 VanDerWaalsContact O-CG 3.32Å; V562-W566 PolarHBondContact O-N 2.92Å; I563-W566 PolarHBondContact O-N 3.22Å; W566-R568 PolarHBondContact O-N 3.28Å; W566-R568 VanDerWaalsContact O-N 3.16Å; W566-P570 HydrophobicContact CE3-CB 3.96Å; W566-P570 HydrophobicContact CE3-CG 4.09Å; W566-P570 HydrophobicContact CZ3-CB 3.65Å; W566-P570 HydrophobicContact CZ3-CG 4.19Å; W566-P577 HydrophobicContact CD2-CB 4.42Å; W566-P577 HydrophobicContact CD2-CG 3.63Å; W566-P577 HydrophobicContact CE3-CG 3.71Å; W566-P577 HydrophobicContact CG-CG 4.31Å; W566-P577 HydrophobicContact CH2-CG 3.75Å; W566-P577 HydrophobicContact CZ2-CG 3.68Å; W566-P577 HydrophobicContact CZ3-CG 3.75Å; W566-L580 HydrophobicContact CZ2-CD1 4.42Å
567	G	70.6	Confident	72.9	Confident	75 Å²	75	56.8 Å²	56.8	77%	0.773	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	15.2	-177.7	0	0	0	0	0	114.3	I563	I563-G567 WeakPolarHBondContact O-CA 3.42Å; I563-G567 PolarHBondContact O-N 3.14Å
568	R	75.5	Confident	71.1	Confident	67 Å²	67	58.9 Å²	58.9	25%	0.253	37%	0.365	S	S	.	.	S	Bend	trans	-156.6	142.5	-164.5	179.4	-166.6	129.3	-82.4	3.7	108.8	I563 W566 P570 A572	I563-R568 PolarHBondContact O-N 3.09Å; W566-R568 PolarHBondContact O-N 3.28Å; W566-R568 VanDerWaalsContact O-N 3.16Å; R568-P570 VanDerWaalsContact NH2-C 3.33Å; R568-P570 PolarHBondContact NH2-O 3.12Å; R568-P570 WeakPolarHBondContact O-CD 3.38Å; R568-A572 HydrophobicContact CG-CB 4.48Å; R568-A572 VanDerWaalsContact CZ-O 3.25Å; R568-A572 PolarHBondContact NE-O 3.12Å; R568-A572 PolarHBondContact NH2-O 3.38Å
569	V	78.6	Confident	69.1	Low	41 Å²	41	60.2 Å²	60.2	25%	0.248	37%	0.373	C	S	.	.			trans	-53.9	121.9	167.8	179.6	0	0	0	0	109.6	F537 F571 A572	F537-V569 HydrophobicContact CD1-CB 4.45Å; F537-V569 HydrophobicContact CD1-CG1 3.47Å; F537-V569 VanDerWaalsContact CD1-CG1 3.47Å; F537-V569 HydrophobicContact CD1-CG2 4.07Å; F537-V569 HydrophobicContact CE1-CB 4.22Å; F537-V569 HydrophobicContact CE1-CG1 3.67Å; F537-V569 HydrophobicContact CE1-CG2 3.43Å; F537-V569 VanDerWaalsContact CE1-CG2 3.43Å; F537-V569 HydrophobicContact CG-CG1 4Å; F537-V569 HydrophobicContact CZ-CG1 4.33Å; F537-V569 HydrophobicContact CZ-CG2 4.04Å; V569-F571 HydrophobicContact CG1-CB 4.4Å; V569-F571 HydrophobicContact CG1-CD2 3.91Å; V569-F571 PolarHBondContact O-N 3.47Å; V569-A572 HydrophobicContact CB-CB 4.34Å; V569-A572 PolarHBondContact O-N 3.11Å; V569-A572 VanDerWaalsContact O-N 3.08Å
570	P	69.6	Low	67.5	Low	2 Å²	2	62.7 Å²	62.7	1%	0.013	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-24.9	-175.3	-35.8	39.5	0	0	0	116	W515 L559 V562 I563 W566 R568	W515-P570 HydrophobicContact CH2-CB 3.63Å; W515-P570 HydrophobicContact CZ2-CB 4.19Å; W515-P570 HydrophobicContact CZ3-CB 4.28Å; L559-P570 HydrophobicContact CD1-CG 3.84Å; V562-P570 HydrophobicContact CB-CG 3.98Å; V562-P570 HydrophobicContact CG1-CB 4.27Å; V562-P570 HydrophobicContact CG1-CG 3.62Å; I563-P570 HydrophobicContact CG1-CG 4.13Å; W566-P570 HydrophobicContact CE3-CB 3.96Å; W566-P570 HydrophobicContact CE3-CG 4.09Å; W566-P570 HydrophobicContact CZ3-CB 3.65Å; W566-P570 HydrophobicContact CZ3-CG 4.19Å; R568-P570 VanDerWaalsContact NH2-C 3.33Å; R568-P570 PolarHBondContact NH2-O 3.12Å; R568-P570 WeakPolarHBondContact O-CD 3.38Å
571	F	75.3	Confident	65.5	Low	3 Å²	3	68.3 Å²	68.3	1%	0.013	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-9.4	-172.2	-39.8	-58.7	0	0	0	114.6	W515 T530 M533 C534 F537 F542 V548 L559 V569	W515-F571 AromaticContact CD2-CD1 4Å; W515-F571 HydrophobicContact CD2-CD1 4Å; W515-F571 AromaticContact CD2-CE1 3.7Å; W515-F571 HydrophobicContact CD2-CE1 3.7Å; W515-F571 AromaticContact CE2-CD1 3.75Å; W515-F571 AromaticContact CE2-CE1 3.9Å; W515-F571 HydrophobicContact CE3-CD1 4.35Å; W515-F571 AromaticContact CE3-CE1 3.64Å; W515-F571 HydrophobicContact CE3-CE1 3.64Å; W515-F571 HydrophobicContact CG-CE1 4.35Å; W515-F571 HydrophobicContact CH2-CD1 4.26Å; W515-F571 AromaticContact CH2-CE1 3.98Å; W515-F571 HydrophobicContact CH2-CE1 3.98Å; W515-F571 AromaticContact CZ2-CD1 3.9Å; W515-F571 HydrophobicContact CZ2-CD1 3.9Å; W515-F571 HydrophobicContact CZ2-CE1 4.04Å; W515-F571 HydrophobicContact CZ3-CD1 4.47Å; W515-F571 AromaticContact CZ3-CE1 3.78Å; W515-F571 HydrophobicContact CZ3-CE1 3.78Å; T530-F571 HydrophobicContact CG2-CB 4.47Å; T530-F571 WeakPolarHBondContact CG2-O 3.45Å; M533-F571 HydrophobicContact CB-CB 4.32Å; M533-F571 HydrophobicContact CB-CD1 3.38Å; M533-F571 HydrophobicContact CB-CD2 4.16Å; M533-F571 HydrophobicContact CB-CE1 3.62Å; M533-F571 HydrophobicContact CB-CE2 4.37Å; M533-F571 HydrophobicContact CB-CG 3.67Å; M533-F571 HydrophobicContact CB-CZ 4.12Å; M533-F571 HydrophobicContact CE-CE1 3.7Å; M533-F571 HydrophobicContact CE-CZ 3.7Å; M533-F571 HydrophobicContact CG-CD1 4.25Å; M533-F571 HydrophobicContact CG-CE1 4.19Å; M533-F571 VanDerWaalsContact O-CD2 3.26Å; M533-F571 WeakPolarHBondContact O-CD2 3.32Å; C534-F571 HydrophobicContact CB-CB 3.5Å; C534-F571 VanDerWaalsContact CB-CB 3.5Å; F537-F571 HydrophobicContact CB-CD2 3.95Å; F537-F571 HydrophobicContact CB-CE2 4.2Å; F537-F571 HydrophobicContact CG-CD2 4.37Å; F542-F571 HydrophobicContact CD2-CE2 4.05Å; F542-F571 HydrophobicContact CD2-CZ 4.5Å; F542-F571 HydrophobicContact CE2-CE2 4.12Å; F542-F571 HydrophobicContact CE2-CZ 4.27Å; V548-F571 HydrophobicContact CG1-CZ 4.37Å; L559-F571 HydrophobicContact CD1-CE2 3.76Å; L559-F571 HydrophobicContact CD1-CZ 3.82Å; L559-F571 HydrophobicContact CD2-CE2 4.35Å; V569-F571 HydrophobicContact CG1-CB 4.4Å; V569-F571 HydrophobicContact CG1-CD2 3.91Å; V569-F571 PolarHBondContact O-N 3.47Å
572	A	71.9	Confident	63.2	Low	30 Å²	30	67.3 Å²	67.3	25%	0.248	42%	0.42	C	S	.	.	S	Bend	trans	-74	139.4	-178.9	0	0	0	0	0	112.2	R568 V569 G574	R568-A572 HydrophobicContact CG-CB 4.48Å; R568-A572 VanDerWaalsContact CZ-O 3.25Å; R568-A572 PolarHBondContact NE-O 3.12Å; R568-A572 PolarHBondContact NH2-O 3.38Å; V569-A572 HydrophobicContact CB-CB 4.34Å; V569-A572 PolarHBondContact O-N 3.11Å; V569-A572 VanDerWaalsContact O-N 3.08Å; A572-G574 PolarHBondContact O-N 3.05Å
573	P	53	Low	61.2	Low	136 Å²	136	74.2 Å²	74.2	88%	0.883	46%	0.456	S	S	*	.	S	Bend	trans	-52.1	128.9	-180	-29	36	0	0	0	113.6
574	G	51.8	Low	59.2	Low	48 Å²	48	79.5 Å²	79.5	50%	0.495	48%	0.484	S	S	.	.	S	Bend	trans	171.7	172.9	-176.6	0	0	0	0	0	112.6	A572 S576	A572-G574 PolarHBondContact O-N 3.05Å; G574-S576 PolarHBondContact O-N 3.46Å
575	P	49.7	Very low	57.4	Low	127 Å²	127	77.3 Å²	77.3	83%	0.825	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-62.9	127.8	179.4	26.4	-34	0	0	0	110.8	P577	P575-P577 WeakPolarHBondContact O-CD 3.4Å
576	S	49.7	Very low	56.1	Low	86 Å²	86	78.3 Å²	78.3	60%	0.601	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-64.7	120.4	-177.4	55.4	0	0	0	0	111.2	G574	G574-S576 PolarHBondContact O-N 3.46Å
577	P	53.2	Low	54.7	Low	33 Å²	33	83.9 Å²	83.9	21%	0.214	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-66.5	156.7	177	25.6	-31.2	0	0	0	111.2	R550 W566 P575	R550-P577 PolarHBondContact NH1-O 3.41Å; W566-P577 HydrophobicContact CD2-CB 4.42Å; W566-P577 HydrophobicContact CD2-CG 3.63Å; W566-P577 HydrophobicContact CE3-CG 3.71Å; W566-P577 HydrophobicContact CG-CG 4.31Å; W566-P577 HydrophobicContact CH2-CG 3.75Å; W566-P577 HydrophobicContact CZ2-CG 3.68Å; W566-P577 HydrophobicContact CZ3-CG 3.75Å; P575-P577 WeakPolarHBondContact O-CD 3.4Å
578	P	45.9	Very low	53.6	Low	100 Å²	100	89.9 Å²	89.9	65%	0.649	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-61.9	163.2	-178.4	25.3	-34.5	0	0	0	113.2	R550	R550-P578 PolarHBondContact NH2-O 3.05Å
579	P	48.8	Very low	52.6	Low	69 Å²	69	91.8 Å²	91.8	45%	0.448	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-62.9	142.6	175.2	-21.6	34.1	0	0	0	112.4	L581	P579-L581 PolarHBondContact O-N 2.88Å
580	L	51.3	Low	51.3	Low	52 Å²	52	94.8 Å²	94.8	27%	0.272	54%	0.536	S	S	.	.			trans	-95.1	92.9	177.8	-63.4	179.9	0	0	0	111.2	D553 M565 W566	D553-L580 PolarHBondContact OD1-N 3.18Å; M565-L580 HydrophobicContact CE-CD1 4.06Å; W566-L580 HydrophobicContact CZ2-CD1 4.42Å
581	L	45	Very low	51	Low	134 Å²	134	101.7 Å²	101.7	70%	0.702	57%	0.565	S	S	*	*			trans	-73.7	144.8	171.3	-72.1	168	0	0	0	111.7	P579	P579-L581 PolarHBondContact O-N 2.88Å
582	G	38.4	Very low	50.8	Low	54 Å²	54	107.9 Å²	107.9	56%	0.557	59%	0.594	S	S	*	*			trans	-72.3	150.8	-173.5	0	0	0	0	0	115	L584	G582-L584 PolarHBondContact O-N 3.36Å; G582-L584 VanDerWaalsContact O-N 3.09Å
583	N	40.6	Very low	50.8	Low	148 Å²	148	112.5 Å²	112.5	79%	0.791	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	16.1	-173.5	-112	-69.4	0	0	0	115.7
584	L	42.2	Very low	51.5	Low	147 Å²	147	112.8 Å²	112.8	77%	0.77	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-27.4	-161.2	-165.6	59.7	0	0	0	115	G582	G582-L584 PolarHBondContact O-N 3.36Å; G582-L584 VanDerWaalsContact O-N 3.09Å
585	D	46.5	Very low	52.4	Low	118 Å²	118	116.3 Å²	116.3	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-83.9	-22.1	-170.9	-66	-63	0	0	0	115	E587 R588 L589	D585-E587 VanDerWaalsContact C-N 3.3Å; D585-E587 PolarHBondContact O-N 3.05Å; D585-R588 PolarHBondContact O-N 3.33Å; D585-L589 PolarHBondContact O-N 2.89Å; D585-L589 VanDerWaalsContact O-N 3.09Å
586	Q	45.3	Very low	53.6	Low	126 Å²	126	113.1 Å²	113.1	59%	0.589	59%	0.591	S	S	*	*	H	α-helix	trans	-63.2	-35.7	-173.9	-171.3	172.1	101.1	0	0	112.5	K590	Q586-K590 WeakPolarHBondContact O-CB 3.1Å; Q586-K590 PolarHBondContact O-N 3.27Å
587	E	45.3	Very low	54.7	Low	165 Å²	165	113.2 Å²	113.2	77%	0.771	59%	0.589	S	S	*	*	H	α-helix	trans	-72.3	-37.6	-179.7	-164.2	177.5	154	0	0	112.2	D585 K590 K591	D585-E587 VanDerWaalsContact C-N 3.3Å; D585-E587 PolarHBondContact O-N 3.05Å; E587-K590 PolarHBondContact O-N 3.45Å; E587-K591 WeakPolarHBondContact O-CB 3.26Å; E587-K591 PolarHBondContact O-N 2.98Å
588	R	48.8	Very low	55.7	Low	202 Å²	202	114.4 Å²	114.4	76%	0.762	60%	0.601	S	S	*	*	H	α-helix	trans	-64	-45.6	173.5	-79.4	-174	162	-157.7	-5.4	111.4	D585 K591 Q592	D585-R588 PolarHBondContact O-N 3.33Å; R588-K591 PolarHBondContact O-N 3.42Å; R588-Q592 PolarHBondContact O-N 2.85Å
589	L	54.1	Low	57.2	Low	107 Å²	107	112.4 Å²	112.4	56%	0.56	59%	0.593	S	S	*	*	H	α-helix	trans	-64.5	-40.9	179	-162.7	69.9	0	0	0	111.5	D585 Q592 Q593	D585-L589 PolarHBondContact O-N 2.89Å; D585-L589 VanDerWaalsContact O-N 3.09Å; L589-Q592 PolarHBondContact O-N 3.07Å; L589-Q593 WeakPolarHBondContact O-CB 3.31Å; L589-Q593 PolarHBondContact O-N 2.86Å
590	K	51.8	Low	58.6	Low	104 Å²	104	114.5 Å²	114.5	45%	0.452	60%	0.6	S	S	.	*	H	α-helix	trans	-62.7	-43.7	176.3	-166.4	164.5	-169.1	167.5	0	112.2	Q586 E587 Q592 Q593 E594 E1066	Q586-K590 WeakPolarHBondContact O-CB 3.1Å; Q586-K590 PolarHBondContact O-N 3.27Å; E587-K590 PolarHBondContact O-N 3.45Å; K590-Q592 VanDerWaalsContact C-N 3.35Å; K590-Q592 PolarHBondContact O-N 2.92Å; K590-Q593 PolarHBondContact O-N 3.43Å; K590-E594 PolarHBondContact O-N 3.41Å; K590-E1066 IonicContact NZ-OE1 3.96Å; K590-E1066 PolarHBondContact NZ-OE1 3.16Å; K590-E1066 IonicContact NZ-OE2 2.66Å; K590-E1066 PolarHBondContact NZ-OE2 3.4Å
591	K	62.9	Low	59.8	Low	146 Å²	146	120.2 Å²	120.2	64%	0.635	62%	0.619	S	S	*	*	H	α-helix	trans	-64.5	-36.1	175.9	-170.2	169.5	-174.7	170	0	112.9	E587 R588 L595	E587-K591 WeakPolarHBondContact O-CB 3.26Å; E587-K591 PolarHBondContact O-N 2.98Å; R588-K591 PolarHBondContact O-N 3.42Å; K591-L595 PolarHBondContact O-N 3.36Å; K591-L595 VanDerWaalsContact O-N 3.16Å
592	Q	71.3	Confident	61.5	Low	133 Å²	133	119.5 Å²	119.5	62%	0.621	61%	0.612	S	S	*	*	H	α-helix	trans	-68.8	-39.7	174.5	-167.6	175.3	13.9	0	0	111.9	R588 L589 K590 L595 A596	R588-Q592 PolarHBondContact O-N 2.85Å; L589-Q592 PolarHBondContact O-N 3.07Å; K590-Q592 VanDerWaalsContact C-N 3.35Å; K590-Q592 PolarHBondContact O-N 2.92Å; Q592-L595 PolarHBondContact O-N 2.83Å; Q592-A596 PolarHBondContact O-N 2.95Å
593	Q	70.7	Confident	63.5	Low	128 Å²	128	122.7 Å²	122.7	60%	0.598	61%	0.613	S	S	*	*	H	α-helix	trans	-69.3	-34.7	176.5	-168.4	166.2	22.6	0	0	112.7	L589 K590 A596 T597	L589-Q593 WeakPolarHBondContact O-CB 3.31Å; L589-Q593 PolarHBondContact O-N 2.86Å; K590-Q593 PolarHBondContact O-N 3.43Å; Q593-A596 PolarHBondContact O-N 3.13Å; Q593-T597 WeakPolarHBondContact O-CB 3.49Å; Q593-T597 PolarHBondContact O-N 2.95Å; Q593-T597 PolarHBondContact O-OG1 2.95Å
594	E	69.1	Low	65.6	Low	141 Å²	141	119.7 Å²	119.7	66%	0.659	60%	0.596	S	S	*	*	H	α-helix	trans	-65.1	-44	173.5	-171.1	167.1	-145.2	0	0	111.6	K590 T597 A598	K590-E594 PolarHBondContact O-N 3.41Å; E594-T597 PolarHBondContact O-N 3.18Å; E594-A598 WeakPolarHBondContact O-CB 3.25Å; E594-A598 PolarHBondContact O-N 3.06Å
595	L	69.4	Low	67.5	Low	122 Å²	122	118.7 Å²	118.7	64%	0.639	59%	0.587	S	S	*	*	H	α-helix	trans	-60.9	-43.5	172.6	-83.2	165.8	0	0	0	112.8	K591 Q592 T597 A598 A599	K591-L595 PolarHBondContact O-N 3.36Å; K591-L595 VanDerWaalsContact O-N 3.16Å; Q592-L595 PolarHBondContact O-N 2.83Å; L595-T597 VanDerWaalsContact C-N 3.31Å; L595-T597 PolarHBondContact O-N 2.96Å; L595-A598 PolarHBondContact O-N 3.49Å; L595-A599 PolarHBondContact O-N 3.38Å
596	A	75.7	Confident	68.8	Low	60 Å²	60	119.2 Å²	119.2	50%	0.496	59%	0.586	S	S	.	*	H	α-helix	trans	-61.9	-39	175.1	0	0	0	0	0	112.2	Q592 Q593 L600	Q592-A596 PolarHBondContact O-N 2.95Å; Q593-A596 PolarHBondContact O-N 3.13Å; A596-L600 PolarHBondContact O-N 3.5Å; A596-L600 VanDerWaalsContact O-N 3.15Å
597	T	71.9	Confident	70.2	Confident	89 Å²	89	118.5 Å²	118.5	55%	0.546	58%	0.583	S	S	.	*	H	α-helix	trans	-68.6	-40.1	177.4	-54.4	0	0	0	0	111.6	Q593 E594 L595 L600 Y601	Q593-T597 WeakPolarHBondContact O-CB 3.49Å; Q593-T597 PolarHBondContact O-N 2.95Å; Q593-T597 PolarHBondContact O-OG1 2.95Å; E594-T597 PolarHBondContact O-N 3.18Å; L595-T597 VanDerWaalsContact C-N 3.31Å; L595-T597 PolarHBondContact O-N 2.96Å; T597-L600 PolarHBondContact O-N 3.27Å; T597-Y601 PolarHBondContact O-N 3.34Å
598	A	74.8	Confident	71.6	Confident	58 Å²	58	116.8 Å²	116.8	48%	0.479	58%	0.575	S	S	.	*	H	α-helix	trans	-64.3	-42	175.4	0	0	0	0	0	112.4	E594 L595 L600 Y601 Q602	E594-A598 WeakPolarHBondContact O-CB 3.25Å; E594-A598 PolarHBondContact O-N 3.06Å; L595-A598 PolarHBondContact O-N 3.49Å; A598-L600 PolarHBondContact O-N 2.86Å; A598-Y601 PolarHBondContact O-N 3Å; A598-Q602 PolarHBondContact O-N 2.73Å
599	A	76.9	Confident	73	Confident	57 Å²	57	112.3 Å²	112.3	47%	0.471	57%	0.565	S	S	.	*	H	α-helix	trans	-61.7	-42.1	175.9	0	0	0	0	0	112.2	L595 Q602 Q603	L595-A599 PolarHBondContact O-N 3.38Å; A599-Q602 PolarHBondContact O-N 2.86Å; A599-Q603 PolarHBondContact O-N 3.31Å
600	L	78.4	Confident	73.7	Confident	114 Å²	114	113.6 Å²	113.6	60%	0.597	57%	0.567	S	S	*	*	H	α-helix	trans	-65.4	-39.8	177	-159.5	160.4	0	0	0	111.4	A596 T597 A598 Q603 L604	A596-L600 PolarHBondContact O-N 3.5Å; A596-L600 VanDerWaalsContact O-N 3.15Å; T597-L600 PolarHBondContact O-N 3.27Å; A598-L600 PolarHBondContact O-N 2.86Å; L600-Q603 PolarHBondContact O-N 2.75Å; L600-L604 PolarHBondContact O-N 3.1Å
601	Y	76.6	Confident	74.7	Confident	171 Å²	171	115.3 Å²	115.3	67%	0.671	58%	0.576	S	S	*	*	H	α-helix	trans	-62.6	-41.3	173.6	-169.9	-98.1	0	0	0	112.4	T597 A598 L604 Q605	T597-Y601 PolarHBondContact O-N 3.34Å; A598-Y601 PolarHBondContact O-N 3Å; Y601-L604 WeakPolarHBondContact O-CB 3.26Å; Y601-L604 PolarHBondContact O-N 2.89Å; Y601-Q605 PolarHBondContact O-N 2.87Å
602	Q	80.7	Confident	75	Confident	120 Å²	120	114.1 Å²	114.1	56%	0.561	58%	0.576	S	S	*	*	H	α-helix	trans	-64.9	-38.4	174.9	-170.9	178.8	69.7	0	0	112.2	A598 A599 L604 Q605 Q606	A598-Q602 PolarHBondContact O-N 2.73Å; A599-Q602 PolarHBondContact O-N 2.86Å; Q602-L604 VanDerWaalsContact C-N 3.34Å; Q602-L604 PolarHBondContact O-N 3.48Å; Q602-Q605 PolarHBondContact O-N 3.44Å; Q602-Q606 PolarHBondContact O-N 3.38Å; Q602-Q606 VanDerWaalsContact O-N 3.08Å
603	Q	80	Confident	74.5	Confident	121 Å²	121	113 Å²	113	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-63.5	-38.8	174.1	-165.8	-173.1	31.3	0	0	112	A599 L600 Q605 Q606 Q607	A599-Q603 PolarHBondContact O-N 3.31Å; L600-Q603 PolarHBondContact O-N 2.75Å; Q603-Q605 VanDerWaalsContact C-N 3.34Å; Q603-Q606 PolarHBondContact O-N 2.87Å; Q603-Q607 PolarHBondContact O-N 2.95Å
604	L	84.8	Confident	73.8	Confident	84 Å²	84	111.8 Å²	111.8	44%	0.44	57%	0.571	S	S	.	*	H	α-helix	trans	-65.3	-37.1	175.4	-174.8	65.6	0	0	0	112	L600 Y601 Q602 Q607 Q608	L600-L604 PolarHBondContact O-N 3.1Å; Y601-L604 WeakPolarHBondContact O-CB 3.26Å; Y601-L604 PolarHBondContact O-N 2.89Å; Q602-L604 VanDerWaalsContact C-N 3.34Å; Q602-L604 PolarHBondContact O-N 3.48Å; L604-Q607 PolarHBondContact O-N 3.24Å; L604-Q608 PolarHBondContact O-N 3.39Å
605	Q	81.8	Confident	73.1	Confident	126 Å²	126	114.6 Å²	114.6	59%	0.589	58%	0.575	S	S	*	*	H	α-helix	trans	-65.1	-42.2	175	-166.2	178.5	22.9	0	0	111.7	Y601 Q602 Q603 Q607 Q608 L609	Y601-Q605 PolarHBondContact O-N 2.87Å; Q602-Q605 PolarHBondContact O-N 3.44Å; Q603-Q605 VanDerWaalsContact C-N 3.34Å; Q605-Q607 PolarHBondContact O-N 2.83Å; Q605-Q608 PolarHBondContact O-N 2.78Å; Q605-L609 PolarHBondContact O-N 3.04Å
606	Q	75.6	Confident	72	Confident	129 Å²	129	116.6 Å²	116.6	60%	0.603	58%	0.579	S	S	*	*	H	α-helix	trans	-63.7	-38.4	174.6	-71.4	-170.8	64.9	0	0	112.5	Q602 Q603 Q608 L609 F610	Q602-Q606 PolarHBondContact O-N 3.38Å; Q602-Q606 VanDerWaalsContact O-N 3.08Å; Q603-Q606 PolarHBondContact O-N 2.87Å; Q606-Q608 PolarHBondContact O-N 3.07Å; Q606-L609 PolarHBondContact O-N 3.27Å; Q606-F610 PolarHBondContact O-N 3.32Å
607	Q	74.8	Confident	70.5	Confident	111 Å²	111	119.4 Å²	119.4	52%	0.519	59%	0.592	S	S	.	*	H	α-helix	trans	-61.7	-40.2	174.2	-79.3	-170.9	67.9	0	0	112.8	Q603 L604 Q605 L609 F610 Q611	Q603-Q607 PolarHBondContact O-N 2.95Å; L604-Q607 PolarHBondContact O-N 3.24Å; Q605-Q607 PolarHBondContact O-N 2.83Å; Q607-L609 VanDerWaalsContact C-N 3.31Å; Q607-L609 PolarHBondContact O-N 3.47Å; Q607-F610 PolarHBondContact O-N 3.33Å; Q607-Q611 VanDerWaalsContact O-CG 3.29Å; Q607-Q611 WeakPolarHBondContact O-CG 3.34Å; Q607-Q611 PolarHBondContact O-N 2.8Å
608	Q	74.6	Confident	69.2	Low	130 Å²	130	123.8 Å²	123.8	61%	0.607	61%	0.611	S	S	*	*	H	α-helix	trans	-63	-38.2	174.8	-70.8	-176.9	50.8	0	0	112.1	L604 Q605 Q606 Q611 L612	L604-Q608 PolarHBondContact O-N 3.39Å; Q605-Q608 PolarHBondContact O-N 2.78Å; Q606-Q608 PolarHBondContact O-N 3.07Å; Q608-Q611 PolarHBondContact O-N 3.29Å; Q608-L612 PolarHBondContact O-N 2.78Å
609	L	77.1	Confident	67.3	Low	108 Å²	108	125.4 Å²	125.4	57%	0.565	62%	0.62	S	S	*	*	H	α-helix	trans	-67.6	-40.6	177.7	-147.5	160.8	0	0	0	111.2	Q605 Q606 Q607 L612 I613	Q605-L609 PolarHBondContact O-N 3.04Å; Q606-L609 PolarHBondContact O-N 3.27Å; Q607-L609 VanDerWaalsContact C-N 3.31Å; Q607-L609 PolarHBondContact O-N 3.47Å; L609-L612 WeakPolarHBondContact O-CB 3.41Å; L609-L612 PolarHBondContact O-N 2.89Å; L609-L612 VanDerWaalsContact O-N 3.16Å; L609-I613 HydrophobicContact CD2-CD1 3.76Å; L609-I613 HydrophobicContact CD2-CG1 4.3Å; L609-I613 WeakPolarHBondContact O-CG1 3.23Å; L609-I613 PolarHBondContact O-N 3.31Å; L609-I613 VanDerWaalsContact O-N 3.1Å
610	F	69.6	Low	65.3	Low	134 Å²	134	132 Å²	132	59%	0.588	64%	0.638	S	S	*	*	H	α-helix	trans	-65	-39.2	174.2	-160.7	-101.3	0	0	0	112.6	Q606 Q607 L612 I613 N614	Q606-F610 PolarHBondContact O-N 3.32Å; Q607-F610 PolarHBondContact O-N 3.33Å; F610-L612 VanDerWaalsContact C-N 3.26Å; F610-L612 PolarHBondContact O-N 3.25Å; F610-I613 PolarHBondContact O-N 2.78Å; F610-N614 VanDerWaalsContact CD1-ND2 3.27Å; F610-N614 WeakPolarHBondContact CD1-ND2 3.33Å; F610-N614 WeakPolarHBondContact CE1-ND2 3.45Å; F610-N614 PolarHBondContact O-N 2.95Å; F610-N614 VanDerWaalsContact O-N 3.17Å; F610-N614 PolarHBondContact O-ND2 3.19Å
611	Q	71.5	Confident	63.6	Low	139 Å²	139	132.1 Å²	132.1	65%	0.65	65%	0.646	S	S	*	*	H	α-helix	trans	-63.4	-31.3	172.4	-70.1	-72	-0.3	0	0	112.4	Q607 Q608	Q607-Q611 VanDerWaalsContact O-CG 3.29Å; Q607-Q611 WeakPolarHBondContact O-CG 3.34Å; Q607-Q611 PolarHBondContact O-N 2.8Å; Q608-Q611 PolarHBondContact O-N 3.29Å
612	L	68.9	Low	61.7	Low	122 Å²	122	132.1 Å²	132.1	64%	0.639	66%	0.656	S	S	*	*	H	α-helix	trans	-69.4	-42.8	175.5	-141.9	76.1	0	0	0	111.9	Q608 L609 F610 R615	Q608-L612 PolarHBondContact O-N 2.78Å; L609-L612 WeakPolarHBondContact O-CB 3.41Å; L609-L612 PolarHBondContact O-N 2.89Å; L609-L612 VanDerWaalsContact O-N 3.16Å; F610-L612 VanDerWaalsContact C-N 3.26Å; F610-L612 PolarHBondContact O-N 3.25Å; L612-R615 PolarHBondContact O-N 2.82Å
613	I	60.8	Low	59.2	Low	108 Å²	108	135.9 Å²	135.9	55%	0.554	67%	0.674	S	S	*	*	H	α-helix	trans	-63.2	-42	179.2	-70.7	167.3	0	0	0	111.4	L609 F610 R615	L609-I613 HydrophobicContact CD2-CD1 3.76Å; L609-I613 HydrophobicContact CD2-CG1 4.3Å; L609-I613 WeakPolarHBondContact O-CG1 3.23Å; L609-I613 PolarHBondContact O-N 3.31Å; L609-I613 VanDerWaalsContact O-N 3.1Å; F610-I613 PolarHBondContact O-N 2.78Å; I613-R615 PolarHBondContact O-N 3.41Å; I613-R615 VanDerWaalsContact O-N 3.12Å
614	N	56.4	Low	56.6	Low	103 Å²	103	135.4 Å²	135.4	55%	0.551	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-1.1	180	-73.3	-82	0	0	0	114.2	F610	F610-N614 VanDerWaalsContact CD1-ND2 3.27Å; F610-N614 WeakPolarHBondContact CD1-ND2 3.33Å; F610-N614 WeakPolarHBondContact CE1-ND2 3.45Å; F610-N614 PolarHBondContact O-N 2.95Å; F610-N614 VanDerWaalsContact O-N 3.17Å; F610-N614 PolarHBondContact O-ND2 3.19Å
615	R	55.6	Low	53.9	Low	200 Å²	200	136.1 Å²	136.1	76%	0.755	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	8.9	-178	-141.6	175.9	78.5	132.4	0.4	114.9	L612 I613	L612-R615 PolarHBondContact O-N 2.82Å; I613-R615 PolarHBondContact O-N 3.41Å; I613-R615 VanDerWaalsContact O-N 3.12Å
616	F	46.4	Very low	51.2	Low	165 Å²	165	137.5 Å²	137.5	72%	0.724	70%	0.701	S	S	*	*	S	Bend	trans	-127.9	109.4	172.3	-68.3	-83	0	0	0	110.3
617	P	43.1	Very low	49	Very low	118 Å²	118	139.6 Å²	139.6	77%	0.766	71%	0.71	S	S	*	*			trans	-72.2	133.5	174.3	29.7	-33	0	0	0	110.6	S619	P617-S619 PolarHBondContact O-N 3.02Å
618	L	45.1	Very low	46.9	Very low	181 Å²	181	137.4 Å²	137.4	95%	0.948	72%	0.718	S	S	*	*			trans	-77.4	116.8	172.7	-70.1	168.2	0	0	0	109.9
619	S	34.2	Very low	44.8	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	73%	0.733	S	S	*	*			trans	-148.5	82.7	176.3	64.6	0	0	0	0	114.2	P617	P617-S619 PolarHBondContact O-N 3.02Å
620	F	34.6	Very low	42.6	Very low	196 Å²	196	143.4 Å²	143.4	86%	0.86	75%	0.748	S	S	*	*			trans	64.2	178.4	157.9	-57.9	-79.8	0	0	0	116
621	P	43.7	Very low	41.8	Very low	116 Å²	116	142.6 Å²	142.6	75%	0.753	76%	0.756	S	S	*	*				-124.6	-169	-89.5	36.1	-17.8	0	0	0	113.3
622	L	37.7	Very low	39.7	Very low	170 Å²	170	141.3 Å²	141.3	89%	0.89	76%	0.762	S	S	*	*			trans	-62.2	138.3	178.4	-66.2	79	0	0	0	112.3
623	E	26.7	Very low	38	Very low	200 Å²	200	143 Å²	143	94%	0.935	77%	0.768	S	S	*	*				-151.5	-179	127.9	-141	161.7	-173.3	0	0	110.8
624	C	26.9	Very low	36.5	Very low	111 Å²	111	145.9 Å²	145.9	75%	0.75	79%	0.785	S	S	*	*			trans	-124.8	167.8	-157.9	-161.6	0	0	0	0	114
625	S	27.1	Very low	35.4	Very low	98 Å²	98	151.6 Å²	151.6	69%	0.685	80%	0.799	S	S	*	*			trans	71.5	139.3	156.2	53	0	0	0	0	121.3
626	E	25	Very low	34.2	Very low	155 Å²	155	147.7 Å²	147.7	72%	0.724	80%	0.803	S	S	*	*			trans	59.2	117.2	144.1	-65.4	-170.1	86.3	0	0	124
627	Q	28.5	Very low	33.2	Very low	173 Å²	173	148.1 Å²	148.1	81%	0.808	81%	0.809	S	S	*	*				51.9	108.8	123.8	-52	-172.6	54.1	0	0	120.9
628	G	32.2	Very low	32.7	Very low	66 Å²	66	148 Å²	148	68%	0.68	81%	0.811	S	S	*	*				112.5	152	123.2	0	0	0	0	0	119.8
629	M	29.4	Very low	32.6	Very low	186 Å²	186	146 Å²	146	92%	0.916	81%	0.806	S	S	*	*			trans	58.9	104.9	156.1	-71.5	66	143.7	0	0	120.5
630	M	32.3	Very low	33.1	Very low	178 Å²	178	147.3 Å²	147.3	88%	0.877	81%	0.812	S	S	*	*			trans	-60	169.8	137.4	-62.7	-77.6	-167.4	0	0	110.2
631	P	51.9	Low	33	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	81%	0.809	S	S	*	*			cis	-143.9	-174.9	16.1	44.6	-26.2	0	0	0	116.3
632	S	28.1	Very low	32.3	Very low	111 Å²	111	146.6 Å²	146.6	78%	0.776	82%	0.816	S	S	*	*				180	162.7	119.9	-164.1	0	0	0	0	112
633	M	32.1	Very low	32	Very low	157 Å²	157	141.4 Å²	141.4	77%	0.773	81%	0.805	S	S	*	*			trans	-96.5	170	-175.1	-47.3	92.4	70.1	0	0	114
634	N	30	Very low	33.3	Very low	170 Å²	170	137.5 Å²	137.5	91%	0.909	80%	0.796	S	S	*	*			trans	-130.4	159.1	139.4	-116.4	-45.3	0	0	0	111.8
635	R	33.9	Very low	33.4	Very low	222 Å²	222	138.5 Å²	138.5	84%	0.838	79%	0.794	S	S	*	*			trans	-88.8	163.3	-162.1	-105.2	175.7	172.7	-138	0.4	113.3
636	S	29.3	Very low	33.6	Very low	119 Å²	119	144.7 Å²	144.7	83%	0.832	80%	0.802	S	S	*	*				-162.7	168.1	67.1	-65.8	0	0	0	0	115.8
637	M	25.3	Very low	34.1	Very low	173 Å²	173	144.4 Å²	144.4	85%	0.852	81%	0.806	S	S	*	*			trans	-141	142.3	-175	-92.4	-94.8	-64.1	0	0	109.9
638	S	32.7	Very low	34.2	Very low	117 Å²	117	144.2 Å²	144.2	82%	0.818	81%	0.807	S	S	*	*			trans	-170.3	131.8	149.5	43.3	0	0	0	0	113.6
639	V	43	Very low	34.3	Very low	138 Å²	138	149.6 Å²	149.6	84%	0.836	81%	0.814	S	S	*	*			trans	-152.5	145	166.8	-173.7	0	0	0	0	107.3
640	P	44.3	Very low	34.2	Very low	121 Å²	121	147.4 Å²	147.4	79%	0.786	81%	0.811	S	S	*	*			trans	-142	168.2	144.9	33.6	-16.2	0	0	0	115.3
641	D	32.2	Very low	33.9	Very low	149 Å²	149	144.3 Å²	144.3	80%	0.797	81%	0.807	S	S	*	*			trans	-84.6	162.4	-165.4	-60.7	-81	0	0	0	118.5
642	T	29.6	Very low	32.7	Very low	147 Å²	147	143.5 Å²	143.5	90%	0.902	81%	0.81	S	S	*	*				-133.6	114.3	121.7	53.3	0	0	0	0	111
643	G	31.6	Very low	32.8	Very low	62 Å²	62	143.9 Å²	143.9	64%	0.639	81%	0.813	S	S	*	*			trans	-93.2	-130.9	172.4	0	0	0	0	0	112
644	P	53.9	Low	32.6	Very low	118 Å²	118	145 Å²	145	77%	0.766	82%	0.816	S	S	*	*			cis	-139.3	178.5	-34.2	32.2	-12.5	0	0	0	112.7
645	L	28.9	Very low	32.5	Very low	132 Å²	132	142.5 Å²	142.5	69%	0.691	81%	0.812	S	S	*	*				176.8	136.8	127.4	-115.7	56.2	0	0	0	115.4
646	W	31.7	Very low	32.3	Very low	228 Å²	228	137.1 Å²	137.1	86%	0.864	81%	0.809	S	S	*	*			trans	57.9	96.8	158.3	-52.4	131.2	0	0	0	121.8
647	D	36.2	Very low	32.4	Very low	149 Å²	149	135.6 Å²	135.6	80%	0.797	81%	0.812	S	S	*	*			trans	-69.8	147.1	140.5	-68.1	-68.3	0	0	0	111.5
648	M	30	Very low	32.7	Very low	168 Å²	168	131.1 Å²	131.1	83%	0.828	81%	0.81	S	S	*	*				-166.6	151.1	126.7	-155.2	55.1	63.9	0	0	111.9
649	H	34	Very low	32.6	Very low	179 Å²	179	135 Å²	135	83%	0.829	82%	0.815	S	S	*	*			trans	-69.3	156.9	173.8	-47.2	-92.6	0	0	0	113.2
650	T	26.6	Very low	31.9	Very low	141 Å²	141	132.7 Å²	132.7	87%	0.865	81%	0.81	S	S	*	*			trans	-157.4	158.1	143.4	-167.6	0	0	0	0	113.6
651	S	27.4	Very low	31.5	Very low	112 Å²	112	132.2 Å²	132.2	78%	0.783	81%	0.81	S	S	*	*			trans	-83.7	178.5	168.7	-62.7	0	0	0	0	111.5
652	A	26.7	Very low	31.3	Very low	100 Å²	100	133.3 Å²	133.3	83%	0.826	82%	0.815	S	S	*	*			trans	-83.4	134.6	-177.7	0	0	0	0	0	114.6
653	S	29.8	Very low	31.8	Very low	120 Å²	120	138.1 Å²	138.1	84%	0.839	82%	0.817	S	S	*	*			trans	-165.2	135.8	142.5	48.7	0	0	0	0	115.3
654	Q	27.2	Very low	31.9	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	82%	0.821	S	S	*	*			trans	-4.4	146.3	162	-56.6	176.9	-3.9	0	0	123.8
655	S	27.5	Very low	31	Very low	117 Å²	117	143 Å²	143	82%	0.818	82%	0.821	S	S	*	*			trans	75.6	157.3	144.2	82.7	0	0	0	0	118.2
656	S	31.1	Very low	31.9	Very low	110 Å²	110	141.6 Å²	141.6	77%	0.769	82%	0.818	S	S	*	*			cis	-156.6	144.1	2	54.8	0	0	0	0	112.4
657	G	30.2	Very low	31.9	Very low	87 Å²	87	138.8 Å²	138.8	90%	0.897	82%	0.817	S	S	*	*			trans	56.8	143.6	151.1	0	0	0	0	0	121.7
658	G	31.7	Very low	31.7	Very low	79 Å²	79	138.7 Å²	138.7	81%	0.814	82%	0.816	S	S	*	*			cis	140.8	109.7	-16.4	0	0	0	0	0	115.6
659	E	30.3	Very low	32.5	Very low	198 Å²	198	136.5 Å²	136.5	93%	0.925	81%	0.814	S	S	*	*			trans	-169.5	148.4	160	54.6	-172.5	164	0	0	109.6
660	A	30	Very low	32.9	Very low	90 Å²	90	135 Å²	135	74%	0.744	81%	0.812	S	S	*	*			cis	-142.9	148.4	-7.1	0	0	0	0	0	112.8
661	S	35.3	Very low	33.5	Very low	111 Å²	111	135.1 Å²	135.1	78%	0.776	81%	0.813	S	S	*	*			trans	35.9	105	149.2	-57	0	0	0	0	121.8
662	L	26.9	Very low	34.5	Very low	172 Å²	172	139 Å²	139	90%	0.901	82%	0.819	S	S	*	*			trans	-143.2	51.1	137.3	-129.4	172	0	0	0	110.9
663	W	39.7	Very low	35.7	Very low	247 Å²	247	137.1 Å²	137.1	94%	0.936	81%	0.81	S	S	*	*			trans	-104.2	99.4	179.3	-75.6	119	0	0	0	112.1
664	D	34.4	Very low	36.9	Very low	135 Å²	135	136.5 Å²	136.5	72%	0.722	80%	0.803	S	S	*	*			trans	-168.2	142.5	134	-129.9	-3.5	0	0	0	106.5
665	L	35.9	Very low	38.9	Very low	148 Å²	148	131.6 Å²	131.6	78%	0.775	79%	0.785	S	S	*	*			cis	-132.4	162.3	26.9	-80.6	155.7	0	0	0	114.4
666	T	46.5	Very low	41	Very low	103 Å²	103	133 Å²	133	63%	0.632	78%	0.782	S	S	*	*			trans	-50.9	143.4	172.6	59.1	0	0	0	0	115.3
667	M	31.7	Very low	42.9	Very low	169 Å²	169	132.1 Å²	132.1	83%	0.833	77%	0.767	S	S	*	*				-161.6	122.8	129.4	-97.1	-45.4	138.6	0	0	114.4
668	N	32.8	Very low	44.7	Very low	147 Å²	147	130.2 Å²	130.2	79%	0.786	73%	0.734	S	S	*	*			trans	40.8	119.7	140	-139.3	-1.3	0	0	0	121.9
669	P	45.9	Very low	46.9	Very low	122 Å²	122	131.4 Å²	131.4	79%	0.792	72%	0.721	S	S	*	*			trans	-100	88.8	-177.1	37.6	-33.1	0	0	0	114.9
670	N	42.6	Very low	49.2	Very low	147 Å²	147	128.8 Å²	128.8	79%	0.786	71%	0.709	S	S	*	*			trans	-161.1	86.5	159.2	-140.8	-4.9	0	0	0	117
671	T	40.8	Very low	51.7	Low	143 Å²	143	127.7 Å²	127.7	88%	0.877	69%	0.688	S	S	*	*			trans	-150.1	116.4	156.8	48.2	0	0	0	0	110.6
672	Q	47.8	Very low	53.7	Low	193 Å²	193	124.5 Å²	124.5	90%	0.902	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-86.1	123.2	170.5	-69.2	-172.7	-0.7	0	0	110.6
673	G	51.7	Low	56.2	Low	62 Å²	62	120.7 Å²	120.7	64%	0.639	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-74.5	158.3	176.2	0	0	0	0	0	113.5	T675	G673-T675 PolarHBondContact O-N 2.88Å
674	P	54.5	Low	58.3	Low	107 Å²	107	114 Å²	114	70%	0.695	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-66.6	131.6	-176.6	27	-34.6	0	0	0	112.5
675	T	70.3	Confident	60.6	Low	77 Å²	77	115 Å²	115	47%	0.472	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-59.1	143.5	-176.6	65.7	0	0	0	0	113	G673 E677 Q678 K1113	G673-T675 PolarHBondContact O-N 2.88Å; T675-E677 PolarHBondContact O-N 3.21Å; T675-Q678 VanDerWaalsContact O-CB 3.23Å; T675-Q678 WeakPolarHBondContact O-CB 3.49Å; T675-Q678 PolarHBondContact O-N 2.72Å; T675-K1113 PolarHBondContact OG1-NZ 3.07Å
676	L	70.6	Confident	62.8	Low	145 Å²	145	114.2 Å²	114.2	76%	0.759	60%	0.599	S	S	*	*	H	α-helix	trans	-44.1	-40	179.9	-171.8	75	0	0	0	114.1	Q678 L679 Q680	L676-Q678 VanDerWaalsContact C-N 3.31Å; L676-Q678 PolarHBondContact O-N 2.89Å; L676-L679 WeakPolarHBondContact O-CB 3.23Å; L676-L679 PolarHBondContact O-N 2.7Å; L676-Q680 PolarHBondContact O-N 2.86Å
677	E	72	Confident	64.7	Low	93 Å²	93	112.5 Å²	112.5	44%	0.435	59%	0.586	S	S	.	*	H	α-helix	trans	-62.9	-33.1	-179.5	-158.7	-177.2	-171.4	0	0	113.1	T675 K681 K1113	T675-E677 PolarHBondContact O-N 3.21Å; E677-K681 WeakPolarHBondContact O-CB 3.49Å; E677-K681 PolarHBondContact O-N 2.96Å; E677-K681 VanDerWaalsContact O-N 3.12Å; E677-K1113 VanDerWaalsContact OE2-CD 3.29Å; E677-K1113 WeakPolarHBondContact OE2-CD 3.5Å; E677-K1113 WeakPolarHBondContact OE2-CE 3.35Å; E677-K1113 IonicContact OE2-NZ 3.85Å; E677-K1113 PolarHBondContact OE2-NZ 3.29Å
678	Q	67.3	Low	67.2	Low	46 Å²	46	106.6 Å²	106.6	22%	0.215	56%	0.563	C	S	.	*	H	α-helix	trans	-64.8	-43.7	176.1	-154.1	84.2	-8.6	0	0	110	T675 L676 K681 L682 Q1110 G1111	T675-Q678 VanDerWaalsContact O-CB 3.23Å; T675-Q678 WeakPolarHBondContact O-CB 3.49Å; T675-Q678 PolarHBondContact O-N 2.72Å; L676-Q678 VanDerWaalsContact C-N 3.31Å; L676-Q678 PolarHBondContact O-N 2.89Å; Q678-K681 PolarHBondContact O-N 3Å; Q678-L682 WeakPolarHBondContact O-CB 3.45Å; Q678-L682 PolarHBondContact O-N 3.08Å; Q678-Q1110 PolarHBondContact NE2-O 2.83Å; Q678-G1111 VanDerWaalsContact NE2-C 3.3Å; Q678-G1111 PolarHBondContact NE2-O 3.46Å
679	L	77.6	Confident	69.8	Low	105 Å²	105	104.3 Å²	104.3	55%	0.55	55%	0.548	S	S	.	.	H	α-helix	trans	-66.5	-41.6	177.9	-106.5	161	0	0	0	112.6	L676 L682 Q683	L676-L679 WeakPolarHBondContact O-CB 3.23Å; L676-L679 PolarHBondContact O-N 2.7Å; L679-L682 HydrophobicContact CD2-CD1 4.45Å; L679-L682 WeakPolarHBondContact O-CB 3.25Å; L679-L682 PolarHBondContact O-N 2.77Å; L679-Q683 PolarHBondContact O-N 3.44Å; L679-Q683 VanDerWaalsContact O-N 3.08Å
680	Q	78.8	Confident	71.6	Confident	142 Å²	142	102.9 Å²	102.9	66%	0.664	53%	0.533	S	S	*	.	H	α-helix	trans	-63.9	-43.7	176.2	-172.7	173.5	7.7	0	0	111.6	L676 L682 Q683 E684	L676-Q680 PolarHBondContact O-N 2.86Å; Q680-L682 VanDerWaalsContact C-N 3.28Å; Q680-L682 PolarHBondContact O-N 3.04Å; Q680-Q683 WeakPolarHBondContact O-CB 3.48Å; Q680-Q683 PolarHBondContact O-N 2.82Å; Q680-E684 PolarHBondContact O-N 3.01Å
681	K	82.4	Confident	73.4	Confident	68 Å²	68	101.9 Å²	101.9	30%	0.296	52%	0.519	S	S	.	.	H	α-helix	trans	-67.6	-29.2	176.5	-167	171.9	-174.5	162.6	0	113	E677 Q678 R685 G1112 M1114	E677-K681 WeakPolarHBondContact O-CB 3.49Å; E677-K681 PolarHBondContact O-N 2.96Å; E677-K681 VanDerWaalsContact O-N 3.12Å; Q678-K681 PolarHBondContact O-N 3Å; K681-R685 WeakPolarHBondContact O-CB 3.35Å; K681-R685 PolarHBondContact O-N 3Å; K681-G1112 WeakPolarHBondContact CD-O 3.47Å; K681-G1112 VanDerWaalsContact CE-O 3.32Å; K681-G1112 WeakPolarHBondContact CE-O 3.46Å; K681-G1112 PolarHBondContact NZ-O 3.31Å; K681-M1114 HydrophobicContact CD-CE 4.16Å; K681-M1114 HydrophobicContact CG-CE 4.4Å
682	L	78.3	Confident	75.6	Confident	44 Å²	44	97.2 Å²	97.2	23%	0.23	50%	0.495	C	S	.	.	H	α-helix	trans	-60.6	-49.8	171	-127.4	173.6	0	0	0	111.7	Q678 L679 Q680 R685 R686 Q1110	Q678-L682 WeakPolarHBondContact O-CB 3.45Å; Q678-L682 PolarHBondContact O-N 3.08Å; L679-L682 HydrophobicContact CD2-CD1 4.45Å; L679-L682 WeakPolarHBondContact O-CB 3.25Å; L679-L682 PolarHBondContact O-N 2.77Å; Q680-L682 VanDerWaalsContact C-N 3.28Å; Q680-L682 PolarHBondContact O-N 3.04Å; L682-R685 PolarHBondContact O-N 2.95Å; L682-R686 PolarHBondContact O-N 3.21Å; L682-Q1110 HydrophobicContact CG-CG 4.35Å
683	Q	79.4	Confident	77.5	Confident	91 Å²	91	93.8 Å²	93.8	43%	0.425	48%	0.477	S	S	.	.	H	α-helix	trans	-61.8	-45.7	176.6	-167.1	80.3	-23.5	0	0	110.6	L679 Q680 R685 R686 D687	L679-Q683 PolarHBondContact O-N 3.44Å; L679-Q683 VanDerWaalsContact O-N 3.08Å; Q680-Q683 WeakPolarHBondContact O-CB 3.48Å; Q680-Q683 PolarHBondContact O-N 2.82Å; Q683-R685 VanDerWaalsContact C-N 3.31Å; Q683-R685 PolarHBondContact O-N 3.19Å; Q683-R686 PolarHBondContact O-N 2.93Å; Q683-R686 VanDerWaalsContact OE1-NH2 3.17Å; Q683-D687 PolarHBondContact O-N 3.39Å
684	E	84.3	Confident	78.9	Confident	106 Å²	106	99 Å²	99	50%	0.495	48%	0.477	S	S	.	.	H	α-helix	trans	-60.2	-38.3	176	-172.6	176.9	-144.6	0	0	112.4	Q680 D687 A688	Q680-E684 PolarHBondContact O-N 3.01Å; E684-D687 PolarHBondContact O-N 3.24Å; E684-A688 VanDerWaalsContact O-CB 3.26Å; E684-A688 WeakPolarHBondContact O-CB 3.39Å; E684-A688 PolarHBondContact O-N 2.88Å
685	R	81.8	Confident	80	Confident	156 Å²	156	103 Å²	103	59%	0.589	48%	0.478	S	S	*	.	H	α-helix	trans	-64.6	-43.7	174.8	-168	179.8	-174.1	-170.4	1.9	111.8	K681 L682 Q683 A688 E689	K681-R685 WeakPolarHBondContact O-CB 3.35Å; K681-R685 PolarHBondContact O-N 3Å; L682-R685 PolarHBondContact O-N 2.95Å; Q683-R685 VanDerWaalsContact C-N 3.31Å; Q683-R685 PolarHBondContact O-N 3.19Å; R685-A688 PolarHBondContact O-N 3.17Å; R685-E689 PolarHBondContact O-N 3.44Å
686	R	83.1	Confident	80.7	Confident	133 Å²	133	105.9 Å²	105.9	50%	0.502	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-44.1	174.3	-87.2	-153.7	-93.8	83.8	-0.4	111.9	L682 Q683 E689 L690	L682-R686 PolarHBondContact O-N 3.21Å; Q683-R686 PolarHBondContact O-N 2.93Å; Q683-R686 VanDerWaalsContact OE1-NH2 3.17Å; R686-E689 PolarHBondContact O-N 3.36Å; R686-L690 WeakPolarHBondContact O-CG 3.38Å; R686-L690 PolarHBondContact O-N 2.99Å
687	D	84.4	Confident	81.2	Confident	67 Å²	67	105 Å²	105	36%	0.358	48%	0.476	S	S	.	.	H	α-helix	trans	-69.4	-35.1	179.6	-72.5	-15.8	0	0	0	112.6	Q683 E684 L690 R691	Q683-D687 PolarHBondContact O-N 3.39Å; E684-D687 PolarHBondContact O-N 3.24Å; D687-L690 PolarHBondContact O-N 3.47Å; D687-R691 VanDerWaalsContact CB-NH2 3.29Å; D687-R691 WeakPolarHBondContact O-CB 3.05Å; D687-R691 VanDerWaalsContact O-CG 3.3Å; D687-R691 WeakPolarHBondContact O-CG 3.44Å; D687-R691 PolarHBondContact O-N 3.05Å; D687-R691 PolarHBondContact O-NE 3.09Å
688	A	84.9	Confident	81.7	Confident	44 Å²	44	105.2 Å²	105.2	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-62.9	-42	171.1	0	0	0	0	0	111.5	E684 R685 R691 A692	E684-A688 VanDerWaalsContact O-CB 3.26Å; E684-A688 WeakPolarHBondContact O-CB 3.39Å; E684-A688 PolarHBondContact O-N 2.88Å; R685-A688 PolarHBondContact O-N 3.17Å; A688-R691 PolarHBondContact O-N 3.25Å; A688-A692 WeakPolarHBondContact O-CB 3.42Å; A688-A692 PolarHBondContact O-N 3.01Å
689	E	87	Confident	81.8	Confident	99 Å²	99	110.9 Å²	110.9	46%	0.463	50%	0.503	S	S	.	.	H	α-helix	trans	-67.2	-41.3	176.1	-158.5	-160.2	125.3	0	0	112.2	R685 R686 R691 A692 K693	R685-E689 PolarHBondContact O-N 3.44Å; R686-E689 PolarHBondContact O-N 3.36Å; E689-R691 VanDerWaalsContact C-N 3.33Å; E689-R691 PolarHBondContact O-N 3.4Å; E689-A692 CarbonylContact O-C 3.59Å; E689-A692 WeakPolarHBondContact O-CB 3.44Å; E689-A692 PolarHBondContact O-N 2.86Å; E689-A692 VanDerWaalsContact O-N 3.1Å; E689-K693 WeakPolarHBondContact O-CB 3.4Å; E689-K693 PolarHBondContact O-N 3.42Å; E689-K693 WeakPolarHBondContact OE1-CE 3.35Å; E689-K693 IonicContact OE1-NZ 2.66Å; E689-K693 PolarHBondContact OE1-NZ 3.27Å
690	L	83.6	Confident	81.7	Confident	92 Å²	92	114.3 Å²	114.3	48%	0.482	51%	0.509	S	S	.	.	H	α-helix	trans	-63.5	-36.7	174.5	-74.7	168.8	0	0	0	112.2	R686 D687 R694	R686-L690 WeakPolarHBondContact O-CG 3.38Å; R686-L690 PolarHBondContact O-N 2.99Å; D687-L690 PolarHBondContact O-N 3.47Å; L690-R694 PolarHBondContact O-N 3.31Å
691	R	81.1	Confident	81.2	Confident	127 Å²	127	110.3 Å²	110.3	48%	0.479	50%	0.496	S	S	.	.	H	α-helix	trans	-66.4	-39.6	170.1	-74	178.3	-116.5	123.6	-5.3	111.5	D687 A688 E689 R695	D687-R691 VanDerWaalsContact CB-NH2 3.29Å; D687-R691 WeakPolarHBondContact O-CB 3.05Å; D687-R691 VanDerWaalsContact O-CG 3.3Å; D687-R691 WeakPolarHBondContact O-CG 3.44Å; D687-R691 PolarHBondContact O-N 3.05Å; D687-R691 PolarHBondContact O-NE 3.09Å; A688-R691 PolarHBondContact O-N 3.25Å; E689-R691 VanDerWaalsContact C-N 3.33Å; E689-R691 PolarHBondContact O-N 3.4Å; R691-R695 WeakPolarHBondContact O-CB 3.43Å; R691-R695 WeakPolarHBondContact O-CG 3.43Å; R691-R695 PolarHBondContact O-N 3.18Å
692	A	86.4	Confident	80.6	Confident	45 Å²	45	110.3 Å²	110.3	37%	0.372	51%	0.505	S	S	.	.	H	α-helix	trans	-68.1	-41.6	176.4	0	0	0	0	0	112.8	A688 E689 R695 K696	A688-A692 WeakPolarHBondContact O-CB 3.42Å; A688-A692 PolarHBondContact O-N 3.01Å; E689-A692 CarbonylContact O-C 3.59Å; E689-A692 WeakPolarHBondContact O-CB 3.44Å; E689-A692 PolarHBondContact O-N 2.86Å; E689-A692 VanDerWaalsContact O-N 3.1Å; A692-R695 CarbonylContact O-C 3.59Å; A692-R695 PolarHBondContact O-N 3Å; A692-K696 WeakPolarHBondContact O-CG 3.48Å; A692-K696 PolarHBondContact O-N 3.1Å
693	K	88.3	Confident	80.5	Confident	121 Å²	121	114.5 Å²	114.5	53%	0.526	52%	0.522	S	S	.	.	H	α-helix	trans	-60.6	-48.6	173.6	-86.2	170.5	165.6	162.6	0	110.8	E689 R695 K696 Q697	E689-K693 WeakPolarHBondContact O-CB 3.4Å; E689-K693 PolarHBondContact O-N 3.42Å; E689-K693 WeakPolarHBondContact OE1-CE 3.35Å; E689-K693 IonicContact OE1-NZ 2.66Å; E689-K693 PolarHBondContact OE1-NZ 3.27Å; K693-R695 PolarHBondContact O-N 2.88Å; K693-K696 PolarHBondContact O-N 3.44Å; K693-K696 VanDerWaalsContact O-N 3.12Å; K693-Q697 PolarHBondContact O-N 3.05Å
694	R	80.3	Confident	79.6	Confident	172 Å²	172	114.7 Å²	114.7	65%	0.649	53%	0.525	S	S	*	.	H	α-helix	trans	-58.3	-45.5	172.3	-77.3	-172	-81.1	-170.8	-4.6	112.5	L690 K696 Q697 V698	L690-R694 PolarHBondContact O-N 3.31Å; R694-K696 VanDerWaalsContact C-N 3.28Å; R694-K696 PolarHBondContact O-N 2.95Å; R694-Q697 PolarHBondContact O-N 3.37Å; R694-V698 WeakPolarHBondContact O-CG2 3.43Å; R694-V698 PolarHBondContact O-N 3.12Å
695	R	79.2	Confident	78.8	Confident	190 Å²	190	113.2 Å²	113.2	72%	0.717	52%	0.521	S	S	*	.	H	α-helix	trans	-66.9	-20	175.5	-73.6	179.2	178.2	-138.5	0.1	114.7	R691 A692 K693 R699	R691-R695 WeakPolarHBondContact O-CB 3.43Å; R691-R695 WeakPolarHBondContact O-CG 3.43Å; R691-R695 PolarHBondContact O-N 3.18Å; A692-R695 CarbonylContact O-C 3.59Å; A692-R695 PolarHBondContact O-N 3Å; K693-R695 PolarHBondContact O-N 2.88Å; R695-R699 PolarHBondContact O-NE 2.75Å; R695-R699 PolarHBondContact O-NH2 2.88Å
696	K	84.3	Confident	77.9	Confident	137 Å²	137	112 Å²	112	60%	0.596	52%	0.522	S	S	*	.	H	α-helix	trans	-82.2	-40.7	169.4	-76.3	179.4	177.8	-177	0	110.8	A692 K693 R694 R699 R700	A692-K696 WeakPolarHBondContact O-CG 3.48Å; A692-K696 PolarHBondContact O-N 3.1Å; K693-K696 PolarHBondContact O-N 3.44Å; K693-K696 VanDerWaalsContact O-N 3.12Å; R694-K696 VanDerWaalsContact C-N 3.28Å; R694-K696 PolarHBondContact O-N 2.95Å; K696-R699 PolarHBondContact O-N 2.92Å; K696-R700 PolarHBondContact O-N 2.96Å
697	Q	81.4	Confident	76.9	Confident	126 Å²	126	111.4 Å²	111.4	59%	0.589	52%	0.523	S	S	*	.	H	α-helix	trans	-66.6	-44	179.3	-169.5	64.3	6.1	0	0	112.6	K693 R694 R699 R700 S701	K693-Q697 PolarHBondContact O-N 3.05Å; R694-Q697 PolarHBondContact O-N 3.37Å; Q697-R699 VanDerWaalsContact C-N 3.31Å; Q697-R699 PolarHBondContact O-N 2.61Å; Q697-R700 PolarHBondContact O-N 3.27Å; Q697-R700 VanDerWaalsContact O-N 3.1Å; Q697-S701 PolarHBondContact O-N 3.39Å
698	V	82.6	Confident	75.5	Confident	99 Å²	99	111.3 Å²	111.3	60%	0.6	53%	0.528	S	S	*	.	H	α-helix	trans	-60.9	-39.1	176.4	172.1	0	0	0	0	111.6	R694 S701 S702	R694-V698 WeakPolarHBondContact O-CG2 3.43Å; R694-V698 PolarHBondContact O-N 3.12Å; V698-S701 PolarHBondContact O-N 2.81Å; V698-S702 WeakPolarHBondContact O-CB 3.45Å; V698-S702 PolarHBondContact O-N 2.8Å
699	R	69.7	Low	74	Confident	164 Å²	164	115 Å²	115	62%	0.619	54%	0.538	S	S	*	.	H	α-helix	trans	-68	-36.2	173.3	-82.8	-179.9	-69.3	157.3	-4.3	113.1	R695 K696 Q697 F703	R695-R699 PolarHBondContact O-NE 2.75Å; R695-R699 PolarHBondContact O-NH2 2.88Å; K696-R699 PolarHBondContact O-N 2.92Å; Q697-R699 VanDerWaalsContact C-N 3.31Å; Q697-R699 PolarHBondContact O-N 2.61Å; R699-F703 VanDerWaalsContact O-CB 3.27Å; R699-F703 WeakPolarHBondContact O-CB 3.3Å; R699-F703 PolarHBondContact O-N 2.97Å
700	R	73.9	Confident	72.3	Confident	177 Å²	177	113.3 Å²	113.3	67%	0.668	54%	0.536	S	S	*	.	H	α-helix	trans	-65.7	-40.5	173	-86	-179.4	161.1	168.7	-7.1	112.3	K696 Q697 N704	K696-R700 PolarHBondContact O-N 2.96Å; Q697-R700 PolarHBondContact O-N 3.27Å; Q697-R700 VanDerWaalsContact O-N 3.1Å; R700-N704 WeakPolarHBondContact O-CB 3.43Å; R700-N704 VanDerWaalsContact O-CG 3.28Å; R700-N704 PolarHBondContact O-N 3.36Å; R700-N704 VanDerWaalsContact O-N 3.09Å
701	S	69.9	Low	70.9	Confident	58 Å²	58	112.6 Å²	112.6	41%	0.406	53%	0.533	S	S	.	.	H	α-helix	trans	-59.9	-61.8	170.5	-163.1	0	0	0	0	109.5	Q697 V698 F703 N704 D705	Q697-S701 PolarHBondContact O-N 3.39Å; V698-S701 PolarHBondContact O-N 2.81Å; S701-F703 PolarHBondContact O-N 3.02Å; S701-N704 CarbonylContact O-C 3.59Å; S701-N704 WeakPolarHBondContact O-CA 3.43Å; S701-N704 WeakPolarHBondContact O-CB 3.36Å; S701-N704 PolarHBondContact O-N 3.45Å; S701-D705 WeakPolarHBondContact O-CB 3.41Å; S701-D705 VanDerWaalsContact O-CG 3.24Å; S701-D705 PolarHBondContact O-N 3.17Å; S701-D705 PolarHBondContact OG-OD2 2.92Å
702	S	70	Confident	69.6	Low	68 Å²	68	109.7 Å²	109.7	48%	0.476	53%	0.526	S	S	.	.	H	α-helix	trans	-53	-35.5	-177	178.6	0	0	0	0	113.7	V698 D705 Q706	V698-S702 WeakPolarHBondContact O-CB 3.45Å; V698-S702 PolarHBondContact O-N 2.8Å; S702-D705 PolarHBondContact N-OD2 2.84Å; S702-Q706 WeakPolarHBondContact O-CB 3.46Å; S702-Q706 PolarHBondContact O-N 2.86Å
703	F	75.4	Confident	68.1	Low	132 Å²	132	113 Å²	113	58%	0.579	54%	0.538	S	S	*	.	H	α-helix	trans	-70.5	-43.4	173.7	-178.9	-99.1	0	0	0	112.9	R699 S701 Q706 K707	R699-F703 VanDerWaalsContact O-CB 3.27Å; R699-F703 WeakPolarHBondContact O-CB 3.3Å; R699-F703 PolarHBondContact O-N 2.97Å; S701-F703 PolarHBondContact O-N 3.02Å; F703-Q706 PolarHBondContact O-N 3.41Å; F703-K707 VanDerWaalsContact O-CB 3.29Å; F703-K707 WeakPolarHBondContact O-CB 3.48Å; F703-K707 PolarHBondContact O-N 2.92Å
704	N	61	Low	66.5	Low	95 Å²	95	113.7 Å²	113.7	51%	0.508	54%	0.543	S	S	.	.	H	α-helix	trans	-66.9	-37.5	174.6	-73	-5.6	0	0	0	112	R700 S701 K707 S708	R700-N704 WeakPolarHBondContact O-CB 3.43Å; R700-N704 VanDerWaalsContact O-CG 3.28Å; R700-N704 PolarHBondContact O-N 3.36Å; R700-N704 VanDerWaalsContact O-N 3.09Å; S701-N704 CarbonylContact O-C 3.59Å; S701-N704 WeakPolarHBondContact O-CA 3.43Å; S701-N704 WeakPolarHBondContact O-CB 3.36Å; S701-N704 PolarHBondContact O-N 3.45Å; N704-K707 PolarHBondContact O-N 3.35Å; N704-S708 VanDerWaalsContact O-CB 3.31Å; N704-S708 WeakPolarHBondContact O-CB 3.25Å; N704-S708 PolarHBondContact O-N 2.91Å; N704-S708 PolarHBondContact O-OG 2.87Å
705	D	65.9	Low	65.2	Low	76 Å²	76	112.4 Å²	112.4	41%	0.406	54%	0.538	S	S	.	.	H	α-helix	trans	-65.1	-45	175.2	-65.6	-49.1	0	0	0	110.2	S701 S702 S708 Q709	S701-D705 WeakPolarHBondContact O-CB 3.41Å; S701-D705 VanDerWaalsContact O-CG 3.24Å; S701-D705 PolarHBondContact O-N 3.17Å; S701-D705 PolarHBondContact OG-OD2 2.92Å; S702-D705 PolarHBondContact N-OD2 2.84Å; D705-S708 PolarHBondContact O-N 3.48Å; D705-Q709 WeakPolarHBondContact O-CB 3.33Å; D705-Q709 VanDerWaalsContact O-CG 3.29Å; D705-Q709 WeakPolarHBondContact O-CG 3.31Å; D705-Q709 PolarHBondContact O-N 2.81Å
706	Q	63.7	Low	63.9	Low	130 Å²	130	105.9 Å²	105.9	61%	0.607	52%	0.516	S	S	*	.	H	α-helix	trans	-66.6	-39.9	175.5	-171.4	171.9	12	0	0	112.3	S702 F703 S708 Q709 S710	S702-Q706 WeakPolarHBondContact O-CB 3.46Å; S702-Q706 PolarHBondContact O-N 2.86Å; F703-Q706 PolarHBondContact O-N 3.41Å; Q706-S708 VanDerWaalsContact C-N 3.32Å; Q706-S708 PolarHBondContact O-N 3.49Å; Q706-Q709 PolarHBondContact O-N 2.97Å; Q706-S710 PolarHBondContact O-N 2.85Å
707	K	61.2	Low	62.6	Low	121 Å²	121	102.5 Å²	102.5	53%	0.526	51%	0.508	S	S	.	.	H	α-helix	trans	-65.4	-34.9	173	-174.5	175.3	-178.8	179	0	112.2	F703 N704 S710 L711	F703-K707 VanDerWaalsContact O-CB 3.29Å; F703-K707 WeakPolarHBondContact O-CB 3.48Å; F703-K707 PolarHBondContact O-N 2.92Å; N704-K707 PolarHBondContact O-N 3.35Å; K707-S710 PolarHBondContact O-OG 2.94Å; K707-L711 HydrophobicContact CG-CD1 4.27Å; K707-L711 WeakPolarHBondContact O-CB 3.48Å; K707-L711 WeakPolarHBondContact O-CD1 3.37Å; K707-L711 VanDerWaalsContact O-CG 3.27Å; K707-L711 WeakPolarHBondContact O-CG 3.48Å; K707-L711 PolarHBondContact O-N 2.92Å; K707-L711 VanDerWaalsContact O-N 3.11Å
708	S	55.3	Low	61.6	Low	65 Å²	65	101.2 Å²	101.2	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-70.4	-38.5	174	-58	0	0	0	0	111.2	N704 D705 Q706 L712	N704-S708 VanDerWaalsContact O-CB 3.31Å; N704-S708 WeakPolarHBondContact O-CB 3.25Å; N704-S708 PolarHBondContact O-N 2.91Å; N704-S708 PolarHBondContact O-OG 2.87Å; D705-S708 PolarHBondContact O-N 3.48Å; Q706-S708 VanDerWaalsContact C-N 3.32Å; Q706-S708 PolarHBondContact O-N 3.49Å; S708-L712 WeakPolarHBondContact O-CB 3.26Å; S708-L712 VanDerWaalsContact O-CG 3.25Å; S708-L712 WeakPolarHBondContact O-CG 3.37Å; S708-L712 PolarHBondContact O-N 3.15Å
709	Q	54.7	Low	60.3	Low	122 Å²	122	97.9 Å²	97.9	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-68	-37.7	174.5	-73	174.1	37.4	0	0	112.6	D705 Q706 L712 N713	D705-Q709 WeakPolarHBondContact O-CB 3.33Å; D705-Q709 VanDerWaalsContact O-CG 3.29Å; D705-Q709 WeakPolarHBondContact O-CG 3.31Å; D705-Q709 PolarHBondContact O-N 2.81Å; Q706-Q709 PolarHBondContact O-N 2.97Å; Q709-L712 PolarHBondContact O-N 2.8Å; Q709-N713 WeakPolarHBondContact O-CB 3.27Å; Q709-N713 PolarHBondContact O-N 2.89Å
710	S	51.5	Low	59.7	Low	62 Å²	62	92.9 Å²	92.9	43%	0.434	47%	0.474	S	S	.	.	H	α-helix	trans	-66.2	-46.7	174.8	66.7	0	0	0	0	111.5	Q706 K707 L712 N713 E714	Q706-S710 PolarHBondContact O-N 2.85Å; K707-S710 PolarHBondContact O-OG 2.94Å; S710-L712 PolarHBondContact O-N 3.09Å; S710-N713 PolarHBondContact O-N 3.46Å; S710-N713 VanDerWaalsContact O-N 3.17Å; S710-E714 WeakPolarHBondContact O-CB 3.44Å; S710-E714 PolarHBondContact O-N 3.03Å
711	L	54	Low	59.2	Low	78 Å²	78	89.5 Å²	89.5	41%	0.408	47%	0.469	S	S	.	.	H	α-helix	trans	-63.6	-28.5	176	-71.5	169.5	0	0	0	113	K707 R715	K707-L711 HydrophobicContact CG-CD1 4.27Å; K707-L711 WeakPolarHBondContact O-CB 3.48Å; K707-L711 WeakPolarHBondContact O-CD1 3.37Å; K707-L711 VanDerWaalsContact O-CG 3.27Å; K707-L711 WeakPolarHBondContact O-CG 3.48Å; K707-L711 PolarHBondContact O-N 2.92Å; K707-L711 VanDerWaalsContact O-N 3.11Å; L711-R715 VanDerWaalsContact O-CG 3.32Å; L711-R715 WeakPolarHBondContact O-CG 3.33Å; L711-R715 PolarHBondContact O-N 3.38Å
712	L	53.4	Low	58.9	Low	65 Å²	65	91.4 Å²	91.4	34%	0.34	47%	0.47	S	S	.	.	H	α-helix	trans	-71.5	-52	169.5	-76.3	167.7	0	0	0	110.9	S708 Q709 S710 E714 R715 Q716	S708-L712 WeakPolarHBondContact O-CB 3.26Å; S708-L712 VanDerWaalsContact O-CG 3.25Å; S708-L712 WeakPolarHBondContact O-CG 3.37Å; S708-L712 PolarHBondContact O-N 3.15Å; Q709-L712 PolarHBondContact O-N 2.8Å; S710-L712 PolarHBondContact O-N 3.09Å; L712-E714 VanDerWaalsContact C-N 3.27Å; L712-E714 PolarHBondContact O-N 3.48Å; L712-R715 CarbonylContact O-C 3.42Å; L712-R715 PolarHBondContact O-N 3.43Å; L712-Q716 WeakPolarHBondContact O-CG 3.42Å; L712-Q716 PolarHBondContact O-N 2.75Å
713	N	54.5	Low	58.2	Low	115 Å²	115	90.3 Å²	90.3	62%	0.615	46%	0.456	S	S	*	.	H	α-helix	trans	-59.4	-35	-179.8	-80.4	3.3	0	0	0	113.1	Q709 S710 P717	Q709-N713 WeakPolarHBondContact O-CB 3.27Å; Q709-N713 PolarHBondContact O-N 2.89Å; S710-N713 PolarHBondContact O-N 3.46Å; S710-N713 VanDerWaalsContact O-N 3.17Å; N713-P717 WeakPolarHBondContact O-CD 3.49Å
714	E	54.6	Low	57.8	Low	136 Å²	136	87 Å²	87	64%	0.636	45%	0.446	S	S	*	.	H	α-helix	trans	-66.9	-35.1	175.1	-171.8	175.5	-162.3	0	0	112.4	S710 L712	S710-E714 WeakPolarHBondContact O-CB 3.44Å; S710-E714 PolarHBondContact O-N 3.03Å; L712-E714 VanDerWaalsContact C-N 3.27Å; L712-E714 PolarHBondContact O-N 3.48Å
715	R	53.8	Low	58	Low	144 Å²	144	91.1 Å²	91.1	54%	0.543	46%	0.455	S	S	.	.	H	α-helix	trans	-86.8	-25.4	178.3	-69	177.9	175.7	-157.8	-2.2	114	L711 L712 V718 C719	L711-R715 VanDerWaalsContact O-CG 3.32Å; L711-R715 WeakPolarHBondContact O-CG 3.33Å; L711-R715 PolarHBondContact O-N 3.38Å; L712-R715 CarbonylContact O-C 3.42Å; L712-R715 PolarHBondContact O-N 3.43Å; R715-V718 PolarHBondContact O-N 2.76Å; R715-C719 WeakPolarHBondContact O-CB 3.32Å; R715-C719 PolarHBondContact O-N 2.75Å; R715-C719 PolarHBondContact O-SG 2.86Å
716	Q	50.9	Low	58.2	Low	54 Å²	54	88.2 Å²	88.2	25%	0.252	44%	0.439	S	S	.	.	H	α-helix	trans	-52.3	-50.9	179.8	-71.7	-105.3	13.5	0	0	114	L712 V718 C719 L720	L712-Q716 WeakPolarHBondContact O-CG 3.42Å; L712-Q716 PolarHBondContact O-N 2.75Å; Q716-V718 PolarHBondContact O-N 3.02Å; Q716-C719 PolarHBondContact O-N 2.75Å; Q716-L720 WeakPolarHBondContact O-CB 3.49Å; Q716-L720 PolarHBondContact O-N 3.36Å
717	P	56.8	Low	58.3	Low	66 Å²	66	85.9 Å²	85.9	43%	0.429	43%	0.427	S	S	.	.	H	α-helix	trans	-65.9	-39.1	-177.6	25.3	-34.3	0	0	0	112.3	N713 L720 L721	N713-P717 WeakPolarHBondContact O-CD 3.49Å; P717-L720 PolarHBondContact O-N 2.83Å; P717-L721 WeakPolarHBondContact O-CB 3.45Å; P717-L721 VanDerWaalsContact O-CG 3.26Å; P717-L721 WeakPolarHBondContact O-CG 3.28Å; P717-L721 PolarHBondContact O-N 3.07Å
718	V	59.8	Low	58.6	Low	99 Å²	99	84.8 Å²	84.8	60%	0.6	42%	0.422	S	S	*	.	H	α-helix	trans	-63.9	-45.5	177.5	-175.7	0	0	0	0	110.5	R715 Q716 L721 F722	R715-V718 PolarHBondContact O-N 2.76Å; Q716-V718 PolarHBondContact O-N 3.02Å; V718-L721 PolarHBondContact O-N 3.04Å; V718-F722 WeakPolarHBondContact O-CB 3.38Å; V718-F722 PolarHBondContact O-N 3.32Å
719	C	55.5	Low	59.2	Low	28 Å²	28	85.1 Å²	85.1	19%	0.189	42%	0.418	C	S	.	.	H	α-helix	trans	-65.3	-41.1	176.1	-70.5	0	0	0	0	112.3	R715 Q716 F722 W723 M781	R715-C719 WeakPolarHBondContact O-CB 3.32Å; R715-C719 PolarHBondContact O-N 2.75Å; R715-C719 PolarHBondContact O-SG 2.86Å; Q716-C719 PolarHBondContact O-N 2.75Å; C719-F722 PolarHBondContact O-N 2.76Å; C719-W723 WeakPolarHBondContact O-CB 3.31Å; C719-W723 PolarHBondContact O-N 2.66Å; C719-M781 HydrophobicContact CB-CE 4.22Å; C719-M781 HydrophobicContact CB-SD 4.37Å; C719-M781 PolarHBondContact SG-SD 3.37Å
720	L	58.2	Low	59.8	Low	59 Å²	59	81.5 Å²	81.5	31%	0.309	40%	0.401	S	S	.	.	H	α-helix	trans	-63.2	-45.1	175	-91	157.5	0	0	0	112.2	Q716 P717 W723 T724 F793	Q716-L720 WeakPolarHBondContact O-CB 3.49Å; Q716-L720 PolarHBondContact O-N 3.36Å; P717-L720 PolarHBondContact O-N 2.83Å; L720-W723 PolarHBondContact O-N 2.97Å; L720-T724 WeakPolarHBondContact O-CB 3.38Å; L720-T724 VanDerWaalsContact O-CG2 3.3Å; L720-T724 WeakPolarHBondContact O-CG2 3.31Å; L720-T724 PolarHBondContact O-N 3.47Å; L720-T724 PolarHBondContact O-OG1 3.33Å; L720-F793 HydrophobicContact CD2-CD2 3.82Å; L720-F793 HydrophobicContact CD2-CE2 4.37Å
721	L	63.5	Low	60.6	Low	107 Å²	107	86 Å²	86	56%	0.56	41%	0.413	S	S	*	.	H	α-helix	trans	-63	-41.4	176.1	-73.7	168.5	0	0	0	111.5	P717 V718 T724 R725	P717-L721 WeakPolarHBondContact O-CB 3.45Å; P717-L721 VanDerWaalsContact O-CG 3.26Å; P717-L721 WeakPolarHBondContact O-CG 3.28Å; P717-L721 PolarHBondContact O-N 3.07Å; V718-L721 PolarHBondContact O-N 3.04Å; L721-T724 WeakPolarHBondContact CA-OG1 3.46Å; L721-T724 PolarHBondContact O-OG1 3.18Å; L721-T724 VanDerWaalsContact O-OG1 3.11Å; L721-R725 WeakPolarHBondContact O-CB 3.43Å; L721-R725 PolarHBondContact O-N 2.9Å
722	F	62.8	Low	61.1	Low	98 Å²	98	89.1 Å²	89.1	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-68.7	-41.4	176.8	-168.6	-94.4	0	0	0	112.2	V718 C719 R725 L726 T773 L777	V718-F722 WeakPolarHBondContact O-CB 3.38Å; V718-F722 PolarHBondContact O-N 3.32Å; C719-F722 PolarHBondContact O-N 2.76Å; F722-R725 PolarHBondContact O-N 3.16Å; F722-L726 HydrophobicContact CD1-CD1 3.75Å; F722-L726 HydrophobicContact CD1-CG 4.41Å; F722-L726 HydrophobicContact CE1-CD1 3.55Å; F722-L726 HydrophobicContact CE1-CG 4.23Å; F722-L726 HydrophobicContact CZ-CD1 4.48Å; F722-L726 WeakPolarHBondContact O-CB 3.36Å; F722-L726 PolarHBondContact O-N 3.09Å; F722-T773 HydrophobicContact CZ-CG2 4.39Å; F722-L777 HydrophobicContact CD1-CD1 3.87Å; F722-L777 HydrophobicContact CD1-CG 4.36Å; F722-L777 HydrophobicContact CE1-CD1 4Å; F722-L777 HydrophobicContact CE1-CG 4.36Å
723	W	56.3	Low	61.6	Low	45 Å²	45	87.8 Å²	87.8	17%	0.17	41%	0.414	C	S	.	.	H	α-helix	trans	-71.7	-35.9	178.6	-137.1	84.6	0	0	0	112.7	C719 L720 K727 Y790 F793	C719-W723 WeakPolarHBondContact O-CB 3.31Å; C719-W723 PolarHBondContact O-N 2.66Å; L720-W723 PolarHBondContact O-N 2.97Å; W723-K727 HydrophobicContact CE3-CG 3.84Å; W723-K727 HydrophobicContact CZ3-CD 4.25Å; W723-K727 VanDerWaalsContact CZ3-CE 3.48Å; W723-K727 HydrophobicContact CZ3-CG 3.91Å; W723-K727 WeakPolarHBondContact O-CB 3.42Å; W723-K727 WeakPolarHBondContact O-CG 3.4Å; W723-K727 PolarHBondContact O-N 3.46Å; W723-Y790 HydrophobicContact CH2-CD2 4.29Å; W723-Y790 AromaticContact CH2-CE2 3.89Å; W723-Y790 HydrophobicContact CH2-CE2 3.89Å; W723-Y790 HydrophobicContact CZ2-CD2 4.24Å; W723-Y790 HydrophobicContact CZ2-CE2 4.11Å; W723-F793 HydrophobicContact CE3-CD1 4.4Å; W723-F793 HydrophobicContact CE3-CE1 4.03Å; W723-F793 HydrophobicContact CE3-CZ 4.36Å; W723-F793 HydrophobicContact CZ3-CD1 4.08Å; W723-F793 AromaticContact CZ3-CE1 3.65Å; W723-F793 HydrophobicContact CZ3-CE1 3.65Å; W723-F793 HydrophobicContact CZ3-CZ 4.34Å
724	T	65.4	Low	62	Low	62 Å²	62	86.9 Å²	86.9	38%	0.38	41%	0.412	S	S	.	.	H	α-helix	trans	-70.6	-37	172.7	51.8	0	0	0	0	111.7	L720 L721 K727 K728	L720-T724 WeakPolarHBondContact O-CB 3.38Å; L720-T724 VanDerWaalsContact O-CG2 3.3Å; L720-T724 WeakPolarHBondContact O-CG2 3.31Å; L720-T724 PolarHBondContact O-N 3.47Å; L720-T724 PolarHBondContact O-OG1 3.33Å; L721-T724 WeakPolarHBondContact CA-OG1 3.46Å; L721-T724 PolarHBondContact O-OG1 3.18Å; L721-T724 VanDerWaalsContact O-OG1 3.11Å; T724-K727 CarbonylContact O-C 3.59Å; T724-K727 PolarHBondContact O-N 2.73Å; T724-K728 WeakPolarHBondContact O-CB 2.82Å; T724-K728 PolarHBondContact O-N 3.11Å
725	R	66.2	Low	62.4	Low	182 Å²	182	84.5 Å²	84.5	69%	0.687	41%	0.407	S	S	*	.	H	α-helix	trans	-64.3	-44	171.4	-165.7	170.1	-173.3	161.9	1.3	111.5	L721 F722 K727 K728 I729	L721-R725 WeakPolarHBondContact O-CB 3.43Å; L721-R725 PolarHBondContact O-N 2.9Å; F722-R725 PolarHBondContact O-N 3.16Å; R725-K727 VanDerWaalsContact C-N 3.35Å; R725-K727 PolarHBondContact O-N 3.38Å; R725-K728 PolarHBondContact O-N 2.89Å; R725-I729 HydrophobicContact CG-CD1 4.39Å; R725-I729 VanDerWaalsContact O-CG1 3.3Å; R725-I729 WeakPolarHBondContact O-CG1 3.28Å; R725-I729 PolarHBondContact O-N 3.05Å
726	L	69.4	Low	62.9	Low	15 Å²	15	84.6 Å²	84.6	8%	0.079	41%	0.408	C	S	.	.	H	α-helix	trans	-57.1	-43.9	169.6	-85.7	169.2	0	0	0	112.2	F722 I729 E730 V770 L777	F722-L726 HydrophobicContact CD1-CD1 3.75Å; F722-L726 HydrophobicContact CD1-CG 4.41Å; F722-L726 HydrophobicContact CE1-CD1 3.55Å; F722-L726 HydrophobicContact CE1-CG 4.23Å; F722-L726 HydrophobicContact CZ-CD1 4.48Å; F722-L726 WeakPolarHBondContact O-CB 3.36Å; F722-L726 PolarHBondContact O-N 3.09Å; L726-I729 PolarHBondContact O-N 2.98Å; L726-E730 PolarHBondContact O-N 3.16Å; L726-V770 HydrophobicContact CD2-CG2 4.3Å; L726-L777 HydrophobicContact CD1-CD1 4.25Å
727	K	66.1	Low	63.2	Low	81 Å²	81	83.9 Å²	83.9	35%	0.352	41%	0.405	S	S	.	.	H	α-helix	trans	-69.3	-31.1	176.5	-79	-75.7	167.8	-162	0	113.5	W723 T724 R725 E730 K731	W723-K727 HydrophobicContact CE3-CG 3.84Å; W723-K727 HydrophobicContact CZ3-CD 4.25Å; W723-K727 VanDerWaalsContact CZ3-CE 3.48Å; W723-K727 HydrophobicContact CZ3-CG 3.91Å; W723-K727 WeakPolarHBondContact O-CB 3.42Å; W723-K727 WeakPolarHBondContact O-CG 3.4Å; W723-K727 PolarHBondContact O-N 3.46Å; T724-K727 CarbonylContact O-C 3.59Å; T724-K727 PolarHBondContact O-N 2.73Å; R725-K727 VanDerWaalsContact C-N 3.35Å; R725-K727 PolarHBondContact O-N 3.38Å; K727-E730 VanDerWaalsContact CD-OE2 3.31Å; K727-E730 WeakPolarHBondContact CD-OE2 3.32Å; K727-E730 VanDerWaalsContact CE-OE2 3.25Å; K727-E730 WeakPolarHBondContact CE-OE2 3.42Å; K727-E730 IonicContact NZ-OE2 2.69Å; K727-E730 PolarHBondContact NZ-OE2 3.47Å; K727-K731 WeakPolarHBondContact O-CB 3.22Å; K727-K731 WeakPolarHBondContact O-CG 3.47Å; K727-K731 PolarHBondContact O-N 2.87Å
728	K	68	Low	63.3	Low	97 Å²	97	88.5 Å²	88.5	42%	0.422	42%	0.415	S	S	.	.	H	α-helix	trans	-68.4	-41.7	171.9	-162.6	168.8	-178.3	176.6	0	109.7	T724 R725 K731 F732	T724-K728 WeakPolarHBondContact O-CB 2.82Å; T724-K728 PolarHBondContact O-N 3.11Å; R725-K728 PolarHBondContact O-N 2.89Å; K728-K731 PolarHBondContact O-N 3.17Å; K728-F732 HydrophobicContact CG-CD2 4.13Å; K728-F732 HydrophobicContact CG-CE2 4.27Å; K728-F732 WeakPolarHBondContact O-CB 3.43Å; K728-F732 WeakPolarHBondContact O-CD2 3.27Å; K728-F732 PolarHBondContact O-N 3.32Å
729	I	68.7	Low	63	Low	73 Å²	73	91.1 Å²	91.1	37%	0.374	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-49	172.7	-67.5	162.1	0	0	0	111.3	R725 L726 K731 F732 Y733	R725-I729 HydrophobicContact CG-CD1 4.39Å; R725-I729 VanDerWaalsContact O-CG1 3.3Å; R725-I729 WeakPolarHBondContact O-CG1 3.28Å; R725-I729 PolarHBondContact O-N 3.05Å; L726-I729 PolarHBondContact O-N 2.98Å; I729-K731 VanDerWaalsContact C-N 3.33Å; I729-K731 PolarHBondContact O-N 3.28Å; I729-F732 PolarHBondContact O-N 3.5Å; I729-Y733 VanDerWaalsContact O-CB 3.28Å; I729-Y733 WeakPolarHBondContact O-CB 3.38Å; I729-Y733 PolarHBondContact O-N 2.87Å
730	E	67.2	Low	63.1	Low	46 Å²	46	91.1 Å²	91.1	22%	0.215	42%	0.419	C	S	.	.	H	α-helix	trans	-58.2	-42.7	175.4	-76.9	-176.1	165.7	0	0	112.3	L726 K727 Y733 V734 V770 K774	L726-E730 PolarHBondContact O-N 3.16Å; K727-E730 VanDerWaalsContact CD-OE2 3.31Å; K727-E730 WeakPolarHBondContact CD-OE2 3.32Å; K727-E730 VanDerWaalsContact CE-OE2 3.25Å; K727-E730 WeakPolarHBondContact CE-OE2 3.42Å; K727-E730 IonicContact NZ-OE2 2.69Å; K727-E730 PolarHBondContact NZ-OE2 3.47Å; E730-Y733 PolarHBondContact O-N 2.7Å; E730-V734 WeakPolarHBondContact O-CG2 3.31Å; E730-V734 PolarHBondContact O-N 2.87Å; E730-V770 HydrophobicContact CG-CG1 4.12Å; E730-V770 WeakPolarHBondContact OE1-CG1 3.48Å; E730-K774 WeakPolarHBondContact OE1-CE 3.5Å; E730-K774 IonicContact OE1-NZ 2.72Å; E730-K774 PolarHBondContact OE1-NZ 3.37Å
731	K	66.6	Low	62.9	Low	156 Å²	156	93.1 Å²	93.1	68%	0.678	43%	0.428	S	S	*	.	H	α-helix	trans	-66.2	-46.5	176.9	-79.2	-175.4	174.2	-170.8	0	112.2	K727 K728 I729 Y733 V734 V735	K727-K731 WeakPolarHBondContact O-CB 3.22Å; K727-K731 WeakPolarHBondContact O-CG 3.47Å; K727-K731 PolarHBondContact O-N 2.87Å; K728-K731 PolarHBondContact O-N 3.17Å; I729-K731 VanDerWaalsContact C-N 3.33Å; I729-K731 PolarHBondContact O-N 3.28Å; K731-Y733 PolarHBondContact O-N 2.97Å; K731-V734 PolarHBondContact O-N 2.74Å; K731-V735 WeakPolarHBondContact O-CG2 3.25Å; K731-V735 PolarHBondContact O-N 3.49Å
732	F	65.6	Low	62.4	Low	144 Å²	144	91.9 Å²	91.9	63%	0.632	43%	0.425	S	S	*	.	H	α-helix	trans	-58.7	-40.1	174.3	-100	-93.5	0	0	0	111.1	K728 I729 V735 Y736	K728-F732 HydrophobicContact CG-CD2 4.13Å; K728-F732 HydrophobicContact CG-CE2 4.27Å; K728-F732 WeakPolarHBondContact O-CB 3.43Å; K728-F732 WeakPolarHBondContact O-CD2 3.27Å; K728-F732 PolarHBondContact O-N 3.32Å; I729-F732 PolarHBondContact O-N 3.5Å; F732-V735 PolarHBondContact O-N 3.24Å; F732-Y736 VanDerWaalsContact O-CB 3.27Å; F732-Y736 WeakPolarHBondContact O-CB 3.26Å; F732-Y736 PolarHBondContact O-N 3.16Å
733	Y	62.9	Low	61.9	Low	36 Å²	36	91 Å²	91	14%	0.141	43%	0.431	C	S	.	.	H	α-helix	trans	-66.7	-42.2	178.1	-170.6	-106.9	0	0	0	112.8	I729 E730 K731 Y736 Q737 D763 L766	I729-Y733 VanDerWaalsContact O-CB 3.28Å; I729-Y733 WeakPolarHBondContact O-CB 3.38Å; I729-Y733 PolarHBondContact O-N 2.87Å; E730-Y733 PolarHBondContact O-N 2.7Å; K731-Y733 PolarHBondContact O-N 2.97Å; Y733-Y736 PolarHBondContact O-N 3.16Å; Y733-Q737 HydrophobicContact CD1-CG 4.11Å; Y733-Q737 HydrophobicContact CE1-CG 3.61Å; Y733-Q737 HydrophobicContact CE2-CG 4.44Å; Y733-Q737 VanDerWaalsContact O-CB 3.26Å; Y733-Q737 WeakPolarHBondContact O-CB 3.43Å; Y733-Q737 WeakPolarHBondContact O-CG 3.45Å; Y733-Q737 PolarHBondContact O-N 2.62Å; Y733-Q737 PolarHBondContact OH-NE2 2.84Å; Y733-D763 WeakPolarHBondContact CE1-OD1 3.38Å; Y733-D763 WeakPolarHBondContact OH-CA 3.45Å; Y733-D763 WeakPolarHBondContact OH-CB 3.43Å; Y733-D763 PolarHBondContact OH-OD1 3.3Å; Y733-L766 HydrophobicContact CD1-CD2 3.98Å; Y733-L766 HydrophobicContact CD2-CD2 3.23Å; Y733-L766 HydrophobicContact CE1-CD2 4.39Å; Y733-L766 HydrophobicContact CE2-CD2 3.72Å; Y733-L766 HydrophobicContact CG-CD2 3.39Å
734	V	63.3	Low	61.7	Low	96 Å²	96	92.2 Å²	92.2	58%	0.582	44%	0.436	S	S	*	.	H	α-helix	trans	-64.8	-38.1	174.1	169.8	0	0	0	0	111.7	E730 K731 Q737 Y738	E730-V734 WeakPolarHBondContact O-CG2 3.31Å; E730-V734 PolarHBondContact O-N 2.87Å; K731-V734 PolarHBondContact O-N 2.74Å; V734-Q737 WeakPolarHBondContact O-CB 3.5Å; V734-Y738 WeakPolarHBondContact O-CB 3.25Å; V734-Y738 PolarHBondContact O-N 3.44Å
735	V	63.8	Low	61	Low	86 Å²	86	99.3 Å²	99.3	52%	0.521	46%	0.457	S	S	.	.	H	α-helix	trans	-70.2	-37.6	175.5	171.7	0	0	0	0	111.7	K731 F732 Y738 K739	K731-V735 WeakPolarHBondContact O-CG2 3.25Å; K731-V735 PolarHBondContact O-N 3.49Å; F732-V735 PolarHBondContact O-N 3.24Å; V735-Y738 PolarHBondContact O-N 2.9Å; V735-K739 PolarHBondContact O-N 3.29Å
736	Y	64.8	Low	60.3	Low	146 Å²	146	97.3 Å²	97.3	57%	0.573	46%	0.46	S	S	*	.	H	α-helix	trans	-65	-49.2	173.9	-173.6	-91.1	0	0	0	110.7	F732 Y733 Y738 K739 S740 F759	F732-Y736 VanDerWaalsContact O-CB 3.27Å; F732-Y736 WeakPolarHBondContact O-CB 3.26Å; F732-Y736 PolarHBondContact O-N 3.16Å; Y733-Y736 PolarHBondContact O-N 3.16Å; Y736-Y738 VanDerWaalsContact C-N 3.31Å; Y736-Y738 PolarHBondContact O-N 3.22Å; Y736-K739 PolarHBondContact O-N 3.08Å; Y736-S740 WeakPolarHBondContact CE1-OG 3.42Å; Y736-S740 WeakPolarHBondContact O-CB 3.29Å; Y736-S740 PolarHBondContact O-N 3.03Å; Y736-S740 PolarHBondContact O-OG 2.93Å; Y736-F759 HydrophobicContact CE1-CE2 4.49Å
737	Q	57.1	Low	59.3	Low	40 Å²	40	102 Å²	102	19%	0.187	49%	0.485	C	S	.	.	H	α-helix	trans	-49.3	-50.2	170.2	-86.8	-85.4	-12.5	0	0	111.6	Y733 V734 S740 M741 F759	Y733-Q737 HydrophobicContact CD1-CG 4.11Å; Y733-Q737 HydrophobicContact CE1-CG 3.61Å; Y733-Q737 HydrophobicContact CE2-CG 4.44Å; Y733-Q737 VanDerWaalsContact O-CB 3.26Å; Y733-Q737 WeakPolarHBondContact O-CB 3.43Å; Y733-Q737 WeakPolarHBondContact O-CG 3.45Å; Y733-Q737 PolarHBondContact O-N 2.62Å; Y733-Q737 PolarHBondContact OH-NE2 2.84Å; V734-Q737 WeakPolarHBondContact O-CB 3.5Å; Q737-S740 PolarHBondContact O-N 3.37Å; Q737-M741 WeakPolarHBondContact O-CB 3.43Å; Q737-M741 PolarHBondContact O-N 3.28Å; Q737-F759 HydrophobicContact CG-CZ 4.17Å; Q737-F759 VanDerWaalsContact OE1-CE1 3.28Å
738	Y	57.4	Low	58.8	Low	162 Å²	162	108.8 Å²	108.8	64%	0.635	51%	0.509	S	S	*	.	H	α-helix	trans	-65.8	-41.9	-179	-149.1	-94.5	0	0	0	112.6	V734 V735 Y736 M741 T742	V734-Y738 WeakPolarHBondContact O-CB 3.25Å; V734-Y738 PolarHBondContact O-N 3.44Å; V735-Y738 PolarHBondContact O-N 2.9Å; Y736-Y738 VanDerWaalsContact C-N 3.31Å; Y736-Y738 PolarHBondContact O-N 3.22Å; Y738-M741 PolarHBondContact O-N 3.37Å; Y738-T742 HydrophobicContact CD1-CG2 4.3Å; Y738-T742 HydrophobicContact CE1-CG2 4.28Å; Y738-T742 PolarHBondContact O-N 3.09Å; Y738-T742 PolarHBondContact O-OG1 3.3Å
739	K	54.7	Low	58.1	Low	154 Å²	154	112.6 Å²	112.6	67%	0.67	53%	0.525	S	S	*	.	H	α-helix	trans	-68.5	-40.9	175.8	-87	-168.6	169.8	-171.8	0	113.3	V735 Y736 M741 T742 S743	V735-K739 PolarHBondContact O-N 3.29Å; Y736-K739 PolarHBondContact O-N 3.08Å; K739-M741 VanDerWaalsContact C-N 3.32Å; K739-T742 PolarHBondContact O-OG1 3.48Å; K739-S743 WeakPolarHBondContact O-CB 3.45Å; K739-S743 PolarHBondContact O-N 3Å
740	S	57.1	Low	57.5	Low	29 Å²	29	116 Å²	116	20%	0.203	54%	0.544	C	S	.	.	H	α-helix	trans	-64.1	-40.5	174.1	-67.4	0	0	0	0	110.8	Y736 Q737 S743 Y744	Y736-S740 WeakPolarHBondContact CE1-OG 3.42Å; Y736-S740 WeakPolarHBondContact O-CB 3.29Å; Y736-S740 PolarHBondContact O-N 3.03Å; Y736-S740 PolarHBondContact O-OG 2.93Å; Q737-S740 PolarHBondContact O-N 3.37Å; S740-S743 PolarHBondContact O-N 3.05Å; S740-Y744 WeakPolarHBondContact O-CB 3.47Å; S740-Y744 PolarHBondContact O-N 3.47Å
741	M	53.8	Low	57	Low	100 Å²	100	120.2 Å²	120.2	49%	0.493	57%	0.568	S	S	.	*	H	α-helix	trans	-72.2	-36.9	-179.9	-164.5	163.1	68.3	0	0	112.6	Q737 Y738 K739 Y744 Y745	Q737-M741 WeakPolarHBondContact O-CB 3.43Å; Q737-M741 PolarHBondContact O-N 3.28Å; Y738-M741 PolarHBondContact O-N 3.37Å; K739-M741 VanDerWaalsContact C-N 3.32Å; M741-Y744 WeakPolarHBondContact O-CB 3.27Å; M741-Y744 PolarHBondContact O-N 2.98Å; M741-Y745 WeakPolarHBondContact O-CD2 3.41Å
742	T	53.5	Low	56.5	Low	81 Å²	81	116 Å²	116	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-68.9	-38	170.3	54	0	0	0	0	112.1	Y738 K739 Y744 Y745	Y738-T742 HydrophobicContact CD1-CG2 4.3Å; Y738-T742 HydrophobicContact CE1-CG2 4.28Å; Y738-T742 PolarHBondContact O-N 3.09Å; Y738-T742 PolarHBondContact O-OG1 3.3Å; K739-T742 PolarHBondContact O-OG1 3.48Å; T742-Y744 PolarHBondContact O-N 3.37Å; T742-Y745 PolarHBondContact O-N 3.29Å
743	S	52.2	Low	56.1	Low	79 Å²	79	117.3 Å²	117.3	55%	0.552	56%	0.557	S	S	*	*	H	α-helix	trans	-64.3	-18.9	172.3	-171.8	0	0	0	0	113.7	K739 S740	K739-S743 WeakPolarHBondContact O-CB 3.45Å; K739-S743 PolarHBondContact O-N 3Å; S740-S743 PolarHBondContact O-N 3.05Å
744	Y	51.1	Low	55.7	Low	71 Å²	71	122 Å²	122	28%	0.278	58%	0.582	S	S	.	*	H	α-helix	trans	-78.7	-22.3	-179.9	-131.6	-94.7	0	0	0	113.4	S740 M741 T742 H752 L755 H756	S740-Y744 WeakPolarHBondContact O-CB 3.47Å; S740-Y744 PolarHBondContact O-N 3.47Å; M741-Y744 WeakPolarHBondContact O-CB 3.27Å; M741-Y744 PolarHBondContact O-N 2.98Å; T742-Y744 PolarHBondContact O-N 3.37Å; Y744-H752 AromaticContact CD1-CE1 3.92Å; Y744-H752 AromaticContact CD1-ND1 3.8Å; Y744-H752 AromaticContact CE1-CE1 3.83Å; Y744-H752 AromaticContact CE1-ND1 3.33Å; Y744-H752 VanDerWaalsContact CE1-ND1 3.33Å; Y744-H752 WeakPolarHBondContact CE1-ND1 3.35Å; Y744-H752 PolarHBondContact OH-O 3.25Å; Y744-L755 HydrophobicContact CE2-CB 4.4Å; Y744-L755 WeakPolarHBondContact OH-CB 3.38Å; Y744-H756 PolarHBondContact OH-N 3.39Å; Y744-H756 VanDerWaalsContact OH-N 3.1Å
745	Y	51.8	Low	55.5	Low	212 Å²	212	122.3 Å²	122.3	83%	0.831	58%	0.579	S	S	*	*	S	Bend	trans	-86.9	-13.2	-177	-86.8	-77.8	0	0	0	114.4	M741 T742	M741-Y745 WeakPolarHBondContact O-CD2 3.41Å; T742-Y745 PolarHBondContact O-N 3.29Å
746	D	52	Low	55.5	Low	140 Å²	140	122.9 Å²	122.9	75%	0.749	58%	0.576	S	S	*	*	S	Bend	trans	-107.4	0.5	-169	-156.2	29.9	0	0	0	113.8
747	N	48.1	Very low	55.3	Low	114 Å²	114	120 Å²	120	61%	0.61	57%	0.57	S	S	*	*	S	Bend	trans	-133.7	160.2	-177.2	-90.6	-76.5	0	0	0	114.8
748	R	55.3	Low	55.5	Low	223 Å²	223	121.4 Å²	121.4	84%	0.842	58%	0.581	S	S	*	*			trans	-74.5	169.1	-154.2	-59	178.5	-170.5	164.5	4.5	114.1	D750 H752	R748-D750 PolarHBondContact O-N 3.16Å; R748-H752 PolarHBondContact O-CD2 3.07Å; R748-H752 VanDerWaalsContact O-CD2 3.29Å; R748-H752 PolarHBondContact O-NE2 3.05Å
749	K	54	Low	56	Low	176 Å²	176	115.8 Å²	115.8	77%	0.765	56%	0.56	S	S	*	*	S	Bend	trans	-84.1	-11.1	-145.1	-70.6	-176.3	174	-179.6	0	117.3	H752	K749-H752 PolarHBondContact O-CD2 3.05Å
750	D	54.8	Low	56.6	Low	146 Å²	146	111.7 Å²	111.7	78%	0.781	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-16.5	-147.8	-51.5	-64.8	0	0	0	115.9	R748	R748-D750 PolarHBondContact O-N 3.16Å
751	D	56.4	Low	57.1	Low	133 Å²	133	114.8 Å²	114.8	71%	0.711	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	16.3	177	-79.7	-57.9	0	0	0	114.5	F753	D751-F753 VanDerWaalsContact C-N 3.3Å; D751-F753 PolarHBondContact O-N 3.29Å; D751-F753 VanDerWaalsContact O-N 3.14Å
752	H	56.5	Low	57.7	Low	69 Å²	69	114.2 Å²	114.2	32%	0.319	56%	0.561	S	S	.	*	H	α-helix	trans	-63.8	-25.8	-165.3	-84	-115	0	0	0	115.6	Y744 R748 K749 H756	Y744-H752 AromaticContact CD1-CE1 3.92Å; Y744-H752 AromaticContact CD1-ND1 3.8Å; Y744-H752 AromaticContact CE1-CE1 3.83Å; Y744-H752 AromaticContact CE1-ND1 3.33Å; Y744-H752 VanDerWaalsContact CE1-ND1 3.33Å; Y744-H752 WeakPolarHBondContact CE1-ND1 3.35Å; Y744-H752 PolarHBondContact OH-O 3.25Å; R748-H752 PolarHBondContact O-CD2 3.07Å; R748-H752 VanDerWaalsContact O-CD2 3.29Å; R748-H752 PolarHBondContact O-NE2 3.05Å; K749-H752 PolarHBondContact O-CD2 3.05Å; H752-H756 VanDerWaalsContact O-CB 3.25Å; H752-H756 WeakPolarHBondContact O-CB 3.45Å; H752-H756 PolarHBondContact O-N 3.45Å
753	F	57.4	Low	58.5	Low	171 Å²	171	111.1 Å²	111.1	75%	0.75	54%	0.541	S	S	*	.	H	α-helix	trans	-80.4	-45.1	-170.1	-150.8	-92.8	0	0	0	113.5	D751 H756 L757	D751-F753 VanDerWaalsContact C-N 3.3Å; D751-F753 PolarHBondContact O-N 3.29Å; D751-F753 VanDerWaalsContact O-N 3.14Å; F753-H756 PolarHBondContact O-N 3.11Å; F753-L757 WeakPolarHBondContact O-CB 3.48Å; F753-L757 PolarHBondContact O-N 2.82Å
754	M	55.6	Low	59.3	Low	135 Å²	135	112.7 Å²	112.7	67%	0.665	54%	0.543	S	S	*	.	H	α-helix	trans	-69.1	-37.3	-179.8	-82.5	-73.2	-81.1	0	0	112.3	L757 T758	M754-L757 PolarHBondContact O-N 2.88Å; M754-T758 WeakPolarHBondContact O-CB 3.4Å; M754-T758 WeakPolarHBondContact O-CG2 3.12Å; M754-T758 PolarHBondContact O-N 2.83Å; M754-T758 PolarHBondContact O-OG1 2.84Å
755	L	58	Low	60	Low	102 Å²	102	113.7 Å²	113.7	53%	0.534	55%	0.554	S	S	.	*	H	α-helix	trans	-67.6	-41	175.1	-68.5	175.1	0	0	0	111.5	Y744 T758 F759	Y744-L755 HydrophobicContact CE2-CB 4.4Å; Y744-L755 WeakPolarHBondContact OH-CB 3.38Å; L755-T758 WeakPolarHBondContact CA-OG1 3.32Å; L755-T758 PolarHBondContact O-OG1 3.07Å; L755-T758 VanDerWaalsContact O-OG1 3.08Å; L755-F759 WeakPolarHBondContact O-CB 3.49Å; L755-F759 PolarHBondContact O-N 3.03Å
756	H	63.6	Low	60.7	Low	97 Å²	97	106.1 Å²	106.1	45%	0.449	53%	0.527	S	S	.	.	H	α-helix	trans	-67.6	-38.4	175.7	-166.2	-101.5	0	0	0	112.2	Y744 H752 F753 F759 L760	Y744-H756 PolarHBondContact OH-N 3.39Å; Y744-H756 VanDerWaalsContact OH-N 3.1Å; H752-H756 VanDerWaalsContact O-CB 3.25Å; H752-H756 WeakPolarHBondContact O-CB 3.45Å; H752-H756 PolarHBondContact O-N 3.45Å; F753-H756 PolarHBondContact O-N 3.11Å; H756-F759 PolarHBondContact O-N 2.93Å; H756-L760 WeakPolarHBondContact O-CB 2.8Å; H756-L760 WeakPolarHBondContact O-CG 3.45Å; H756-L760 PolarHBondContact O-N 3.45Å
757	L	61.2	Low	61.5	Low	85 Å²	85	105.5 Å²	105.5	45%	0.445	52%	0.518	S	S	.	.	H	α-helix	trans	-68.2	-42.2	178.3	-158	79.5	0	0	0	112.2	F753 M754 L760 L761	F753-L757 WeakPolarHBondContact O-CB 3.48Å; F753-L757 PolarHBondContact O-N 2.82Å; M754-L757 PolarHBondContact O-N 2.88Å; L757-L760 PolarHBondContact O-N 3.16Å; L757-L761 PolarHBondContact O-N 2.65Å
758	T	62	Low	62.5	Low	70 Å²	70	105.7 Å²	105.7	43%	0.429	52%	0.518	S	S	.	.	H	α-helix	trans	-68.2	-38.8	175.2	49.1	0	0	0	0	112.1	M754 L755 L761 V762	M754-T758 WeakPolarHBondContact O-CB 3.4Å; M754-T758 WeakPolarHBondContact O-CG2 3.12Å; M754-T758 PolarHBondContact O-N 2.83Å; M754-T758 PolarHBondContact O-OG1 2.84Å; L755-T758 WeakPolarHBondContact CA-OG1 3.32Å; L755-T758 PolarHBondContact O-OG1 3.07Å; L755-T758 VanDerWaalsContact O-OG1 3.08Å; T758-L761 WeakPolarHBondContact O-CB 3.34Å; T758-L761 PolarHBondContact O-N 3.26Å; T758-V762 WeakPolarHBondContact O-CG2 3.18Å; T758-V762 PolarHBondContact O-N 3Å
759	F	66.3	Low	63.1	Low	44 Å²	44	99 Å²	99	19%	0.193	50%	0.502	C	S	.	.	H	α-helix	trans	-61	-44.7	172.8	-173.7	-107.8	0	0	0	112.1	Y736 Q737 L755 H756 V762 D763	Y736-F759 HydrophobicContact CE1-CE2 4.49Å; Q737-F759 HydrophobicContact CG-CZ 4.17Å; Q737-F759 VanDerWaalsContact OE1-CE1 3.28Å; L755-F759 WeakPolarHBondContact O-CB 3.49Å; L755-F759 PolarHBondContact O-N 3.03Å; H756-F759 PolarHBondContact O-N 2.93Å; F759-V762 PolarHBondContact O-N 3.4Å; F759-D763 WeakPolarHBondContact O-CB 3.49Å; F759-D763 PolarHBondContact O-N 2.99Å
760	L	67.9	Low	63.8	Low	68 Å²	68	91.2 Å²	91.2	36%	0.356	47%	0.469	S	S	.	.	H	α-helix	trans	-63.3	-37.5	172.6	-76.4	172.4	0	0	0	112.7	H756 L757 D763 L764	H756-L760 WeakPolarHBondContact O-CB 2.8Å; H756-L760 WeakPolarHBondContact O-CG 3.45Å; H756-L760 PolarHBondContact O-N 3.45Å; L757-L760 PolarHBondContact O-N 3.16Å; L760-D763 PolarHBondContact O-N 3.34Å; L760-L764 WeakPolarHBondContact O-CB 3.44Å; L760-L764 WeakPolarHBondContact O-CG 3.41Å; L760-L764 PolarHBondContact O-N 2.97Å
761	L	66.9	Low	64.5	Low	94 Å²	94	85.8 Å²	85.8	49%	0.492	45%	0.447	S	S	.	.	H	α-helix	trans	-64.2	-43.6	174.6	-112.7	73.1	0	0	0	111.8	L757 T758 N765	L757-L761 PolarHBondContact O-N 2.65Å; T758-L761 WeakPolarHBondContact O-CB 3.34Å; T758-L761 PolarHBondContact O-N 3.26Å; L761-N765 WeakPolarHBondContact O-CB 3.27Å; L761-N765 PolarHBondContact O-N 3.28Å; L761-N765 PolarHBondContact O-ND2 3.45Å
762	V	67.1	Low	64.8	Low	88 Å²	88	85.4 Å²	85.4	53%	0.533	44%	0.441	S	S	.	.	H	α-helix	trans	-65.7	-40.4	176.5	171.7	0	0	0	0	110.9	T758 F759 L766	T758-V762 WeakPolarHBondContact O-CG2 3.18Å; T758-V762 PolarHBondContact O-N 3Å; F759-V762 PolarHBondContact O-N 3.4Å; V762-L766 WeakPolarHBondContact O-CB 3.44Å; V762-L766 PolarHBondContact O-N 3.46Å
763	D	70.4	Confident	65.2	Low	16 Å²	16	83.6 Å²	83.6	9%	0.086	44%	0.435	C	S	.	.	H	α-helix	trans	-61.8	-49.4	175.1	-177.2	43.3	0	0	0	112.5	Y733 F759 L760 L766 K767	Y733-D763 WeakPolarHBondContact CE1-OD1 3.38Å; Y733-D763 WeakPolarHBondContact OH-CA 3.45Å; Y733-D763 WeakPolarHBondContact OH-CB 3.43Å; Y733-D763 PolarHBondContact OH-OD1 3.3Å; F759-D763 WeakPolarHBondContact O-CB 3.49Å; F759-D763 PolarHBondContact O-N 2.99Å; L760-D763 PolarHBondContact O-N 3.34Å; D763-L766 PolarHBondContact O-N 2.85Å; D763-K767 VanDerWaalsContact O-CB 3.25Å; D763-K767 WeakPolarHBondContact O-CB 3.31Å; D763-K767 VanDerWaalsContact O-CG 3.26Å; D763-K767 WeakPolarHBondContact O-CG 3.29Å; D763-K767 PolarHBondContact O-N 3.3Å; D763-K767 WeakPolarHBondContact OD1-CD 3.5Å; D763-K767 WeakPolarHBondContact OD1-CE 3.44Å; D763-K767 IonicContact OD1-NZ 2.65Å; D763-K767 PolarHBondContact OD1-NZ 3.49Å; D763-K767 IonicContact OD2-NZ 2.75Å; D763-K767 PolarHBondContact OD2-NZ 3.01Å
764	L	69.1	Low	65.7	Low	112 Å²	112	78.4 Å²	78.4	59%	0.586	41%	0.412	S	S	*	.	H	α-helix	trans	-61.4	-46.7	176	-77.1	165.7	0	0	0	111.7	L760 K767 L768	L760-L764 WeakPolarHBondContact O-CB 3.44Å; L760-L764 WeakPolarHBondContact O-CG 3.41Å; L760-L764 PolarHBondContact O-N 2.97Å; L764-K767 PolarHBondContact O-N 3Å; L764-L768 WeakPolarHBondContact O-CB 3.37Å; L764-L768 PolarHBondContact O-N 3.46Å
765	N	65.6	Low	66.2	Low	93 Å²	93	75 Å²	75	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-63.7	-43.8	178.5	-83	-75.1	0	0	0	112.2	L761 L768 V769	L761-N765 WeakPolarHBondContact O-CB 3.27Å; L761-N765 PolarHBondContact O-N 3.28Å; L761-N765 PolarHBondContact O-ND2 3.45Å; N765-L768 WeakPolarHBondContact O-CB 3.43Å; N765-L768 PolarHBondContact O-N 3.16Å; N765-V769 WeakPolarHBondContact O-CG2 3.46Å; N765-V769 PolarHBondContact O-N 3.23Å
766	L	67.1	Low	66.6	Low	53 Å²	53	74.4 Å²	74.4	28%	0.277	40%	0.398	S	S	.	.	H	α-helix	trans	-70	-38.5	179.5	-164.6	72.3	0	0	0	111.7	Y733 V762 D763 L768 V769 V770	Y733-L766 HydrophobicContact CD1-CD2 3.98Å; Y733-L766 HydrophobicContact CD2-CD2 3.23Å; Y733-L766 HydrophobicContact CE1-CD2 4.39Å; Y733-L766 HydrophobicContact CE2-CD2 3.72Å; Y733-L766 HydrophobicContact CG-CD2 3.39Å; V762-L766 WeakPolarHBondContact O-CB 3.44Å; V762-L766 PolarHBondContact O-N 3.46Å; D763-L766 PolarHBondContact O-N 2.85Å; L766-L768 VanDerWaalsContact C-N 3.3Å; L766-L768 PolarHBondContact O-N 3.49Å; L766-V769 PolarHBondContact O-N 2.94Å; L766-V770 HydrophobicContact CG-CG2 4.35Å; L766-V770 VanDerWaalsContact O-CB 3.29Å; L766-V770 WeakPolarHBondContact O-CB 3.25Å; L766-V770 VanDerWaalsContact O-CG2 3.29Å; L766-V770 WeakPolarHBondContact O-CG2 3.4Å; L766-V770 PolarHBondContact O-N 2.89Å
767	K	68.3	Low	66.5	Low	126 Å²	126	70.7 Å²	70.7	55%	0.548	38%	0.381	S	S	.	.	H	α-helix	trans	-61	-39	170.6	-77.2	167.5	173.1	160.1	0	111.6	D763 L764 G771	D763-K767 VanDerWaalsContact O-CB 3.25Å; D763-K767 WeakPolarHBondContact O-CB 3.31Å; D763-K767 VanDerWaalsContact O-CG 3.26Å; D763-K767 WeakPolarHBondContact O-CG 3.29Å; D763-K767 PolarHBondContact O-N 3.3Å; D763-K767 WeakPolarHBondContact OD1-CD 3.5Å; D763-K767 WeakPolarHBondContact OD1-CE 3.44Å; D763-K767 IonicContact OD1-NZ 2.65Å; D763-K767 PolarHBondContact OD1-NZ 3.49Å; D763-K767 IonicContact OD2-NZ 2.75Å; D763-K767 PolarHBondContact OD2-NZ 3.01Å; L764-K767 PolarHBondContact O-N 3Å; K767-G771 PolarHBondContact O-N 2.99Å
768	L	68.9	Low	66.5	Low	119 Å²	119	72.7 Å²	72.7	62%	0.623	38%	0.383	S	S	*	.	H	α-helix	trans	-62.7	-51.8	174.7	-157	83.8	0	0	0	110.9	L764 N765 L766 V770 G771 H772	L764-L768 WeakPolarHBondContact O-CB 3.37Å; L764-L768 PolarHBondContact O-N 3.46Å; N765-L768 WeakPolarHBondContact O-CB 3.43Å; N765-L768 PolarHBondContact O-N 3.16Å; L766-L768 VanDerWaalsContact C-N 3.3Å; L766-L768 PolarHBondContact O-N 3.49Å; L768-V770 PolarHBondContact O-N 2.98Å; L768-G771 PolarHBondContact O-N 2.94Å; L768-H772 WeakPolarHBondContact O-CB 3.02Å; L768-H772 PolarHBondContact O-N 3.44Å
769	V	69	Low	66.6	Low	81 Å²	81	75.2 Å²	75.2	49%	0.491	39%	0.393	S	S	.	.	H	α-helix	trans	-63.4	-42.5	-179.7	171.2	0	0	0	0	112.2	N765 L766 G771 H772 T773	N765-V769 WeakPolarHBondContact O-CG2 3.46Å; N765-V769 PolarHBondContact O-N 3.23Å; L766-V769 PolarHBondContact O-N 2.94Å; V769-G771 VanDerWaalsContact C-N 3.32Å; V769-G771 PolarHBondContact O-N 3.43Å; V769-H772 PolarHBondContact O-N 2.73Å; V769-T773 WeakPolarHBondContact O-CB 3.18Å; V769-T773 WeakPolarHBondContact O-CG2 3.13Å; V769-T773 PolarHBondContact O-N 3.33Å; V769-T773 PolarHBondContact O-OG1 3.47Å
770	V	67.4	Low	66	Low	14 Å²	14	79.9 Å²	79.9	9%	0.085	42%	0.416	C	S	.	.	H	α-helix	trans	-69.7	-29.5	176.3	170.8	0	0	0	0	111.6	L726 E730 L766 L768 T773 K774	L726-V770 HydrophobicContact CD2-CG2 4.3Å; E730-V770 HydrophobicContact CG-CG1 4.12Å; E730-V770 WeakPolarHBondContact OE1-CG1 3.48Å; L766-V770 HydrophobicContact CG-CG2 4.35Å; L766-V770 VanDerWaalsContact O-CB 3.29Å; L766-V770 WeakPolarHBondContact O-CB 3.25Å; L766-V770 VanDerWaalsContact O-CG2 3.29Å; L766-V770 WeakPolarHBondContact O-CG2 3.4Å; L766-V770 PolarHBondContact O-N 2.89Å; L768-V770 PolarHBondContact O-N 2.98Å; V770-T773 WeakPolarHBondContact CA-OG1 3.49Å; V770-T773 PolarHBondContact O-OG1 3.37Å; V770-K774 HydrophobicContact CG1-CD 4.49Å; V770-K774 VanDerWaalsContact O-CD 3.26Å; V770-K774 WeakPolarHBondContact O-CD 3.02Å; V770-K774 VanDerWaalsContact O-CG 3.23Å; V770-K774 WeakPolarHBondContact O-CG 3.49Å; V770-K774 PolarHBondContact O-N 3.03Å
771	G	69	Low	65.4	Low	31 Å²	31	78.6 Å²	78.6	32%	0.32	41%	0.408	S	S	.	.	H	α-helix	trans	-68.8	-50.5	168.8	0	0	0	0	0	112	K767 L768 V769 T773 K774 S775	K767-G771 PolarHBondContact O-N 2.99Å; L768-G771 PolarHBondContact O-N 2.94Å; V769-G771 VanDerWaalsContact C-N 3.32Å; V769-G771 PolarHBondContact O-N 3.43Å; G771-T773 PolarHBondContact O-N 2.95Å; G771-K774 WeakPolarHBondContact O-CB 3.32Å; G771-K774 PolarHBondContact O-N 3.46Å; G771-K774 VanDerWaalsContact O-N 3.16Å; G771-S775 PolarHBondContact O-N 3.3Å; G771-S775 PolarHBondContact O-OG 3.48Å
772	H	64.2	Low	64.9	Low	126 Å²	126	75.1 Å²	75.1	58%	0.583	40%	0.395	S	S	*	.	H	α-helix	trans	-63.4	-43.6	-176.7	-133.6	-166.6	0	0	0	111.7	L768 V769 K774 S775 I776	L768-H772 WeakPolarHBondContact O-CB 3.02Å; L768-H772 PolarHBondContact O-N 3.44Å; V769-H772 PolarHBondContact O-N 2.73Å; H772-K774 VanDerWaalsContact C-N 3.3Å; H772-K774 PolarHBondContact O-N 3.37Å; H772-S775 PolarHBondContact O-N 3.05Å; H772-I776 WeakPolarHBondContact O-CB 3.42Å; H772-I776 WeakPolarHBondContact O-CD1 3.41Å; H772-I776 VanDerWaalsContact O-CG1 3.24Å; H772-I776 WeakPolarHBondContact O-CG1 3.5Å; H772-I776 PolarHBondContact O-N 3.41Å
773	T	65.1	Low	64.6	Low	31 Å²	31	74.7 Å²	74.7	19%	0.19	39%	0.394	C	S	.	.	H	α-helix	trans	-62.7	-32.3	175.4	47.9	0	0	0	0	113.3	F722 V769 V770 G771 L777	F722-T773 HydrophobicContact CZ-CG2 4.39Å; V769-T773 WeakPolarHBondContact O-CB 3.18Å; V769-T773 WeakPolarHBondContact O-CG2 3.13Å; V769-T773 PolarHBondContact O-N 3.33Å; V769-T773 PolarHBondContact O-OG1 3.47Å; V770-T773 WeakPolarHBondContact CA-OG1 3.49Å; V770-T773 PolarHBondContact O-OG1 3.37Å; G771-T773 PolarHBondContact O-N 2.95Å; T773-L777 WeakPolarHBondContact O-CB 3.47Å; T773-L777 PolarHBondContact O-N 2.85Å
774	K	67.6	Low	63.7	Low	61 Å²	61	80.5 Å²	80.5	27%	0.265	43%	0.425	S	S	.	.	H	α-helix	trans	-71.2	-41.5	171.5	-70.8	167.3	-169.6	165.9	0	112.3	E730 V770 G771 H772 L777 W778	E730-K774 WeakPolarHBondContact OE1-CE 3.5Å; E730-K774 IonicContact OE1-NZ 2.72Å; E730-K774 PolarHBondContact OE1-NZ 3.37Å; V770-K774 HydrophobicContact CG1-CD 4.49Å; V770-K774 VanDerWaalsContact O-CD 3.26Å; V770-K774 WeakPolarHBondContact O-CD 3.02Å; V770-K774 VanDerWaalsContact O-CG 3.23Å; V770-K774 WeakPolarHBondContact O-CG 3.49Å; V770-K774 PolarHBondContact O-N 3.03Å; G771-K774 WeakPolarHBondContact O-CB 3.32Å; G771-K774 PolarHBondContact O-N 3.46Å; G771-K774 VanDerWaalsContact O-N 3.16Å; H772-K774 VanDerWaalsContact C-N 3.3Å; H772-K774 PolarHBondContact O-N 3.37Å; K774-L777 WeakPolarHBondContact O-CB 3.36Å; K774-L777 PolarHBondContact O-N 2.84Å; K774-W778 WeakPolarHBondContact O-CB 3.34Å; K774-W778 PolarHBondContact O-N 3.49Å
775	S	65.9	Low	63.2	Low	63 Å²	63	77.2 Å²	77.2	44%	0.441	41%	0.412	S	S	.	.	H	α-helix	trans	-63.2	-42.1	174.1	-66.6	0	0	0	0	111.8	G771 H772 W778 L779	G771-S775 PolarHBondContact O-N 3.3Å; G771-S775 PolarHBondContact O-OG 3.48Å; H772-S775 PolarHBondContact O-N 3.05Å; S775-W778 PolarHBondContact O-N 3.04Å; S775-L779 WeakPolarHBondContact O-CB 3.34Å; S775-L779 VanDerWaalsContact O-CG 3.29Å; S775-L779 WeakPolarHBondContact O-CG 3.49Å; S775-L779 PolarHBondContact O-N 3.49Å
776	I	66.3	Low	63	Low	90 Å²	90	75 Å²	75	46%	0.462	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-45.7	175.6	-68.5	161.9	0	0	0	110.4	H772 W778 L779 Q780	H772-I776 WeakPolarHBondContact O-CB 3.42Å; H772-I776 WeakPolarHBondContact O-CD1 3.41Å; H772-I776 VanDerWaalsContact O-CG1 3.24Å; H772-I776 WeakPolarHBondContact O-CG1 3.5Å; H772-I776 PolarHBondContact O-N 3.41Å; I776-W778 VanDerWaalsContact C-N 3.32Å; I776-W778 PolarHBondContact O-N 3.39Å; I776-L779 PolarHBondContact O-N 2.89Å; I776-Q780 WeakPolarHBondContact O-CB 3.37Å; I776-Q780 PolarHBondContact O-N 2.99Å
777	L	61.4	Low	62.8	Low	19 Å²	19	79 Å²	79	10%	0.099	41%	0.412	C	S	.	.	H	α-helix	trans	-57.7	-41.6	172.6	-90.6	166.3	0	0	0	113.5	F722 L726 T773 K774 Q780 M781 Y786	F722-L777 HydrophobicContact CD1-CD1 3.87Å; F722-L777 HydrophobicContact CD1-CG 4.36Å; F722-L777 HydrophobicContact CE1-CD1 4Å; F722-L777 HydrophobicContact CE1-CG 4.36Å; L726-L777 HydrophobicContact CD1-CD1 4.25Å; T773-L777 WeakPolarHBondContact O-CB 3.47Å; T773-L777 PolarHBondContact O-N 2.85Å; K774-L777 WeakPolarHBondContact O-CB 3.36Å; K774-L777 PolarHBondContact O-N 2.84Å; L777-Q780 PolarHBondContact O-N 3.44Å; L777-M781 PolarHBondContact O-N 2.93Å; L777-M781 VanDerWaalsContact O-N 3.11Å; L777-Y786 HydrophobicContact CB-CE2 4.38Å
778	W	61.2	Low	62.6	Low	128 Å²	128	80 Å²	80	49%	0.485	42%	0.416	S	S	.	.	H	α-helix	trans	-67	-42.6	-179.8	-175.6	83.7	0	0	0	111.6	K774 S775 I776 G782 P783 Y786	K774-W778 WeakPolarHBondContact O-CB 3.34Å; K774-W778 PolarHBondContact O-N 3.49Å; S775-W778 PolarHBondContact O-N 3.04Å; I776-W778 VanDerWaalsContact C-N 3.32Å; I776-W778 PolarHBondContact O-N 3.39Å; W778-G782 PolarHBondContact O-N 2.99Å; W778-G782 VanDerWaalsContact O-N 3.07Å; W778-P783 HydrophobicContact CZ2-CB 4.33Å; W778-Y786 HydrophobicContact CB-CD2 4.32Å; W778-Y786 HydrophobicContact CB-CE2 4.44Å; W778-Y786 AromaticContact CD1-CD1 3.7Å; W778-Y786 AromaticContact CD1-CG 3.83Å
779	L	63.8	Low	62.2	Low	123 Å²	123	75.3 Å²	75.3	64%	0.644	40%	0.395	S	S	*	.	H	α-helix	trans	-65.5	-44.1	173.1	-68	167.6	0	0	0	112	S775 I776 M781	S775-L779 WeakPolarHBondContact O-CB 3.34Å; S775-L779 VanDerWaalsContact O-CG 3.29Å; S775-L779 WeakPolarHBondContact O-CG 3.49Å; S775-L779 PolarHBondContact O-N 3.49Å; I776-L779 PolarHBondContact O-N 2.89Å; L779-M781 PolarHBondContact O-N 3.37Å
780	Q	53.4	Low	62.1	Low	142 Å²	142	76.9 Å²	76.9	66%	0.664	39%	0.393	S	S	*	.	H	α-helix	trans	-71.1	-27.5	-174.6	-165.5	68.9	10.5	0	0	113.8	I776 L777	I776-Q780 WeakPolarHBondContact O-CB 3.37Å; I776-Q780 PolarHBondContact O-N 2.99Å; L777-Q780 PolarHBondContact O-N 3.44Å
781	M	56.6	Low	62.1	Low	40 Å²	40	80.8 Å²	80.8	20%	0.197	41%	0.41	C	S	.	.	H	α-helix	trans	-102.6	-18.9	179.5	-67.2	-136.3	-71.3	0	0	114.3	C719 L777 L779 S785 A789	C719-M781 HydrophobicContact CB-CE 4.22Å; C719-M781 HydrophobicContact CB-SD 4.37Å; C719-M781 PolarHBondContact SG-SD 3.37Å; L777-M781 PolarHBondContact O-N 2.93Å; L777-M781 VanDerWaalsContact O-N 3.11Å; L779-M781 PolarHBondContact O-N 3.37Å; M781-S785 WeakPolarHBondContact O-CB 3.48Å; M781-S785 PolarHBondContact O-OG 3.2Å; M781-A789 HydrophobicContact CE-CB 4.37Å
782	G	56.4	Low	61.9	Low	22 Å²	22	83.1 Å²	83.1	23%	0.227	42%	0.415	C	S	.	.			trans	74.4	155.5	-173.1	0	0	0	0	0	113.2	W778 N784 S785 Y786	W778-G782 PolarHBondContact O-N 2.99Å; W778-G782 VanDerWaalsContact O-N 3.07Å; G782-N784 PolarHBondContact O-N 3.17Å; G782-S785 PolarHBondContact O-N 3.37Å; G782-Y786 WeakPolarHBondContact O-CB 3.34Å; G782-Y786 PolarHBondContact O-N 2.96Å
783	P	60.7	Low	61.9	Low	78 Å²	78	79.7 Å²	79.7	51%	0.506	40%	0.398	S	S	.	.	H	α-helix	trans	-62.3	-41.9	-166.1	21.8	-33.2	0	0	0	113.5	W778 F787	W778-P783 HydrophobicContact CZ2-CB 4.33Å; P783-F787 VanDerWaalsContact O-CB 3.23Å; P783-F787 WeakPolarHBondContact O-CB 3.46Å; P783-F787 PolarHBondContact O-N 3.33Å
784	N	50	Low	62	Low	138 Å²	138	85.4 Å²	85.4	74%	0.738	42%	0.416	S	S	*	.	H	α-helix	trans	-68.5	-42.1	-177.9	-70.5	-20.6	0	0	0	112.5	G782 K788	G782-N784 PolarHBondContact O-N 3.17Å; N784-K788 WeakPolarHBondContact O-CB 3.48Å; N784-K788 PolarHBondContact O-N 2.82Å
785	S	58.4	Low	61.7	Low	43 Å²	43	86.9 Å²	86.9	30%	0.301	42%	0.424	S	S	.	.	H	α-helix	trans	-68.1	-44.9	177.6	-35.1	0	0	0	0	110.9	M781 G782 K788 A789	M781-S785 WeakPolarHBondContact O-CB 3.48Å; M781-S785 PolarHBondContact O-OG 3.2Å; G782-S785 PolarHBondContact O-N 3.37Å; S785-K788 PolarHBondContact O-N 2.91Å; S785-A789 WeakPolarHBondContact O-CB 3.24Å; S785-A789 PolarHBondContact O-N 3.4Å
786	Y	62.3	Low	61.9	Low	46 Å²	46	88.1 Å²	88.1	18%	0.18	42%	0.423	C	S	.	.	H	α-helix	trans	-60.2	-46.5	176.5	-176.5	-85.5	0	0	0	111.2	L777 W778 G782 A789 Y790	L777-Y786 HydrophobicContact CB-CE2 4.38Å; W778-Y786 HydrophobicContact CB-CD2 4.32Å; W778-Y786 HydrophobicContact CB-CE2 4.44Å; W778-Y786 AromaticContact CD1-CD1 3.7Å; W778-Y786 AromaticContact CD1-CG 3.83Å; G782-Y786 WeakPolarHBondContact O-CB 3.34Å; G782-Y786 PolarHBondContact O-N 2.96Å; Y786-A789 PolarHBondContact O-N 3.36Å; Y786-Y790 VanDerWaalsContact O-CB 3.23Å; Y786-Y790 WeakPolarHBondContact O-CB 3.29Å; Y786-Y790 PolarHBondContact O-N 3.4Å
787	F	62.2	Low	61.8	Low	139 Å²	139	90.4 Å²	90.4	61%	0.61	43%	0.426	S	S	*	.	H	α-helix	trans	-65.1	-40.7	178.6	-166.8	-94	0	0	0	112.3	P783 Y790 H791	P783-F787 VanDerWaalsContact O-CB 3.23Å; P783-F787 WeakPolarHBondContact O-CB 3.46Å; P783-F787 PolarHBondContact O-N 3.33Å; F787-Y790 PolarHBondContact O-N 3.33Å; F787-H791 WeakPolarHBondContact O-CB 3.33Å; F787-H791 PolarHBondContact O-N 3.41Å
788	K	64	Low	62.1	Low	145 Å²	145	94.1 Å²	94.1	63%	0.63	44%	0.443	S	S	*	.	H	α-helix	trans	-67.1	-41.2	177.7	-165.8	170.7	-175	176.6	0	112.3	N784 S785 H791 L792	N784-K788 WeakPolarHBondContact O-CB 3.48Å; N784-K788 PolarHBondContact O-N 2.82Å; S785-K788 PolarHBondContact O-N 2.91Å; K788-H791 PolarHBondContact O-N 3.42Å; K788-L792 WeakPolarHBondContact O-CG 3.41Å; K788-L792 PolarHBondContact O-N 3.39Å
789	A	62.1	Low	62.4	Low	22 Å²	22	93.6 Å²	93.6	18%	0.182	45%	0.446	C	S	.	.	H	α-helix	trans	-64.8	-43	173.1	0	0	0	0	0	111.9	M781 S785 Y786 H791 L792 F793	M781-A789 HydrophobicContact CE-CB 4.37Å; S785-A789 WeakPolarHBondContact O-CB 3.24Å; S785-A789 PolarHBondContact O-N 3.4Å; Y786-A789 PolarHBondContact O-N 3.36Å; A789-H791 VanDerWaalsContact C-N 3.34Å; A789-H791 PolarHBondContact O-N 3.41Å; A789-L792 PolarHBondContact O-N 2.81Å; A789-F793 WeakPolarHBondContact O-CB 3.46Å; A789-F793 PolarHBondContact O-N 3.01Å
790	Y	65.3	Low	62.3	Low	113 Å²	113	93.8 Å²	93.8	44%	0.443	44%	0.443	S	S	.	.	H	α-helix	trans	-63	-38.2	175.9	-174	-96.9	0	0	0	112.4	W723 Y786 F787 R794	W723-Y790 HydrophobicContact CH2-CD2 4.29Å; W723-Y790 AromaticContact CH2-CE2 3.89Å; W723-Y790 HydrophobicContact CH2-CE2 3.89Å; W723-Y790 HydrophobicContact CZ2-CD2 4.24Å; W723-Y790 HydrophobicContact CZ2-CE2 4.11Å; Y786-Y790 VanDerWaalsContact O-CB 3.23Å; Y786-Y790 WeakPolarHBondContact O-CB 3.29Å; Y786-Y790 PolarHBondContact O-N 3.4Å; F787-Y790 PolarHBondContact O-N 3.33Å; Y790-R794 WeakPolarHBondContact O-CB 3.29Å; Y790-R794 PolarHBondContact O-N 3.13Å
791	H	67.7	Low	63.1	Low	97 Å²	97	90.4 Å²	90.4	45%	0.449	43%	0.427	S	S	.	.	H	α-helix	trans	-67.7	-45.2	175.4	-165.3	-73	0	0	0	112.2	F787 K788 A789 R794 Q795	F787-H791 WeakPolarHBondContact O-CB 3.33Å; F787-H791 PolarHBondContact O-N 3.41Å; K788-H791 PolarHBondContact O-N 3.42Å; A789-H791 VanDerWaalsContact C-N 3.34Å; A789-H791 PolarHBondContact O-N 3.41Å; H791-R794 PolarHBondContact O-N 2.71Å; H791-Q795 WeakPolarHBondContact O-CB 3.42Å; H791-Q795 PolarHBondContact O-N 3.15Å
792	L	66.2	Low	64.1	Low	79 Å²	79	94 Å²	94	41%	0.414	45%	0.447	S	S	.	.	H	α-helix	trans	-60.8	-44	174.8	-78.3	165.1	0	0	0	111.7	K788 A789 R794 Q795 Q796	K788-L792 WeakPolarHBondContact O-CG 3.41Å; K788-L792 PolarHBondContact O-N 3.39Å; A789-L792 PolarHBondContact O-N 2.81Å; L792-R794 PolarHBondContact O-N 2.97Å; L792-Q795 PolarHBondContact O-N 3.11Å; L792-Q796 WeakPolarHBondContact O-CB 3.49Å; L792-Q796 PolarHBondContact O-N 3.15Å
793	F	63.7	Low	64.9	Low	55 Å²	55	98.8 Å²	98.8	24%	0.241	47%	0.467	C	S	.	.	H	α-helix	trans	-63.2	-39.9	174.9	179.7	-102.2	0	0	0	112.4	L720 W723 A789 Q795 Q796 R797	L720-F793 HydrophobicContact CD2-CD2 3.82Å; L720-F793 HydrophobicContact CD2-CE2 4.37Å; W723-F793 HydrophobicContact CE3-CD1 4.4Å; W723-F793 HydrophobicContact CE3-CE1 4.03Å; W723-F793 HydrophobicContact CE3-CZ 4.36Å; W723-F793 HydrophobicContact CZ3-CD1 4.08Å; W723-F793 AromaticContact CZ3-CE1 3.65Å; W723-F793 HydrophobicContact CZ3-CE1 3.65Å; W723-F793 HydrophobicContact CZ3-CZ 4.34Å; A789-F793 WeakPolarHBondContact O-CB 3.46Å; A789-F793 PolarHBondContact O-N 3.01Å; F793-Q795 VanDerWaalsContact C-N 3.34Å; F793-Q795 PolarHBondContact O-N 3.09Å; F793-Q796 PolarHBondContact O-N 3.01Å; F793-R797 WeakPolarHBondContact O-CB 3.23Å; F793-R797 PolarHBondContact O-N 3.29Å
794	R	65.9	Low	65.1	Low	150 Å²	150	100.6 Å²	100.6	57%	0.566	47%	0.47	S	S	*	.	H	α-helix	trans	-61.9	-42.3	174	-172.7	-178.3	-174.2	-172.8	2.4	111.5	Y790 H791 L792 R797 Q798	Y790-R794 WeakPolarHBondContact O-CB 3.29Å; Y790-R794 PolarHBondContact O-N 3.13Å; H791-R794 PolarHBondContact O-N 2.71Å; L792-R794 PolarHBondContact O-N 2.97Å; R794-R797 PolarHBondContact O-N 2.95Å; R794-Q798 WeakPolarHBondContact O-CB 3.31Å; R794-Q798 VanDerWaalsContact O-CG 3.31Å; R794-Q798 WeakPolarHBondContact O-CG 3.4Å; R794-Q798 PolarHBondContact O-N 3.36Å
795	Q	63.3	Low	65.9	Low	92 Å²	92	100.5 Å²	100.5	43%	0.43	46%	0.463	S	S	.	.	H	α-helix	trans	-67	-44.7	178.4	-172.3	173.7	6	0	0	111.9	H791 L792 F793 R797 Q798 Q799	H791-Q795 WeakPolarHBondContact O-CB 3.42Å; H791-Q795 PolarHBondContact O-N 3.15Å; L792-Q795 PolarHBondContact O-N 3.11Å; F793-Q795 VanDerWaalsContact C-N 3.34Å; F793-Q795 PolarHBondContact O-N 3.09Å; Q795-R797 PolarHBondContact O-N 3.29Å; Q795-Q798 WeakPolarHBondContact O-CB 3.3Å; Q795-Q798 PolarHBondContact O-N 3.2Å; Q795-Q799 WeakPolarHBondContact O-CG 3.34Å; Q795-Q799 PolarHBondContact O-N 3.38Å
796	Q	68.6	Low	66.7	Low	90 Å²	90	104 Å²	104	42%	0.421	48%	0.477	S	S	.	.	H	α-helix	trans	-62.4	-41.1	174.8	-170.9	-179.2	34.3	0	0	111.7	L792 F793 Q799 Q800	L792-Q796 WeakPolarHBondContact O-CB 3.49Å; L792-Q796 PolarHBondContact O-N 3.15Å; F793-Q796 PolarHBondContact O-N 3.01Å; Q796-Q799 WeakPolarHBondContact O-CB 3.33Å; Q796-Q799 PolarHBondContact O-N 3.18Å; Q796-Q800 PolarHBondContact O-N 3.11Å
797	R	65.1	Low	67.3	Low	138 Å²	138	106 Å²	106	52%	0.521	49%	0.491	S	S	.	.	H	α-helix	trans	-64.3	-39.8	172.8	179.6	178.6	165.2	-164.9	-9.7	111.9	F793 R794 Q795 Q799 Q800 E801	F793-R797 WeakPolarHBondContact O-CB 3.23Å; F793-R797 PolarHBondContact O-N 3.29Å; R794-R797 PolarHBondContact O-N 2.95Å; Q795-R797 PolarHBondContact O-N 3.29Å; R797-Q799 VanDerWaalsContact C-N 3.32Å; R797-Q799 PolarHBondContact O-N 3.49Å; R797-Q800 PolarHBondContact O-N 3.28Å; R797-E801 HydrophobicContact CG-CG 4.41Å; R797-E801 IonicContact CZ-OE1 2.89Å; R797-E801 IonicContact NE-OE1 3.32Å; R797-E801 PolarHBondContact NE-OE1 3.08Å; R797-E801 IonicContact NH2-OE1 3.45Å; R797-E801 PolarHBondContact NH2-OE1 3.07Å; R797-E801 WeakPolarHBondContact O-CB 3.36Å; R797-E801 WeakPolarHBondContact O-CG 3.33Å; R797-E801 PolarHBondContact O-N 3.28Å
798	Q	67.4	Low	67.9	Low	96 Å²	96	104.8 Å²	104.8	45%	0.449	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-36.9	174.7	-77.3	173.4	-52.8	0	0	111.8	R794 Q795 E801 L802	R794-Q798 WeakPolarHBondContact O-CB 3.31Å; R794-Q798 VanDerWaalsContact O-CG 3.31Å; R794-Q798 WeakPolarHBondContact O-CG 3.4Å; R794-Q798 PolarHBondContact O-N 3.36Å; Q795-Q798 WeakPolarHBondContact O-CB 3.3Å; Q795-Q798 PolarHBondContact O-N 3.2Å; Q798-E801 PolarHBondContact O-N 2.88Å; Q798-L802 WeakPolarHBondContact O-CB 3.26Å; Q798-L802 VanDerWaalsContact O-CG 3.26Å; Q798-L802 WeakPolarHBondContact O-CG 3.19Å; Q798-L802 PolarHBondContact O-N 3.17Å
799	Q	67.8	Low	68.2	Low	118 Å²	118	104.3 Å²	104.3	55%	0.551	49%	0.487	S	S	*	.	H	α-helix	trans	-63.9	-44.4	171.9	-71.7	170.6	-35.1	0	0	111.8	Q795 Q796 R797 L802 L803	Q795-Q799 WeakPolarHBondContact O-CG 3.34Å; Q795-Q799 PolarHBondContact O-N 3.38Å; Q796-Q799 WeakPolarHBondContact O-CB 3.33Å; Q796-Q799 PolarHBondContact O-N 3.18Å; R797-Q799 VanDerWaalsContact C-N 3.32Å; R797-Q799 PolarHBondContact O-N 3.49Å; Q799-L802 PolarHBondContact O-N 3.29Å; Q799-L803 WeakPolarHBondContact O-CB 3.3Å; Q799-L803 PolarHBondContact O-N 3.49Å
800	Q	62.1	Low	68.1	Low	127 Å²	127	108.1 Å²	108.1	59%	0.593	50%	0.501	S	S	*	.	H	α-helix	trans	-63.8	-41	174.9	-72.4	179.2	-15.2	0	0	112.7	Q796 R797 L803 M804	Q796-Q800 PolarHBondContact O-N 3.11Å; R797-Q800 PolarHBondContact O-N 3.28Å; Q800-L803 PolarHBondContact O-N 2.71Å; Q800-M804 VanDerWaalsContact O-CB 3.3Å; Q800-M804 WeakPolarHBondContact O-CB 3.45Å; Q800-M804 PolarHBondContact O-N 3.42Å
801	E	68.9	Low	67.6	Low	70 Å²	70	108.1 Å²	108.1	33%	0.327	51%	0.505	S	S	.	.	H	α-helix	trans	-69.6	-30.4	176.1	-75	179.3	-178.1	0	0	112.7	R797 Q798 K805	R797-E801 HydrophobicContact CG-CG 4.41Å; R797-E801 IonicContact CZ-OE1 2.89Å; R797-E801 IonicContact NE-OE1 3.32Å; R797-E801 PolarHBondContact NE-OE1 3.08Å; R797-E801 IonicContact NH2-OE1 3.45Å; R797-E801 PolarHBondContact NH2-OE1 3.07Å; R797-E801 WeakPolarHBondContact O-CB 3.36Å; R797-E801 WeakPolarHBondContact O-CG 3.33Å; R797-E801 PolarHBondContact O-N 3.28Å; Q798-E801 PolarHBondContact O-N 2.88Å; E801-K805 VanDerWaalsContact O-CB 3.27Å; E801-K805 WeakPolarHBondContact O-CB 3.43Å; E801-K805 WeakPolarHBondContact O-CG 3.41Å; E801-K805 PolarHBondContact O-N 2.9Å
802	L	77.5	Confident	66.6	Low	115 Å²	115	107.4 Å²	107.4	60%	0.602	51%	0.511	S	S	*	.	H	α-helix	trans	-69.5	-44.7	170.7	-78.8	166.9	0	0	0	111.7	Q798 Q799 K805 L806	Q798-L802 WeakPolarHBondContact O-CB 3.26Å; Q798-L802 VanDerWaalsContact O-CG 3.26Å; Q798-L802 WeakPolarHBondContact O-CG 3.19Å; Q798-L802 PolarHBondContact O-N 3.17Å; Q799-L802 PolarHBondContact O-N 3.29Å; L802-K805 PolarHBondContact O-N 2.92Å; L802-L806 WeakPolarHBondContact O-CB 3.47Å; L802-L806 PolarHBondContact O-N 2.84Å
803	L	73.1	Confident	65.6	Low	123 Å²	123	108 Å²	108	64%	0.644	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-41.3	179	-160.4	158.4	0	0	0	111.1	Q799 Q800 L806 L807	Q799-L803 WeakPolarHBondContact O-CB 3.3Å; Q799-L803 PolarHBondContact O-N 3.49Å; Q800-L803 PolarHBondContact O-N 2.71Å; L803-L806 WeakPolarHBondContact O-CB 3.38Å; L803-L806 PolarHBondContact O-N 3.41Å; L803-L807 PolarHBondContact O-N 2.85Å
804	M	64.8	Low	64.8	Low	116 Å²	116	113.6 Å²	113.6	57%	0.571	55%	0.549	S	S	*	.	H	α-helix	trans	-64.6	-37.5	171.7	-169.7	-171.7	76.9	0	0	112.3	Q800 Q808	Q800-M804 VanDerWaalsContact O-CB 3.3Å; Q800-M804 WeakPolarHBondContact O-CB 3.45Å; Q800-M804 PolarHBondContact O-N 3.42Å; M804-Q808 VanDerWaalsContact O-CB 3.31Å; M804-Q808 WeakPolarHBondContact O-CB 3.39Å; M804-Q808 PolarHBondContact O-N 2.88Å
805	K	67.5	Low	63.6	Low	137 Å²	137	114.9 Å²	114.9	60%	0.596	56%	0.561	S	S	*	*	H	α-helix	trans	-67.6	-36.6	173.6	-83.8	176.4	176.3	-177.3	0	112.8	E801 L802 Q808 Q809	E801-K805 VanDerWaalsContact O-CB 3.27Å; E801-K805 WeakPolarHBondContact O-CB 3.43Å; E801-K805 WeakPolarHBondContact O-CG 3.41Å; E801-K805 PolarHBondContact O-N 2.9Å; L802-K805 PolarHBondContact O-N 2.92Å; K805-Q808 PolarHBondContact O-N 3.44Å; K805-Q809 VanDerWaalsContact O-CB 3.24Å; K805-Q809 WeakPolarHBondContact O-CB 3.45Å; K805-Q809 PolarHBondContact O-N 3.46Å
806	L	75.2	Confident	62.8	Low	115 Å²	115	119.8 Å²	119.8	60%	0.602	58%	0.584	S	S	*	*	H	α-helix	trans	-61.6	-49.1	175	-174.5	66	0	0	0	110.2	L802 L803 Q808 Q809 Q810	L802-L806 WeakPolarHBondContact O-CB 3.47Å; L802-L806 PolarHBondContact O-N 2.84Å; L803-L806 WeakPolarHBondContact O-CB 3.38Å; L803-L806 PolarHBondContact O-N 3.41Å; L806-Q808 PolarHBondContact O-N 3.49Å; L806-Q809 PolarHBondContact O-N 3.38Å; L806-Q810 WeakPolarHBondContact O-CB 3.39Å; L806-Q810 PolarHBondContact O-N 3.36Å
807	L	75.4	Confident	61.1	Low	90 Å²	90	118.6 Å²	118.6	47%	0.471	60%	0.596	S	S	.	*	H	α-helix	trans	-60.9	-42.9	175.1	-174.1	65.5	0	0	0	112.3	L803 Q809 Q810 Q811	L803-L807 PolarHBondContact O-N 2.85Å; L807-Q809 VanDerWaalsContact C-N 3.33Å; L807-Q809 PolarHBondContact O-N 3.01Å; L807-Q810 PolarHBondContact O-N 2.78Å; L807-Q811 PolarHBondContact O-N 2.92Å
808	Q	74.3	Confident	59.9	Low	113 Å²	113	118.2 Å²	118.2	53%	0.528	61%	0.611	S	S	.	*	H	α-helix	trans	-64.4	-38	176.5	-168.7	77.3	94	0	0	112.1	M804 K805 L806 Q811 S812	M804-Q808 VanDerWaalsContact O-CB 3.31Å; M804-Q808 WeakPolarHBondContact O-CB 3.39Å; M804-Q808 PolarHBondContact O-N 2.88Å; K805-Q808 PolarHBondContact O-N 3.44Å; L806-Q808 PolarHBondContact O-N 3.49Å; Q808-Q811 PolarHBondContact O-N 3.38Å; Q808-S812 PolarHBondContact O-N 3.39Å
809	Q	70.3	Confident	58.1	Low	134 Å²	134	118.6 Å²	118.6	63%	0.626	63%	0.631	S	S	*	*	H	α-helix	trans	-68.6	-41.8	177.5	-171.3	163.3	27.9	0	0	110.9	K805 L806 L807 Q811 S812 S813	K805-Q809 VanDerWaalsContact O-CB 3.24Å; K805-Q809 WeakPolarHBondContact O-CB 3.45Å; K805-Q809 PolarHBondContact O-N 3.46Å; L806-Q809 PolarHBondContact O-N 3.38Å; L807-Q809 VanDerWaalsContact C-N 3.33Å; L807-Q809 PolarHBondContact O-N 3.01Å; Q809-Q811 VanDerWaalsContact C-N 3.35Å; Q809-Q811 PolarHBondContact O-N 2.87Å; Q809-S812 WeakPolarHBondContact CA-OG 3.23Å; Q809-S812 PolarHBondContact O-N 2.87Å; Q809-S812 VanDerWaalsContact O-N 3.1Å; Q809-S812 PolarHBondContact O-OG 3.16Å; Q809-S813 PolarHBondContact O-N 3.46Å; Q809-S813 VanDerWaalsContact O-N 3.13Å; Q809-S813 PolarHBondContact O-OG 2.79Å
810	Q	59.3	Low	56.4	Low	103 Å²	103	120.2 Å²	120.2	48%	0.481	65%	0.648	S	S	.	*	H	α-helix	trans	-59.5	-42.2	174.5	-164.6	172.7	21.2	0	0	112	L806 L807 S813	L806-Q810 WeakPolarHBondContact O-CB 3.39Å; L806-Q810 PolarHBondContact O-N 3.36Å; L807-Q810 PolarHBondContact O-N 2.78Å; Q810-S813 WeakPolarHBondContact CA-OG 3.23Å; Q810-S813 PolarHBondContact O-N 3.32Å; Q810-S813 PolarHBondContact O-OG 3.5Å
811	Q	55.8	Low	55	Low	113 Å²	113	117.9 Å²	117.9	53%	0.528	66%	0.659	S	S	.	*	H	α-helix	trans	-63.8	-41.1	171.6	-73.5	-178	-16.2	0	0	112.6	L807 Q808 Q809 S813 Q814	L807-Q811 PolarHBondContact O-N 2.92Å; Q808-Q811 PolarHBondContact O-N 3.38Å; Q809-Q811 VanDerWaalsContact C-N 3.35Å; Q809-Q811 PolarHBondContact O-N 2.87Å; Q811-S813 PolarHBondContact O-N 3.19Å; Q811-Q814 PolarHBondContact O-N 3.47Å
812	S	47.2	Very low	53	Low	81 Å²	81	118.3 Å²	118.3	57%	0.566	68%	0.681	S	S	*	*	H	α-helix	trans	-63.5	-29.7	179.9	74	0	0	0	0	113.3	Q808 Q809 Q814	Q808-S812 PolarHBondContact O-N 3.39Å; Q809-S812 WeakPolarHBondContact CA-OG 3.23Å; Q809-S812 PolarHBondContact O-N 2.87Å; Q809-S812 VanDerWaalsContact O-N 3.1Å; Q809-S812 PolarHBondContact O-OG 3.16Å; S812-Q814 VanDerWaalsContact C-N 3.31Å; S812-Q814 PolarHBondContact O-N 3.47Å
813	S	44.6	Very low	50.9	Low	92 Å²	92	119 Å²	119	64%	0.643	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-11.6	174.6	36.1	0	0	0	0	114.9	Q809 Q810 Q811	Q809-S813 PolarHBondContact O-N 3.46Å; Q809-S813 VanDerWaalsContact O-N 3.13Å; Q809-S813 PolarHBondContact O-OG 2.79Å; Q810-S813 WeakPolarHBondContact CA-OG 3.23Å; Q810-S813 PolarHBondContact O-N 3.32Å; Q810-S813 PolarHBondContact O-OG 3.5Å; Q811-S813 PolarHBondContact O-N 3.19Å
814	Q	45.9	Very low	48.6	Very low	172 Å²	172	116.7 Å²	116.7	80%	0.804	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-4.2	-179.4	-153.7	170.6	24	0	0	113.4	Q811 S812	Q811-Q814 PolarHBondContact O-N 3.47Å; S812-Q814 VanDerWaalsContact C-N 3.31Å; S812-Q814 PolarHBondContact O-N 3.47Å
815	Q	42.4	Very low	46.7	Very low	178 Å²	178	123 Å²	123	83%	0.832	72%	0.72	S	S	*	*	S	Bend	trans	-105	34.3	-174.9	-155.4	167.1	92.8	0	0	113.9
816	Q	46.1	Very low	44.8	Very low	195 Å²	195	121.8 Å²	121.8	91%	0.911	73%	0.728	S	S	*	*			trans	-131	87.2	162.1	-70	-166.5	0.3	0	0	110.3
817	G	31.6	Very low	42.6	Very low	64 Å²	64	122 Å²	122	66%	0.66	74%	0.739	S	S	*	*			trans	-139.9	147.1	171.1	0	0	0	0	0	108.9
818	P	40.7	Very low	40.2	Very low	131 Å²	131	123.1 Å²	123.1	85%	0.851	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-84.2	136.1	-148.4	30.6	-36.3	0	0	0	115.3
819	A	30	Very low	38.8	Very low	104 Å²	104	123.3 Å²	123.3	86%	0.86	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-95.9	135.5	156.7	0	0	0	0	0	109.5
820	V	32.3	Very low	36.7	Very low	151 Å²	151	122.2 Å²	122.2	92%	0.915	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-99.6	129.3	-177	174.2	0	0	0	0	110.8
821	G	32.1	Very low	35.3	Very low	79 Å²	79	123 Å²	123	81%	0.814	79%	0.79	S	S	*	*			trans	148.7	112.4	162	0	0	0	0	0	115
822	G	28	Very low	33.9	Very low	78 Å²	78	121.4 Å²	121.4	80%	0.804	80%	0.804	S	S	*	*			trans	136.3	85.8	166.2	0	0	0	0	0	116.7
823	S	31.5	Very low	33.1	Very low	131 Å²	131	125.5 Å²	125.5	92%	0.916	82%	0.818	S	S	*	*			trans	-7.9	135.3	157.5	-47.8	0	0	0	0	120.2
824	G	26.3	Very low	32.5	Very low	74 Å²	74	126 Å²	126	76%	0.763	82%	0.822	S	S	*	*			trans	-174.6	19	174.9	0	0	0	0	0	123.8
825	W	25.3	Very low	31.8	Very low	249 Å²	249	127.7 Å²	127.7	94%	0.943	83%	0.826	S	S	*	*			trans	51	129.9	164.5	-67.8	6	0	0	0	121.8
826	S	26.8	Very low	31.2	Very low	111 Å²	111	124.1 Å²	124.1	78%	0.776	83%	0.827	S	S	*	*			trans	62.7	142.7	151.6	56.3	0	0	0	0	119.9
827	S	27.9	Very low	30.7	Very low	118 Å²	118	118.4 Å²	118.4	83%	0.825	82%	0.82	S	S	*	*			cis	-156.5	159	-4.5	-88.9	0	0	0	0	111.1
828	S	26.4	Very low	31	Very low	115 Å²	115	125.5 Å²	125.5	80%	0.804	83%	0.833	S	S	*	*			trans	-92.1	179.1	168.8	-49.9	0	0	0	0	111.3
829	P	44.2	Very low	30.8	Very low	117 Å²	117	124.9 Å²	124.9	76%	0.76	83%	0.832	S	S	*	*			cis	-126.1	176.3	-3.9	43.2	-27.1	0	0	0	113.7
830	S	25.7	Very low	31	Very low	110 Å²	110	125.8 Å²	125.8	77%	0.769	82%	0.822	S	S	*	*				179.3	158.3	80.6	47.2	0	0	0	0	115.2
831	S	30.7	Very low	31.6	Very low	121 Å²	121	123 Å²	123	85%	0.846	81%	0.805	S	S	*	*			trans	-5.3	132.3	168.7	54.2	0	0	0	0	122.7
832	G	26.3	Very low	32	Very low	79 Å²	79	126.6 Å²	126.6	81%	0.814	80%	0.803	S	S	*	*			trans	-172	144	158.8	0	0	0	0	0	111.8
833	L	30.2	Very low	32.8	Very low	167 Å²	167	128.8 Å²	128.8	87%	0.874	80%	0.795	S	S	*	*			trans	-108.9	146.8	-165.5	-132.6	76.4	0	0	0	115.5
834	S	32.1	Very low	33.6	Very low	102 Å²	102	126.7 Å²	126.7	71%	0.713	77%	0.771	S	S	*	*			trans	69.4	110.7	156.6	72.4	0	0	0	0	120.5
835	K	30.9	Very low	34.6	Very low	208 Å²	208	129.5 Å²	129.5	90%	0.904	77%	0.766	S	S	*	*				-172	124.3	102.3	-101.7	171.8	-179.1	174.1	0	111.3
836	A	30.7	Very low	35.7	Very low	102 Å²	102	124.2 Å²	124.2	84%	0.843	75%	0.751	S	S	*	*			trans	-82.2	144.3	167.9	0	0	0	0	0	110.1
837	G	35.3	Very low	36.8	Very low	75 Å²	75	124.3 Å²	124.3	77%	0.773	74%	0.74	S	S	*	*			trans	-79	173.6	173.9	0	0	0	0	0	112.9
838	K	38.4	Very low	37.6	Very low	214 Å²	214	121.1 Å²	121.1	93%	0.93	72%	0.721	S	S	*	*			trans	-128.8	133.6	158.8	-71.2	-170.4	175.1	-173.5	0	108.1
839	S	35.8	Very low	38.6	Very low	117 Å²	117	122 Å²	122	82%	0.818	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-70.2	144.4	177.8	31.6	0	0	0	0	111.3
840	L	34.8	Very low	38.9	Very low	124 Å²	124	124 Å²	124	65%	0.649	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-80.7	153.7	168.3	-163.9	49.8	0	0	0	109.1	E844	L840-E844 VanDerWaalsContact CD2-OE1 3.32Å; L840-E844 WeakPolarHBondContact CD2-OE1 3.4Å; L840-E844 VanDerWaalsContact CD2-OE2 3.24Å; L840-E844 WeakPolarHBondContact CD2-OE2 3.3Å; L840-E844 VanDerWaalsContact CG-OE2 3.27Å; L840-E844 WeakPolarHBondContact CG-OE2 3.09Å
841	T	44.2	Very low	40.3	Very low	91 Å²	91	123.4 Å²	123.4	56%	0.558	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-90.7	155.2	-154.3	50.1	0	0	0	0	114.5	L843 E844	T841-L843 PolarHBondContact O-N 2.98Å; T841-L843 VanDerWaalsContact O-N 3.08Å; T841-E844 WeakPolarHBondContact O-CB 3.41Å; T841-E844 PolarHBondContact O-N 3.4Å
842	M	39.6	Very low	41.1	Very low	156 Å²	156	122.8 Å²	122.8	77%	0.768	68%	0.678	S	S	*	*	H	α-helix	trans	-53.5	-29.1	178.2	-175.5	177.8	-70.9	0	0	113.7	E844 M845 Q846	M842-E844 VanDerWaalsContact C-N 3.26Å; M842-E844 PolarHBondContact O-N 2.6Å; M842-M845 PolarHBondContact O-N 2.76Å; M842-Q846 PolarHBondContact O-N 3.19Å; M842-Q846 VanDerWaalsContact O-N 3.17Å
843	L	45.6	Very low	42.3	Very low	124 Å²	124	122.5 Å²	122.5	65%	0.649	66%	0.664	S	S	*	*	H	α-helix	trans	-55.8	-40.1	176	-155.3	85.1	0	0	0	112.1	T841 M845 Q846 E847	T841-L843 PolarHBondContact O-N 2.98Å; T841-L843 VanDerWaalsContact O-N 3.08Å; L843-M845 VanDerWaalsContact C-N 3.32Å; L843-M845 PolarHBondContact O-N 3.02Å; L843-Q846 PolarHBondContact O-N 2.7Å; L843-E847 WeakPolarHBondContact O-CB 3.17Å; L843-E847 PolarHBondContact O-N 2.86Å
844	E	49.4	Very low	43.3	Very low	86 Å²	86	118.5 Å²	118.5	40%	0.402	64%	0.641	S	S	.	*	H	α-helix	trans	-72.2	-27.5	-177.2	-162.3	171.9	128.8	0	0	112	L840 T841 M842 A848	L840-E844 VanDerWaalsContact CD2-OE1 3.32Å; L840-E844 WeakPolarHBondContact CD2-OE1 3.4Å; L840-E844 VanDerWaalsContact CD2-OE2 3.24Å; L840-E844 WeakPolarHBondContact CD2-OE2 3.3Å; L840-E844 VanDerWaalsContact CG-OE2 3.27Å; L840-E844 WeakPolarHBondContact CG-OE2 3.09Å; T841-E844 WeakPolarHBondContact O-CB 3.41Å; T841-E844 PolarHBondContact O-N 3.4Å; M842-E844 VanDerWaalsContact C-N 3.26Å; M842-E844 PolarHBondContact O-N 2.6Å; E844-A848 WeakPolarHBondContact O-CB 3.48Å; E844-A848 PolarHBondContact O-N 3.04Å
845	M	46.9	Very low	43.8	Very low	133 Å²	133	120.8 Å²	120.8	66%	0.655	64%	0.638	S	S	*	*	H	α-helix	trans	-74.7	-39.2	172.8	-167.9	167.7	73.2	0	0	111.6	M842 L843 A848 E849	M842-M845 PolarHBondContact O-N 2.76Å; L843-M845 VanDerWaalsContact C-N 3.32Å; L843-M845 PolarHBondContact O-N 3.02Å; M845-A848 PolarHBondContact O-N 3.35Å; M845-E849 PolarHBondContact O-N 2.77Å
846	Q	46.8	Very low	44.9	Very low	138 Å²	138	115.9 Å²	115.9	65%	0.645	62%	0.621	S	S	*	*	H	α-helix	trans	-71	-34.9	175.3	-166.4	171.8	20.2	0	0	112	M842 L843 R850	M842-Q846 PolarHBondContact O-N 3.19Å; M842-Q846 VanDerWaalsContact O-N 3.17Å; L843-Q846 PolarHBondContact O-N 2.7Å; Q846-R850 WeakPolarHBondContact O-CB 3.49Å; Q846-R850 PolarHBondContact O-N 2.83Å
847	E	50.4	Low	46.1	Very low	113 Å²	113	116.5 Å²	116.5	53%	0.528	61%	0.609	S	S	.	*	H	α-helix	trans	-67.5	-39.9	171	-173.2	164.8	-153	0	0	111.3	L843 R850 I851	L843-E847 WeakPolarHBondContact O-CB 3.17Å; L843-E847 PolarHBondContact O-N 2.86Å; E847-R850 PolarHBondContact O-N 3.23Å; E847-I851 HydrophobicContact CG-CD1 3.92Å; E847-I851 WeakPolarHBondContact O-CB 3.31Å; E847-I851 VanDerWaalsContact O-CG1 3.25Å; E847-I851 WeakPolarHBondContact O-CG1 3.31Å; E847-I851 PolarHBondContact O-N 3.1Å
848	A	45.8	Very low	46.5	Very low	52 Å²	52	116.7 Å²	116.7	43%	0.43	59%	0.592	S	S	.	*	H	α-helix	trans	-61.6	-45.8	172.2	0	0	0	0	0	112.4	E844 M845 R850 I851 L852	E844-A848 WeakPolarHBondContact O-CB 3.48Å; E844-A848 PolarHBondContact O-N 3.04Å; M845-A848 PolarHBondContact O-N 3.35Å; A848-R850 PolarHBondContact O-N 3.34Å; A848-I851 PolarHBondContact O-N 2.92Å; A848-L852 VanDerWaalsContact O-CB 3.32Å; A848-L852 WeakPolarHBondContact O-CB 3.42Å; A848-L852 PolarHBondContact O-N 3.47Å
849	E	46.5	Very low	46.7	Very low	134 Å²	134	108.5 Å²	108.5	63%	0.626	57%	0.565	S	S	*	*	H	α-helix	trans	-64.8	-36.8	174.6	-75.8	-157.8	139.7	0	0	112.5	M845 L852 S853	M845-E849 PolarHBondContact O-N 2.77Å; E849-L852 PolarHBondContact O-N 3.33Å; E849-S853 WeakPolarHBondContact O-CB 3.26Å; E849-S853 PolarHBondContact O-N 3.35Å; E849-S853 PolarHBondContact O-OG 2.81Å
850	R	50.9	Low	47.1	Very low	158 Å²	158	112.3 Å²	112.3	60%	0.596	56%	0.561	S	S	*	*	H	α-helix	trans	-62.8	-45.8	173.2	-172.1	-153.2	148.3	116.3	2.9	111	Q846 E847 A848 S853 E854	Q846-R850 WeakPolarHBondContact O-CB 3.49Å; Q846-R850 PolarHBondContact O-N 2.83Å; E847-R850 PolarHBondContact O-N 3.23Å; A848-R850 PolarHBondContact O-N 3.34Å; R850-S853 WeakPolarHBondContact O-CB 3.48Å; R850-S853 PolarHBondContact O-N 2.84Å; R850-E854 IonicContact CZ-OE2 2.72Å; R850-E854 IonicContact NE-OE2 2.8Å; R850-E854 PolarHBondContact NE-OE2 2.94Å; R850-E854 IonicContact NH2-OE2 2.65Å; R850-E854 PolarHBondContact NH2-OE2 3.45Å; R850-E854 PolarHBondContact O-N 3.46Å
851	I	54	Low	47.5	Very low	98 Å²	98	109.4 Å²	109.4	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-65.4	-40.8	178.2	-70.6	166.1	0	0	0	110.8	E847 A848 S853 E854 F855	E847-I851 HydrophobicContact CG-CD1 3.92Å; E847-I851 WeakPolarHBondContact O-CB 3.31Å; E847-I851 VanDerWaalsContact O-CG1 3.25Å; E847-I851 WeakPolarHBondContact O-CG1 3.31Å; E847-I851 PolarHBondContact O-N 3.1Å; A848-I851 PolarHBondContact O-N 2.92Å; I851-S853 VanDerWaalsContact C-N 3.34Å; I851-E854 PolarHBondContact O-N 3.35Å; I851-F855 WeakPolarHBondContact O-CB 3.3Å; I851-F855 PolarHBondContact O-N 3.2Å
852	L	49.1	Very low	47.1	Very low	107 Å²	107	112.2 Å²	112.2	56%	0.56	55%	0.546	S	S	*	.	H	α-helix	trans	-67	-37.1	176.5	-146.3	165.3	0	0	0	110.8	A848 E849 F855 L856	A848-L852 VanDerWaalsContact O-CB 3.32Å; A848-L852 WeakPolarHBondContact O-CB 3.42Å; A848-L852 PolarHBondContact O-N 3.47Å; E849-L852 PolarHBondContact O-N 3.33Å; L852-F855 PolarHBondContact O-N 3.46Å; L852-L856 HydrophobicContact CD2-CD1 3.55Å; L852-L856 HydrophobicContact CD2-CG 3.95Å; L852-L856 WeakPolarHBondContact O-CB 3.48Å; L852-L856 WeakPolarHBondContact O-CG 3.33Å; L852-L856 PolarHBondContact O-N 2.96Å
853	S	50.6	Low	47	Very low	73 Å²	73	109.2 Å²	109.2	51%	0.51	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-45.7	172.5	-61.7	0	0	0	0	112.3	E849 R850 I851 F855 L856 L857	E849-S853 WeakPolarHBondContact O-CB 3.26Å; E849-S853 PolarHBondContact O-N 3.35Å; E849-S853 PolarHBondContact O-OG 2.81Å; R850-S853 WeakPolarHBondContact O-CB 3.48Å; R850-S853 PolarHBondContact O-N 2.84Å; I851-S853 VanDerWaalsContact C-N 3.34Å; S853-F855 VanDerWaalsContact C-N 3.32Å; S853-F855 PolarHBondContact O-N 3.45Å; S853-L856 PolarHBondContact O-N 2.87Å; S853-L857 VanDerWaalsContact O-CB 3.23Å; S853-L857 WeakPolarHBondContact O-CB 3.44Å; S853-L857 PolarHBondContact O-N 3.32Å
854	E	50.7	Low	47	Very low	83 Å²	83	107 Å²	107	39%	0.388	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-39.5	173	-80.5	-166.3	70.5	0	0	111.6	R850 I851 L857 L858	R850-E854 IonicContact CZ-OE2 2.72Å; R850-E854 IonicContact NE-OE2 2.8Å; R850-E854 PolarHBondContact NE-OE2 2.94Å; R850-E854 IonicContact NH2-OE2 2.65Å; R850-E854 PolarHBondContact NH2-OE2 3.45Å; R850-E854 PolarHBondContact O-N 3.46Å; I851-E854 PolarHBondContact O-N 3.35Å; E854-L857 PolarHBondContact O-N 3.1Å; E854-L858 VanDerWaalsContact O-CB 3.3Å; E854-L858 WeakPolarHBondContact O-CB 3.3Å; E854-L858 PolarHBondContact O-N 2.96Å
855	F	43.1	Very low	46.8	Very low	151 Å²	151	108.3 Å²	108.3	66%	0.662	54%	0.538	S	S	*	.	H	α-helix	trans	-68.9	-37.9	178	-155.5	-89.3	0	0	0	112.2	I851 L852 S853 A859	I851-F855 WeakPolarHBondContact O-CB 3.3Å; I851-F855 PolarHBondContact O-N 3.2Å; L852-F855 PolarHBondContact O-N 3.46Å; S853-F855 VanDerWaalsContact C-N 3.32Å; S853-F855 PolarHBondContact O-N 3.45Å; F855-A859 VanDerWaalsContact O-CB 3.25Å; F855-A859 WeakPolarHBondContact O-CB 3.29Å; F855-A859 PolarHBondContact O-N 3.4Å
856	L	54.2	Low	46.4	Very low	104 Å²	104	104.1 Å²	104.1	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-69.3	-33.6	172.3	-78	170.2	0	0	0	112.5	L852 S853 A859 R860	L852-L856 HydrophobicContact CD2-CD1 3.55Å; L852-L856 HydrophobicContact CD2-CG 3.95Å; L852-L856 WeakPolarHBondContact O-CB 3.48Å; L852-L856 WeakPolarHBondContact O-CG 3.33Å; L852-L856 PolarHBondContact O-N 2.96Å; S853-L856 PolarHBondContact O-N 2.87Å; L856-A859 PolarHBondContact O-N 3.06Å; L856-R860 WeakPolarHBondContact O-CB 3.41Å; L856-R860 PolarHBondContact O-N 3.26Å
857	L	55.1	Low	45.9	Very low	115 Å²	115	102.6 Å²	102.6	60%	0.602	53%	0.525	S	S	*	.	H	α-helix	trans	-73.5	-41.7	176.7	-164.9	151	0	0	0	110.9	S853 E854 A859 R860 M861	S853-L857 VanDerWaalsContact O-CB 3.23Å; S853-L857 WeakPolarHBondContact O-CB 3.44Å; S853-L857 PolarHBondContact O-N 3.32Å; E854-L857 PolarHBondContact O-N 3.1Å; L857-A859 VanDerWaalsContact C-N 3.34Å; L857-R860 PolarHBondContact O-N 3.16Å; L857-M861 VanDerWaalsContact O-CB 3.26Å; L857-M861 WeakPolarHBondContact O-CB 3.36Å; L857-M861 PolarHBondContact O-N 3.22Å
858	L	44	Very low	45.2	Very low	79 Å²	79	107 Å²	107	41%	0.414	54%	0.536	S	S	.	.	H	α-helix	trans	-59.7	-41.5	168	-87.1	157.4	0	0	0	111.9	E854 M861 W862	E854-L858 VanDerWaalsContact O-CB 3.3Å; E854-L858 WeakPolarHBondContact O-CB 3.3Å; E854-L858 PolarHBondContact O-N 2.96Å; L858-M861 HydrophobicContact CD2-CE 3.78Å; L858-M861 PolarHBondContact O-N 2.79Å; L858-W862 WeakPolarHBondContact O-CB 3.43Å; L858-W862 PolarHBondContact O-N 3.43Å
859	A	44.2	Very low	45	Very low	43 Å²	43	110.5 Å²	110.5	36%	0.355	55%	0.553	S	S	.	*	H	α-helix	trans	-67	-47.9	176.4	0	0	0	0	0	112.2	F855 L856 L857 M861 W862 D863	F855-A859 VanDerWaalsContact O-CB 3.25Å; F855-A859 WeakPolarHBondContact O-CB 3.29Å; F855-A859 PolarHBondContact O-N 3.4Å; L856-A859 PolarHBondContact O-N 3.06Å; L857-A859 VanDerWaalsContact C-N 3.34Å; A859-M861 VanDerWaalsContact C-N 3.26Å; A859-M861 PolarHBondContact O-N 2.89Å; A859-W862 WeakPolarHBondContact O-CB 3.4Å; A859-W862 PolarHBondContact O-N 3.26Å; A859-W862 VanDerWaalsContact O-N 3.1Å; A859-D863 PolarHBondContact O-N 3.32Å
860	R	44.2	Very low	44.3	Very low	197 Å²	197	112.4 Å²	112.4	74%	0.743	56%	0.561	S	S	*	*	H	α-helix	trans	-55.1	-43.4	172.4	-100.2	-177	163.1	173.3	-4.3	111.4	L856 L857 D863 V864	L856-R860 WeakPolarHBondContact O-CB 3.41Å; L856-R860 PolarHBondContact O-N 3.26Å; L857-R860 PolarHBondContact O-N 3.16Å; R860-D863 PolarHBondContact O-N 3.4Å; R860-V864 WeakPolarHBondContact O-CB 3.41Å; R860-V864 VanDerWaalsContact O-CG2 3.31Å; R860-V864 WeakPolarHBondContact O-CG2 3.29Å; R860-V864 PolarHBondContact O-N 2.84Å
861	M	41.5	Very low	43.4	Very low	62 Å²	62	109.6 Å²	109.6	31%	0.305	56%	0.562	S	S	.	*	H	α-helix	trans	-66.2	-38.2	177.5	-176	175.3	65.5	0	0	112.2	L857 L858 A859 D863 V864 V865 F1074	L857-M861 VanDerWaalsContact O-CB 3.26Å; L857-M861 WeakPolarHBondContact O-CB 3.36Å; L857-M861 PolarHBondContact O-N 3.22Å; L858-M861 HydrophobicContact CD2-CE 3.78Å; L858-M861 PolarHBondContact O-N 2.79Å; A859-M861 VanDerWaalsContact C-N 3.26Å; A859-M861 PolarHBondContact O-N 2.89Å; M861-D863 VanDerWaalsContact C-N 3.32Å; M861-D863 PolarHBondContact O-N 3.45Å; M861-V864 PolarHBondContact O-N 2.88Å; M861-V865 HydrophobicContact CG-CG2 4.46Å; M861-V865 WeakPolarHBondContact O-CB 3.34Å; M861-V865 VanDerWaalsContact O-CG2 3.31Å; M861-V865 WeakPolarHBondContact O-CG2 3.29Å; M861-V865 PolarHBondContact O-N 2.93Å; M861-F1074 HydrophobicContact CE-CE1 3.98Å; M861-F1074 HydrophobicContact CE-CZ 3.7Å; M861-F1074 HydrophobicContact SD-CE1 3.3Å; M861-F1074 WeakPolarHBondContact SD-CE1 3.49Å; M861-F1074 HydrophobicContact SD-CZ 3.42Å; M861-F1074 WeakPolarHBondContact SD-CZ 3.45Å
862	W	35.6	Very low	42.2	Very low	150 Å²	150	112.4 Å²	112.4	57%	0.568	58%	0.578	S	S	*	*	H	α-helix	trans	-63.5	-37.4	174.5	-134.9	91.6	0	0	0	112.1	L858 A859 G866	L858-W862 WeakPolarHBondContact O-CB 3.43Å; L858-W862 PolarHBondContact O-N 3.43Å; A859-W862 WeakPolarHBondContact O-CB 3.4Å; A859-W862 PolarHBondContact O-N 3.26Å; A859-W862 VanDerWaalsContact O-N 3.1Å; W862-G866 PolarHBondContact O-N 3.48Å
863	D	38.6	Very low	41.4	Very low	94 Å²	94	111.6 Å²	111.6	50%	0.503	59%	0.586	S	S	.	*	H	α-helix	trans	-74.9	-35.2	174.2	-80.8	-5.3	0	0	0	112.7	A859 R860 M861 G866 N867	A859-D863 PolarHBondContact O-N 3.32Å; R860-D863 PolarHBondContact O-N 3.4Å; M861-D863 VanDerWaalsContact C-N 3.32Å; M861-D863 PolarHBondContact O-N 3.45Å; D863-G866 PolarHBondContact O-N 2.85Å; D863-N867 VanDerWaalsContact O-CB 3.31Å; D863-N867 WeakPolarHBondContact O-CB 3.33Å; D863-N867 PolarHBondContact O-N 3.49Å; D863-N867 PolarHBondContact O-ND2 3.32Å
864	V	45.6	Very low	40.6	Very low	77 Å²	77	113.4 Å²	113.4	47%	0.467	60%	0.599	S	S	.	*	H	α-helix	trans	-66.1	-40.9	173.5	167.4	0	0	0	0	111.3	R860 M861 G866 R868	R860-V864 WeakPolarHBondContact O-CB 3.41Å; R860-V864 VanDerWaalsContact O-CG2 3.31Å; R860-V864 WeakPolarHBondContact O-CG2 3.29Å; R860-V864 PolarHBondContact O-N 2.84Å; M861-V864 PolarHBondContact O-N 2.88Å; V864-G866 VanDerWaalsContact C-N 3.3Å; V864-R868 HydrophobicContact CG1-CG 4.44Å; V864-R868 WeakPolarHBondContact O-CB 3.43Å; V864-R868 WeakPolarHBondContact O-CG 3.26Å; V864-R868 PolarHBondContact O-N 3.24Å
865	V	44.2	Very low	39.6	Very low	114 Å²	114	115.3 Å²	115.3	69%	0.691	62%	0.621	S	S	*	*	H	α-helix	trans	-69.9	-28.6	173	173.2	0	0	0	0	111.4	M861	M861-V865 HydrophobicContact CG-CG2 4.46Å; M861-V865 WeakPolarHBondContact O-CB 3.34Å; M861-V865 VanDerWaalsContact O-CG2 3.31Å; M861-V865 WeakPolarHBondContact O-CG2 3.29Å; M861-V865 PolarHBondContact O-N 2.93Å
866	G	38.5	Very low	38.8	Very low	44 Å²	44	116.5 Å²	116.5	45%	0.454	63%	0.633	S	S	.	*	H	α-helix	trans	-72	-42.1	173.1	0	0	0	0	0	114.3	W862 D863 V864	W862-G866 PolarHBondContact O-N 3.48Å; D863-G866 PolarHBondContact O-N 2.85Å; V864-G866 VanDerWaalsContact C-N 3.3Å
867	N	36.9	Very low	37.9	Very low	106 Å²	106	118.5 Å²	118.5	57%	0.567	64%	0.642	S	S	*	*	H	α-helix	trans	-96.8	-8	-168.7	-69	-30.1	0	0	0	115.1	D863 T869 H870	D863-N867 VanDerWaalsContact O-CB 3.31Å; D863-N867 WeakPolarHBondContact O-CB 3.33Å; D863-N867 PolarHBondContact O-N 3.49Å; D863-N867 PolarHBondContact O-ND2 3.32Å; N867-T869 PolarHBondContact O-N 3.25Å; N867-H870 PolarHBondContact O-N 3.5Å
868	R	35.5	Very low	36.6	Very low	206 Å²	206	122.9 Å²	122.9	78%	0.777	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	24.4	177.4	-97.4	-174.9	174	-147	-1.7	115.6	V864	V864-R868 HydrophobicContact CG1-CG 4.44Å; V864-R868 WeakPolarHBondContact O-CB 3.43Å; V864-R868 WeakPolarHBondContact O-CG 3.26Å; V864-R868 PolarHBondContact O-N 3.24Å
869	T	41	Very low	35.8	Very low	126 Å²	126	124.2 Å²	124.2	77%	0.773	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127	5.4	178.7	54.9	0	0	0	0	113.8	N867	N867-T869 PolarHBondContact O-N 3.25Å
870	H	32.5	Very low	35	Very low	173 Å²	173	127.2 Å²	127.2	80%	0.801	70%	0.698	S	S	*	*	S	Bend	trans	-144.1	23	-170.1	-152.8	-73.9	0	0	0	116.4	N867	N867-H870 PolarHBondContact O-N 3.5Å
871	T	32.8	Very low	34.2	Very low	99 Å²	99	126.7 Å²	126.7	61%	0.607	70%	0.704	S	S	*	*	S	Bend	trans	-119.6	-20.8	-175.3	49.9	0	0	0	0	116.6	A873	T871-A873 VanDerWaalsContact C-N 3.32Å; T871-A873 PolarHBondContact O-N 2.91Å
872	D	27.9	Very low	33.6	Very low	157 Å²	157	132.7 Å²	132.7	84%	0.84	73%	0.731	S	S	*	*	S	Bend	trans	-97.8	35.9	-162.3	-56.3	-2.1	0	0	0	112.7
873	A	33.3	Very low	33.6	Very low	90 Å²	90	131.6 Å²	131.6	74%	0.744	74%	0.743	S	S	*	*	S	Bend	trans	-138.8	22.6	-168.4	0	0	0	0	0	115	T871	T871-A873 VanDerWaalsContact C-N 3.32Å; T871-A873 PolarHBondContact O-N 2.91Å
874	S	32.9	Very low	33	Very low	112 Å²	112	130.1 Å²	130.1	78%	0.783	75%	0.75	S	S	*	*	S	Bend	trans	-143.9	4.4	-177	-59.7	0	0	0	0	117.4
875	C	29.3	Very low	32.1	Very low	123 Å²	123	134.7 Å²	134.7	83%	0.831	77%	0.771	S	S	*	*			trans	-127.4	57.2	179.2	-70.2	0	0	0	0	113.6
876	L	26.3	Very low	31.1	Very low	175 Å²	175	134.2 Å²	134.2	92%	0.916	77%	0.772	S	S	*	*	S	Bend	trans	-135	29.5	163.1	-90.3	-176.8	0	0	0	113.3
877	I	36.3	Very low	30.6	Very low	146 Å²	146	141 Å²	141	75%	0.749	80%	0.795	S	S	*	*	S	Bend	trans	-131.7	139.7	162.7	-54.5	-179.2	0	0	0	106.2
878	F	28.6	Very low	30	Very low	208 Å²	208	139.2 Å²	139.2	91%	0.912	80%	0.802	S	S	*	*			trans	71.2	72.5	-168.2	-70.3	-85.4	0	0	0	116.9
879	A	26	Very low	29.4	Very low	106 Å²	106	135.1 Å²	135.1	88%	0.876	80%	0.804	S	S	*	*			trans	-149	89.7	148.4	0	0	0	0	0	110.1
880	S	27	Very low	28.6	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	80%	0.799	S	S	*	*			trans	-153.5	138.2	169.3	-173.2	0	0	0	0	110
881	Q	28.8	Very low	28.3	Very low	186 Å²	186	130.2 Å²	130.2	87%	0.869	80%	0.795	S	S	*	*			trans	90.4	105.6	-169.2	-57.8	146.3	112.7	0	0	115.8
882	H	27.6	Very low	28	Very low	189 Å²	189	134.8 Å²	134.8	88%	0.875	81%	0.811	S	S	*	*			trans	-77.5	179.5	151.8	-72.8	-74.5	0	0	0	109.6
883	P	37	Very low	27.8	Very low	126 Å²	126	130.4 Å²	130.4	82%	0.818	80%	0.804	S	S	*	*			cis	-141.3	177.1	12.4	43.2	-25	0	0	0	118.2
884	G	24.5	Very low	27.3	Very low	64 Å²	64	130 Å²	130	66%	0.66	81%	0.809	S	S	*	*			trans	122.9	111.4	138.8	0	0	0	0	0	120.3
885	L	27	Very low	27	Very low	172 Å²	172	133 Å²	133	90%	0.901	81%	0.81	S	S	*	*			trans	58	135.6	147.9	-44.4	179.2	0	0	0	118.6
886	S	24	Very low	26.7	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	81%	0.814	S	S	*	*			cis	76.7	132	25.4	-159.2	0	0	0	0	115.1
887	M	27.8	Very low	26.4	Very low	187 Å²	187	134.4 Å²	134.4	92%	0.921	80%	0.804	S	S	*	*			cis	-109.5	-159.4	5	-60.5	-178.3	179.8	0	0	111.4
888	G	23.8	Very low	25.8	Very low	69 Å²	69	135.5 Å²	135.5	71%	0.711	81%	0.811	S	S	*	*			cis	-153.3	-174.6	2.5	0	0	0	0	0	110
889	S	23.7	Very low	25.7	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	81%	0.806	S	S	*	*			cis	79.1	125.2	33.9	-147.6	0	0	0	0	115
890	S	24.7	Very low	25.6	Very low	94 Å²	94	130.9 Å²	130.9	66%	0.657	80%	0.804	S	S	*	*			cis	-170.2	165.4	-11.8	45.3	0	0	0	0	113.1
891	S	25.6	Very low	25.6	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	80%	0.796	S	S	*	*			trans	48.8	121.2	139.9	62.6	0	0	0	0	122.7
892	M	26.3	Very low	25.5	Very low	195 Å²	195	127.6 Å²	127.6	96%	0.961	79%	0.794	S	S	*	*				-167.8	155.5	117.8	-74.5	-141.4	82.8	0	0	107.6
893	G	23.5	Very low	25.4	Very low	66 Å²	66	125.6 Å²	125.6	68%	0.68	78%	0.779	S	S	*	*			cis	-172.5	170.3	-4.2	0	0	0	0	0	109.5
894	G	23.6	Very low	24.8	Very low	82 Å²	82	123 Å²	123	85%	0.845	78%	0.775	S	S	*	*			trans	-79.6	-166.9	175.7	0	0	0	0	0	113.2
895	Q	24.9	Very low	25.1	Very low	174 Å²	174	123.7 Å²	123.7	81%	0.813	78%	0.782	S	S	*	*			cis	-170.1	-142.3	-2.1	-159.2	166.7	21	0	0	105.8
896	W	23.1	Very low	25.6	Very low	242 Å²	242	121.8 Å²	121.8	92%	0.917	78%	0.78	S	S	*	*			trans	72.3	143.4	168.8	-56.2	61.3	0	0	0	115.3
897	A	21.6	Very low	25.7	Very low	85 Å²	85	120.9 Å²	120.9	70%	0.702	79%	0.787	S	S	*	*			cis	-160.7	179.5	-13.3	0	0	0	0	0	111
898	D	23.5	Very low	25.6	Very low	169 Å²	169	115.3 Å²	115.3	90%	0.904	78%	0.777	S	S	*	*			trans	-72.1	172.1	-168.8	-61.1	-91.1	0	0	0	118.7
899	G	25.2	Very low	25.7	Very low	77 Å²	77	119.8 Å²	119.8	79%	0.794	78%	0.784	S	S	*	*			trans	-160.7	81.9	178.2	0	0	0	0	0	115.8
900	V	25.6	Very low	25.5	Very low	140 Å²	140	122.6 Å²	122.6	85%	0.848	78%	0.784	S	S	*	*			trans	-23.3	142.3	158.1	-169.8	0	0	0	0	114.3
901	G	26.6	Very low	25.5	Very low	54 Å²	54	121 Å²	121	56%	0.557	78%	0.782	S	S	*	*			cis	115.6	130.7	19.8	0	0	0	0	0	110.6
902	M	26.2	Very low	25.5	Very low	169 Å²	169	126.3 Å²	126.3	83%	0.833	79%	0.792	S	S	*	*			trans	-155.1	95.7	175.4	-164.3	61.7	63.4	0	0	114.2
903	W	25	Very low	25.3	Very low	147 Å²	147	120.8 Å²	120.8	56%	0.557	79%	0.786	S	S	*	*			trans	29.7	146.9	137.9	-61.7	88.7	0	0	0	122.6	A471 M474	A471-W903 HydrophobicContact CB-CH2 4.39Å; M474-W903 HydrophobicContact CE-CE3 4.37Å; M474-W903 HydrophobicContact CE-CH2 3.67Å; M474-W903 HydrophobicContact CE-CZ3 3.4Å; M474-W903 VanDerWaalsContact CE-CZ3 3.4Å; M474-W903 HydrophobicContact CG-CH2 4.4Å; M474-W903 HydrophobicContact SD-CH2 3.51Å; M474-W903 VanDerWaalsContact SD-CH2 3.51Å; M474-W903 HydrophobicContact SD-CZ2 4.23Å; M474-W903 HydrophobicContact SD-CZ3 3.76Å
904	G	23.9	Very low	25.2	Very low	72 Å²	72	121.2 Å²	121.2	74%	0.742	79%	0.79	S	S	*	*			trans	-141	-174.2	172.3	0	0	0	0	0	113.4
905	G	31.4	Very low	25.1	Very low	79 Å²	79	123.5 Å²	123.5	81%	0.814	79%	0.793	S	S	*	*			trans	83.8	-177.6	-176.4	0	0	0	0	0	114.1
906	P	37.8	Very low	25	Very low	132 Å²	132	119 Å²	119	86%	0.857	79%	0.793	S	S	*	*			cis	-131.3	176.7	-2.2	41.4	-26.3	0	0	0	115.2
907	G	25.8	Very low	25	Very low	84 Å²	84	111.3 Å²	111.3	87%	0.866	79%	0.79	S	S	*	*			trans	78.3	158	156.9	0	0	0	0	0	118.7
908	G	24.9	Very low	25.1	Very low	70 Å²	70	112.7 Å²	112.7	72%	0.722	79%	0.794	S	S	*	*			cis	159	136.6	-11.6	0	0	0	0	0	114.9
909	L	26.1	Very low	25.1	Very low	163 Å²	163	109.5 Å²	109.5	85%	0.853	79%	0.785	S	S	*	*			trans	70	133.7	155.3	-54.8	172.1	0	0	0	121.5
910	E	21.2	Very low	25.1	Very low	179 Å²	179	112 Å²	112	84%	0.836	79%	0.79	S	S	*	*			trans	50.2	158	146.8	-60.4	-170.1	100.3	0	0	122.5
911	G	24.7	Very low	25.4	Very low	59 Å²	59	111.1 Å²	111.1	61%	0.608	79%	0.79	S	S	*	*			cis	163.4	144.5	-9.6	0	0	0	0	0	113.6
912	K	24.1	Very low	25.8	Very low	214 Å²	214	117.6 Å²	117.6	93%	0.93	81%	0.808	S	S	*	*			trans	72.6	152.4	179.2	-53.8	152.5	-177.8	154.4	0	115.9
913	G	22.6	Very low	26	Very low	80 Å²	80	113 Å²	113	83%	0.825	80%	0.804	S	S	*	*			cis	164.5	143.9	-12.3	0	0	0	0	0	115.2
914	G	21.7	Very low	26.5	Very low	74 Å²	74	113.4 Å²	113.4	76%	0.763	81%	0.814	S	S	*	*			trans	101.1	148.7	172	0	0	0	0	0	115.7
915	S	21.6	Very low	26.9	Very low	130 Å²	130	120.3 Å²	120.3	91%	0.909	82%	0.818	S	S	*	*			cis	-162.9	148.3	-3.1	-78.9	0	0	0	0	112.8
916	G	23	Very low	26.8	Very low	80 Å²	80	123.1 Å²	123.1	83%	0.825	81%	0.814	S	S	*	*			trans	100.4	108.7	141.6	0	0	0	0	0	121.1
917	G	22.2	Very low	26.5	Very low	81 Å²	81	125.3 Å²	125.3	84%	0.835	81%	0.813	S	S	*	*			trans	74.5	145.5	150	0	0	0	0	0	118.7
918	S	23.9	Very low	26.7	Very low	114 Å²	114	125.7 Å²	125.7	80%	0.797	81%	0.808	S	S	*	*			cis	-162.2	162.9	1.5	51.7	0	0	0	0	113.2
919	S	23.2	Very low	27.3	Very low	102 Å²	102	129 Å²	129	71%	0.713	81%	0.814	S	S	*	*			trans	62	109.1	161.6	56.4	0	0	0	0	122.5
920	S	26.4	Very low	27.6	Very low	129 Å²	129	129.9 Å²	129.9	90%	0.902	81%	0.81	S	S	*	*				83.9	163.5	126.5	-56.7	0	0	0	0	121.1
921	S	30.9	Very low	28	Very low	121 Å²	121	127.9 Å²	127.9	85%	0.846	81%	0.806	S	S	*	*			trans	-121.8	174	-153.8	-166.3	0	0	0	0	115.2
922	M	34.5	Very low	28.2	Very low	191 Å²	191	134 Å²	134	94%	0.941	82%	0.819	S	S	*	*			trans	-71.8	156.4	-171.9	-64.9	171.9	164.4	0	0	115.7
923	G	31.5	Very low	28.5	Very low	71 Å²	71	128.9 Å²	128.9	73%	0.732	82%	0.816	S	S	*	*			trans	-147.6	159.8	166.5	0	0	0	0	0	110.6
924	M	35.3	Very low	28.7	Very low	157 Å²	157	128.5 Å²	128.5	77%	0.773	81%	0.812	S	S	*	*			trans	-156.6	151.1	-161.8	-154.1	73.1	169.3	0	0	115.3
925	W	32	Very low	29.2	Very low	217 Å²	217	132.5 Å²	132.5	82%	0.822	82%	0.815	S	S	*	*			trans	69.7	140.2	163	-69.2	119	0	0	0	122.2
926	D	29.5	Very low	29.4	Very low	138 Å²	138	138 Å²	138	74%	0.738	82%	0.815	S	S	*	*			trans	91.3	175.9	140.5	-97.4	-108.5	0	0	0	124.2
927	E	31.6	Very low	29.6	Very low	178 Å²	178	137.9 Å²	137.9	83%	0.832	81%	0.814	S	S	*	*			trans	-102.9	170.9	-135.3	-152.5	-172.6	132.3	0	0	116.4
928	A	29.4	Very low	29.9	Very low	92 Å²	92	141.2 Å²	141.2	76%	0.76	81%	0.813	S	S	*	*			trans	80.7	178.8	162.8	0	0	0	0	0	118.6
929	V	37.3	Very low	30.4	Very low	139 Å²	139	140.5 Å²	140.5	84%	0.842	80%	0.804	S	S	*	*			trans	-120.9	152.8	-150.3	172.8	0	0	0	0	112.9
930	K	32.9	Very low	30.9	Very low	181 Å²	181	142 Å²	142	79%	0.787	80%	0.804	S	S	*	*			trans	107.1	127.2	150.8	-123.1	171.7	-173.6	177.7	0	118.8
931	N	29.1	Very low	31.3	Very low	138 Å²	138	142.1 Å²	142.1	74%	0.738	80%	0.795	S	S	*	*			trans	50	111.5	151.4	-66.6	12.4	0	0	0	123.2
932	Q	30.4	Very low	31.3	Very low	188 Å²	188	142.7 Å²	142.7	88%	0.879	79%	0.789	S	S	*	*			trans	41.9	124	132	-90.1	-176.4	-26.1	0	0	123.5
933	A	28.7	Very low	31.2	Very low	105 Å²	105	141.5 Å²	141.5	87%	0.868	79%	0.785	S	S	*	*			trans	79	134.7	138.2	0	0	0	0	0	121.5
934	G	28.4	Very low	31	Very low	72 Å²	72	141.4 Å²	141.4	74%	0.742	78%	0.784	S	S	*	*			trans	136.7	61.9	149.1	0	0	0	0	0	122.4
935	L	31.6	Very low	30.7	Very low	158 Å²	158	141.8 Å²	141.8	83%	0.827	79%	0.789	S	S	*	*			trans	50	120.4	144	-61.3	171.4	0	0	0	124
936	R	26.6	Very low	30.6	Very low	245 Å²	245	140.6 Å²	140.6	93%	0.925	79%	0.789	S	S	*	*			trans	66.4	144.2	140.8	-62.7	-178.9	174.5	-87.3	1.4	121.2
937	G	27	Very low	30.4	Very low	78 Å²	78	141.2 Å²	141.2	80%	0.804	79%	0.792	S	S	*	*			trans	-157.7	-85.1	-178.1	0	0	0	0	0	120.7
938	N	27.9	Very low	30.3	Very low	151 Å²	151	137 Å²	137	81%	0.807	78%	0.782	S	S	*	*			trans	80	136.9	172.5	-148.4	46.4	0	0	0	122.1
939	T	33.9	Very low	30.2	Very low	100 Å²	100	143.7 Å²	143.7	61%	0.613	79%	0.788	S	S	*	*			trans	74	112.5	147.8	38.6	0	0	0	0	126.7
940	N	34.3	Very low	29.7	Very low	132 Å²	132	142.8 Å²	142.8	71%	0.706	79%	0.788	S	S	*	*				79.2	122	117.9	-68	11.8	0	0	0	127.4
941	N	34.5	Very low	29.5	Very low	133 Å²	133	139.8 Å²	139.8	71%	0.711	79%	0.79	S	S	*	*				87	130.4	126.6	-65.9	-2.2	0	0	0	126.1
942	N	31	Very low	30.3	Very low	133 Å²	133	139.1 Å²	139.1	71%	0.711	79%	0.793	S	S	*	*				109	122.5	126.8	-94.9	-3.6	0	0	0	125
943	L	32.8	Very low	29.9	Very low	165 Å²	165	135.1 Å²	135.1	86%	0.864	79%	0.786	S	S	*	*			trans	61	151.5	137.8	-64.3	166.3	0	0	0	122.5
944	G	26.5	Very low	29.9	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	78%	0.784	S	S	*	*			trans	-174.8	-35.7	168.5	0	0	0	0	0	125.4
945	L	30.3	Very low	29.9	Very low	165 Å²	165	141 Å²	141	86%	0.864	79%	0.79	S	S	*	*			trans	52.3	140	172.5	-70	167.4	0	0	0	123.1
946	K	29	Very low	29.6	Very low	192 Å²	192	139.8 Å²	139.8	84%	0.835	79%	0.785	S	S	*	*			trans	73.2	97.2	142.8	70.8	171.4	179.4	179	0	125.6
947	N	26.3	Very low	29.6	Very low	150 Å²	150	135.5 Å²	135.5	80%	0.802	78%	0.775	S	S	*	*				75.4	123.4	111.9	-163.9	37.4	0	0	0	124.8
948	S	29.3	Very low	29.4	Very low	89 Å²	89	141.2 Å²	141.2	62%	0.622	77%	0.774	S	S	*	*			trans	96.9	122.1	138.1	-90.9	0	0	0	0	125
949	R	27.2	Very low	29.3	Very low	234 Å²	234	142.5 Å²	142.5	88%	0.883	78%	0.777	S	S	*	*			trans	91.4	135	140.6	-74.4	-177.4	168	-170.1	-5.3	123.1
950	S	25.8	Very low	28.9	Very low	120 Å²	120	146.7 Å²	146.7	84%	0.839	79%	0.792	S	S	*	*			trans	80.4	135.2	158.6	2.2	0	0	0	0	120.4
951	S	29.3	Very low	28.8	Very low	117 Å²	117	151.1 Å²	151.1	82%	0.818	80%	0.799	S	S	*	*			trans	-111.4	-179.5	169.8	-40.8	0	0	0	0	108.3
952	P	44.7	Very low	28.7	Very low	124 Å²	124	156.5 Å²	156.5	81%	0.805	81%	0.809	S	S	*	*			cis	-144.6	-170.5	18.1	44.4	-23.8	0	0	0	117.8
953	S	23.2	Very low	29.3	Very low	105 Å²	105	159.4 Å²	159.4	73%	0.734	82%	0.815	S	S	*	*			trans	102.4	128.9	152.6	-148.7	0	0	0	0	120.6
954	L	27.5	Very low	29.5	Very low	157 Å²	157	158.5 Å²	158.5	82%	0.822	80%	0.8	S	S	*	*			trans	22.4	118.2	155	-69	163.5	0	0	0	121.2
955	T	28.7	Very low	30.7	Very low	143 Å²	143	158.7 Å²	158.7	88%	0.877	79%	0.788	S	S	*	*				-177.3	158.1	100.5	-66	0	0	0	0	108.9
956	D	25.4	Very low	31.3	Very low	133 Å²	133	157.2 Å²	157.2	71%	0.711	78%	0.777	S	S	*	*			trans	-89.3	153.3	-160.1	-138.5	-43.8	0	0	0	116.4
957	Q	26	Very low	32.1	Very low	154 Å²	154	152.4 Å²	152.4	72%	0.72	76%	0.76	S	S	*	*			trans	65.7	150.1	174.4	-50.4	-177.8	15	0	0	114.4
958	Y	24.1	Very low	33	Very low	199 Å²	199	149.7 Å²	149.7	78%	0.78	74%	0.742	S	S	*	*			cis	-142.8	136.6	29	-19.4	-89	0	0	0	112.8
959	M	25.6	Very low	33.9	Very low	177 Å²	177	150.1 Å²	150.1	87%	0.872	74%	0.735	S	S	*	*			trans	48.9	102.5	150.9	-49.2	-175.6	-157.6	0	0	119.8
960	M	24.7	Very low	35.1	Very low	189 Å²	189	143.6 Å²	143.6	93%	0.931	71%	0.712	S	S	*	*				-165.2	153.5	108.7	-107.9	-59	167.2	0	0	115.4
961	R	33.3	Very low	36.8	Very low	225 Å²	225	143.5 Å²	143.5	85%	0.849	70%	0.702	S	S	*	*			trans	-87.6	124.4	-173.2	171.8	-164.6	-75.5	-178	-6.1	112.3
962	R	31.6	Very low	37.9	Very low	245 Å²	245	142.3 Å²	142.3	93%	0.925	69%	0.686	S	S	*	*			trans	-140.4	106.4	151.9	-79.5	-163.7	-177.2	168.9	4.9	113.3	R964	R962-R964 PolarHBondContact O-N 2.86Å
963	K	43.7	Very low	38.2	Very low	194 Å²	194	143.3 Å²	143.3	84%	0.843	68%	0.678	S	S	*	*			trans	14.1	92.2	146.8	-166	168.2	-174.2	170.2	0	116.8
964	R	37.3	Very low	39.6	Very low	146 Å²	146	145.2 Å²	145.2	55%	0.551	68%	0.679	S	S	*	*			trans	-62.6	146.9	152	-143.2	176.9	-159.6	160	8.1	108.9	R962 E968	R962-R964 PolarHBondContact O-N 2.86Å; R964-E968 HydrophobicContact CG-CB 4.28Å; R964-E968 VanDerWaalsContact CG-OE2 3.23Å; R964-E968 WeakPolarHBondContact CG-OE2 3.46Å; R964-E968 IonicContact NE-OE2 2.73Å; R964-E968 PolarHBondContact NE-OE2 2.8Å
965	T	50.8	Low	40.3	Very low	75 Å²	75	145.6 Å²	145.6	46%	0.46	68%	0.681	S	S	.	*			trans	-84.7	143.8	167.9	42.6	0	0	0	0	109.3	D967 E968	T965-D967 PolarHBondContact O-N 3.49Å; T965-E968 PolarHBondContact O-N 3.47Å
966	E	44	Very low	40.9	Very low	134 Å²	134	145.2 Å²	145.2	63%	0.626	67%	0.669	S	S	*	*	H	α-helix	trans	-57.1	-24	-179.5	-58.4	-175.8	156.3	0	0	112.9	E969 K970	E966-E969 PolarHBondContact O-N 2.94Å; E966-K970 WeakPolarHBondContact O-CE 3.33Å; E966-K970 WeakPolarHBondContact O-CG 3.35Å; E966-K970 PolarHBondContact O-N 2.9Å; E966-K970 IonicContact OE2-NZ 2.65Å; E966-K970 PolarHBondContact OE2-NZ 3.24Å
967	D	46.5	Very low	41.4	Very low	90 Å²	90	143 Å²	143	48%	0.481	68%	0.678	S	S	.	*	H	α-helix	trans	-74.8	-26.7	-174.6	-49.4	-53.8	0	0	0	112.4	T965 E969 K970 L971	T965-D967 PolarHBondContact O-N 3.49Å; D967-E969 VanDerWaalsContact C-N 3.34Å; D967-K970 PolarHBondContact O-N 3.37Å; D967-K970 WeakPolarHBondContact OD1-CD 3.4Å; D967-K970 IonicContact OD1-NZ 3.8Å; D967-K970 PolarHBondContact OD1-NZ 2.85Å; D967-L971 WeakPolarHBondContact O-CB 2.97Å; D967-L971 VanDerWaalsContact O-CG 3.27Å; D967-L971 WeakPolarHBondContact O-CG 3.22Å; D967-L971 PolarHBondContact O-N 3.46Å
968	E	43.8	Very low	41.8	Very low	93 Å²	93	142.9 Å²	142.9	44%	0.435	68%	0.679	S	S	.	*	H	α-helix	trans	-66.7	-36.4	166.6	-71.1	-172.7	-177.6	0	0	111.7	R964 T965 L971 L972	R964-E968 HydrophobicContact CG-CB 4.28Å; R964-E968 VanDerWaalsContact CG-OE2 3.23Å; R964-E968 WeakPolarHBondContact CG-OE2 3.46Å; R964-E968 IonicContact NE-OE2 2.73Å; R964-E968 PolarHBondContact NE-OE2 2.8Å; T965-E968 PolarHBondContact O-N 3.47Å; E968-L971 PolarHBondContact O-N 2.66Å; E968-L972 WeakPolarHBondContact O-CB 3.47Å; E968-L972 WeakPolarHBondContact O-CG 3.34Å; E968-L972 PolarHBondContact O-N 2.89Å
969	E	48.8	Very low	42.1	Very low	99 Å²	99	142.7 Å²	142.7	46%	0.463	68%	0.682	S	S	.	*	H	α-helix	trans	-73.8	-28.4	176.8	-59.8	-169.9	174.1	0	0	112.1	E966 D967 K973	E966-E969 PolarHBondContact O-N 2.94Å; D967-E969 VanDerWaalsContact C-N 3.34Å; E969-K973 WeakPolarHBondContact O-CB 3.37Å; E969-K973 WeakPolarHBondContact O-CG 3.45Å; E969-K973 PolarHBondContact O-N 3.46Å
970	K	52	Low	42.8	Very low	96 Å²	96	138.9 Å²	138.9	42%	0.417	67%	0.671	S	S	.	*	H	α-helix	trans	-68.8	-41	169.3	-66.5	162.3	-151.1	162.8	0	111	E966 D967 K973 L974	E966-K970 WeakPolarHBondContact O-CE 3.33Å; E966-K970 WeakPolarHBondContact O-CG 3.35Å; E966-K970 PolarHBondContact O-N 2.9Å; E966-K970 IonicContact OE2-NZ 2.65Å; E966-K970 PolarHBondContact OE2-NZ 3.24Å; D967-K970 PolarHBondContact O-N 3.37Å; D967-K970 WeakPolarHBondContact OD1-CD 3.4Å; D967-K970 IonicContact OD1-NZ 3.8Å; D967-K970 PolarHBondContact OD1-NZ 2.85Å; K970-K973 PolarHBondContact O-N 2.89Å; K970-L974 PolarHBondContact O-N 3.08Å; K970-L974 VanDerWaalsContact O-N 3.12Å
971	L	61.6	Low	43.8	Very low	118 Å²	118	134.4 Å²	134.4	62%	0.618	65%	0.647	S	S	*	*	H	α-helix	trans	-67.2	-42.3	175.4	-72.5	167.3	0	0	0	112.3	D967 E968 K973 L974 L975	D967-L971 WeakPolarHBondContact O-CB 2.97Å; D967-L971 VanDerWaalsContact O-CG 3.27Å; D967-L971 WeakPolarHBondContact O-CG 3.22Å; D967-L971 PolarHBondContact O-N 3.46Å; E968-L971 PolarHBondContact O-N 2.66Å; L971-K973 VanDerWaalsContact C-N 3.33Å; L971-K973 PolarHBondContact O-N 2.88Å; L971-L974 WeakPolarHBondContact O-CB 3.23Å; L971-L974 PolarHBondContact O-N 3.3Å; L971-L975 PolarHBondContact O-N 2.82Å; L971-L975 VanDerWaalsContact O-N 3.11Å
972	L	52.5	Low	45.2	Very low	93 Å²	93	127.4 Å²	127.4	49%	0.487	63%	0.627	S	S	.	*	H	α-helix	trans	-63.7	-36.9	174	-73	165.2	0	0	0	112.1	E968 L974 L975 Q976	E968-L972 WeakPolarHBondContact O-CB 3.47Å; E968-L972 WeakPolarHBondContact O-CG 3.34Å; E968-L972 PolarHBondContact O-N 2.89Å; L972-L974 VanDerWaalsContact C-N 3.25Å; L972-L974 PolarHBondContact O-N 3.4Å; L972-L975 PolarHBondContact O-N 3.35Å; L972-Q976 WeakPolarHBondContact O-CB 3.25Å; L972-Q976 PolarHBondContact O-N 3.46Å; L972-Q976 VanDerWaalsContact O-N 3.12Å
973	K	51.8	Low	47.3	Very low	145 Å²	145	119 Å²	119	63%	0.63	62%	0.616	S	S	*	*	H	α-helix	trans	-68.8	-16.2	171	-83.4	173.4	176	162.6	0	114.9	E969 K970 L971	E969-K973 WeakPolarHBondContact O-CB 3.37Å; E969-K973 WeakPolarHBondContact O-CG 3.45Å; E969-K973 PolarHBondContact O-N 3.46Å; K970-K973 PolarHBondContact O-N 2.89Å; L971-K973 VanDerWaalsContact C-N 3.33Å; L971-K973 PolarHBondContact O-N 2.88Å
974	L	52.3	Low	49	Very low	145 Å²	145	110.8 Å²	110.8	76%	0.759	58%	0.581	S	S	*	*	H	α-helix	trans	-91.9	-27.1	176.6	-93.8	161.1	0	0	0	112.8	K970 L971 L972	K970-L974 PolarHBondContact O-N 3.08Å; K970-L974 VanDerWaalsContact O-N 3.12Å; L971-L974 WeakPolarHBondContact O-CB 3.23Å; L971-L974 PolarHBondContact O-N 3.3Å; L972-L974 VanDerWaalsContact C-N 3.25Å; L972-L974 PolarHBondContact O-N 3.4Å
975	L	41.4	Very low	51.2	Low	164 Å²	164	104 Å²	104	86%	0.859	56%	0.555	S	S	*	*	H	α-helix	trans	-95.6	-23.6	-179	-142.4	71.9	0	0	0	113.7	L971 L972 G977	L971-L975 PolarHBondContact O-N 2.82Å; L971-L975 VanDerWaalsContact O-N 3.11Å; L972-L975 PolarHBondContact O-N 3.35Å; L975-G977 PolarHBondContact O-N 3.32Å
976	Q	42.6	Very low	52.8	Low	136 Å²	136	102.7 Å²	102.7	64%	0.636	55%	0.547	S	S	*	.	S	Bend	trans	-86.4	99.4	172.6	-162.8	94	51.6	0	0	110	L972 M978	L972-Q976 WeakPolarHBondContact O-CB 3.25Å; L972-Q976 PolarHBondContact O-N 3.46Å; L972-Q976 VanDerWaalsContact O-N 3.12Å; Q976-M978 PolarHBondContact O-N 2.83Å
977	G	36.1	Very low	54.8	Low	86 Å²	86	97.7 Å²	97.7	89%	0.887	52%	0.523	S	S	*	.			trans	-69	32	-174.8	0	0	0	0	0	117.3	L975	L975-G977 PolarHBondContact O-N 3.32Å
978	M	32.3	Very low	56.7	Low	151 Å²	151	93.4 Å²	93.4	74%	0.744	50%	0.5	S	S	*	.	S	Bend	trans	-126.3	129.1	179.4	-70.8	165	67.7	0	0	109.8	Q976 P980	Q976-M978 PolarHBondContact O-N 2.83Å; M978-P980 WeakPolarHBondContact O-CD 3.33Å
979	K	30.8	Very low	58.7	Low	195 Å²	195	90.8 Å²	90.8	85%	0.848	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-59.2	127.8	179.2	-80.6	176.6	175.4	170.2	0	110.6	Q981	K979-Q981 PolarHBondContact O-N 2.85Å
980	P	40	Very low	60.3	Low	98 Å²	98	92.2 Å²	92.2	64%	0.636	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-55.5	136.4	161	-21.6	33.4	0	0	0	109.3	M978	M978-P980 WeakPolarHBondContact O-CD 3.33Å
981	Q	46.6	Very low	61.7	Low	94 Å²	94	89.9 Å²	89.9	44%	0.439	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-56	145.6	-172.4	-78.6	-68.2	17.3	0	0	113.3	K979 G983 T985 T986 E989	K979-Q981 PolarHBondContact O-N 2.85Å; Q981-G983 PolarHBondContact O-N 2.83Å; Q981-T985 VanDerWaalsContact CD-CB 3.43Å; Q981-T985 VanDerWaalsContact CD-CG2 3.42Å; Q981-T985 HydrophobicContact CG-CG2 4.48Å; Q981-T985 VanDerWaalsContact NE2-CG2 3.29Å; Q981-T985 VanDerWaalsContact OE1-CG2 3.24Å; Q981-T985 PolarHBondContact OE1-OG1 3.32Å; Q981-T986 VanDerWaalsContact CB-OG1 3.3Å; Q981-T986 WeakPolarHBondContact CB-OG1 3.19Å; Q981-E989 PolarHBondContact NE2-OE1 3.49Å
982	D	62.8	Low	62.6	Low	78 Å²	78	84.5 Å²	84.5	42%	0.417	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-54.4	137.1	158.5	-65.3	-64.2	0	0	0	108.2	F984 T985 T986 K1016	D982-F984 HydrophobicContact CB-CB 4.28Å; D982-F984 CarbonylContact O-C 3.56Å; D982-F984 PolarHBondContact O-N 3.3Å; D982-T985 WeakPolarHBondContact O-CA 3.27Å; D982-T985 WeakPolarHBondContact O-CB 3.4Å; D982-T985 PolarHBondContact O-N 2.99Å; D982-T985 PolarHBondContact O-OG1 2.85Å; D982-T986 PolarHBondContact O-N 3.39Å; D982-K1016 IonicContact OD2-NZ 3.3Å
983	G	75	Confident	63.8	Low	68 Å²	68	84.9 Å²	84.9	70%	0.701	46%	0.456	S	S	*	.	H	α-helix	trans	-60.3	-10	171.8	0	0	0	0	0	114	Q981	Q981-G983 PolarHBondContact O-N 2.83Å
984	F	80.6	Confident	65	Low	23 Å²	23	80.6 Å²	80.6	10%	0.101	45%	0.448	C	S	.	.	H	α-helix	trans	-73.4	-48.1	164.4	175.3	-121.4	0	0	0	112.1	D982 T986 W987 C988 F1045 R1048 R1049 Q1052	D982-F984 HydrophobicContact CB-CB 4.28Å; D982-F984 CarbonylContact O-C 3.56Å; D982-F984 PolarHBondContact O-N 3.3Å; F984-T986 PolarHBondContact O-N 2.86Å; F984-W987 HydrophobicContact CD2-CE3 4.08Å; F984-W987 HydrophobicContact CD2-CZ3 4.44Å; F984-W987 HydrophobicContact CE2-CE3 4.05Å; F984-W987 AromaticContact CE2-CZ3 3.96Å; F984-W987 HydrophobicContact CE2-CZ3 3.96Å; F984-W987 PolarHBondContact O-N 2.79Å; F984-C988 VanDerWaalsContact CE2-SG 3.57Å; F984-C988 PolarHBondContact O-N 3.12Å; F984-C988 PolarHBondContact O-SG 2.92Å; F984-F1045 AromaticContact CE1-CE2 3.97Å; F984-F1045 HydrophobicContact CE1-CE2 3.97Å; F984-F1045 HydrophobicContact CE1-CZ 4.28Å; F984-F1045 HydrophobicContact CE2-CD2 4.09Å; F984-F1045 HydrophobicContact CE2-CE2 4.32Å; F984-F1045 AromaticContact CZ-CD2 3.59Å; F984-F1045 HydrophobicContact CZ-CD2 3.59Å; F984-F1045 AromaticContact CZ-CE2 3.43Å; F984-F1045 HydrophobicContact CZ-CE2 3.43Å; F984-F1045 VanDerWaalsContact CZ-CE2 3.43Å; F984-F1045 HydrophobicContact CZ-CG 4.2Å; F984-F1045 AromaticContact CZ-CZ 3.93Å; F984-F1045 HydrophobicContact CZ-CZ 3.93Å; F984-R1048 HydrophobicContact CD2-CB 3.76Å; F984-R1048 HydrophobicContact CE2-CB 3.54Å; F984-R1049 HydrophobicContact CE1-CB 4.34Å; F984-R1049 HydrophobicContact CE1-CG 4.49Å; F984-R1049 HydrophobicContact CZ-CB 3.98Å; F984-Q1052 VanDerWaalsContact CD1-OE1 3.22Å
985	T	83.3	Confident	65.9	Low	2 Å²	2	74.2 Å²	74.2	1%	0.012	41%	0.414	C	S	.	.	H	α-helix	trans	-59.9	-48.4	179.4	-30.6	0	0	0	0	111.2	Q981 D982 W987 C988 E989 V1012 K1016	Q981-T985 VanDerWaalsContact CD-CB 3.43Å; Q981-T985 VanDerWaalsContact CD-CG2 3.42Å; Q981-T985 HydrophobicContact CG-CG2 4.48Å; Q981-T985 VanDerWaalsContact NE2-CG2 3.29Å; Q981-T985 VanDerWaalsContact OE1-CG2 3.24Å; Q981-T985 PolarHBondContact OE1-OG1 3.32Å; D982-T985 WeakPolarHBondContact O-CA 3.27Å; D982-T985 WeakPolarHBondContact O-CB 3.4Å; D982-T985 PolarHBondContact O-N 2.99Å; D982-T985 PolarHBondContact O-OG1 2.85Å; T985-W987 PolarHBondContact O-N 3.46Å; T985-C988 CarbonylContact O-C 3.57Å; T985-C988 WeakPolarHBondContact O-CA 3.42Å; T985-C988 VanDerWaalsContact O-CB 3.3Å; T985-C988 WeakPolarHBondContact O-CB 3.44Å; T985-C988 PolarHBondContact O-N 2.88Å; T985-E989 WeakPolarHBondContact O-CG 3.46Å; T985-E989 PolarHBondContact O-N 3.32Å; T985-V1012 HydrophobicContact CG2-CG1 3.27Å; T985-K1016 HydrophobicContact CG2-CD 3.83Å; T985-K1016 PolarHBondContact OG1-NZ 3.31Å
986	T	83.2	Confident	67.2	Low	48 Å²	48	69.5 Å²	69.5	29%	0.294	39%	0.39	S	S	.	.	H	α-helix	trans	-63.8	-30.2	-179.4	-53.4	0	0	0	0	113.1	Q981 D982 F984 E989 Q990	Q981-T986 VanDerWaalsContact CB-OG1 3.3Å; Q981-T986 WeakPolarHBondContact CB-OG1 3.19Å; D982-T986 PolarHBondContact O-N 3.39Å; F984-T986 PolarHBondContact O-N 2.86Å; T986-E989 VanDerWaalsContact CA-OE2 3.25Å; T986-E989 WeakPolarHBondContact CA-OE2 3.47Å; T986-Q990 WeakPolarHBondContact O-CB 3.46Å; T986-Q990 WeakPolarHBondContact O-CG 3.49Å; T986-Q990 PolarHBondContact O-N 2.91Å
987	W	87.1	Confident	68.4	Low	30 Å²	30	68.1 Å²	68.1	11%	0.114	39%	0.391	C	S	.	.	H	α-helix	trans	-70.8	-35.7	169.4	169.8	75.9	0	0	0	112.7	F984 T985 M991 F1041 Q1044 F1045 R1048	F984-W987 HydrophobicContact CD2-CE3 4.08Å; F984-W987 HydrophobicContact CD2-CZ3 4.44Å; F984-W987 HydrophobicContact CE2-CE3 4.05Å; F984-W987 AromaticContact CE2-CZ3 3.96Å; F984-W987 HydrophobicContact CE2-CZ3 3.96Å; F984-W987 PolarHBondContact O-N 2.79Å; T985-W987 PolarHBondContact O-N 3.46Å; W987-M991 HydrophobicContact CZ2-CB 4.47Å; W987-M991 HydrophobicContact CZ2-CE 4.31Å; W987-M991 HydrophobicContact CZ2-CG 4.37Å; W987-M991 VanDerWaalsContact O-CB 3.27Å; W987-M991 WeakPolarHBondContact O-CB 3.35Å; W987-M991 PolarHBondContact O-N 3.47Å; W987-F1041 AromaticContact CH2-CD2 3.9Å; W987-F1041 HydrophobicContact CH2-CD2 3.9Å; W987-F1041 AromaticContact CH2-CE2 3.9Å; W987-F1041 HydrophobicContact CH2-CE2 3.9Å; W987-F1041 HydrophobicContact CZ2-CD2 4.36Å; W987-F1041 HydrophobicContact CZ3-CE2 4.13Å; W987-Q1044 HydrophobicContact CH2-CB 3.7Å; W987-Q1044 HydrophobicContact CZ2-CB 3.95Å; W987-F1045 HydrophobicContact CZ3-CB 4.45Å; W987-R1048 VanDerWaalsContact CD2-CZ 3.42Å; W987-R1048 VanDerWaalsContact CE2-NH2 3.32Å
988	C	86.8	Confident	69.4	Low	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-65.8	-47.7	174.8	-58.2	0	0	0	0	110.8	F984 T985 M991 L992 V1012 F1045	F984-C988 VanDerWaalsContact CE2-SG 3.57Å; F984-C988 PolarHBondContact O-N 3.12Å; F984-C988 PolarHBondContact O-SG 2.92Å; T985-C988 CarbonylContact O-C 3.57Å; T985-C988 WeakPolarHBondContact O-CA 3.42Å; T985-C988 VanDerWaalsContact O-CB 3.3Å; T985-C988 WeakPolarHBondContact O-CB 3.44Å; T985-C988 PolarHBondContact O-N 2.88Å; C988-M991 PolarHBondContact O-N 3.17Å; C988-L992 WeakPolarHBondContact O-CB 3.26Å; C988-L992 WeakPolarHBondContact O-CD1 3.28Å; C988-L992 VanDerWaalsContact O-CG 3.32Å; C988-L992 WeakPolarHBondContact O-CG 3.49Å; C988-L992 PolarHBondContact O-N 3.48Å; C988-V1012 HydrophobicContact CB-CG1 4.06Å; C988-V1012 HydrophobicContact CB-CG2 3.94Å; C988-F1045 HydrophobicContact CB-CE2 4.49Å; C988-F1045 VanDerWaalsContact SG-CD2 3.52Å; C988-F1045 VanDerWaalsContact SG-CE2 3.54Å
989	E	84.3	Confident	70.5	Confident	37 Å²	37	61.3 Å²	61.3	17%	0.173	35%	0.347	C	S	.	.	H	α-helix	trans	-54.2	-54.6	175.6	-67.4	160.7	174.4	0	0	110.4	Q981 T985 T986 M991 L992 H993 V1008 V1012	Q981-E989 PolarHBondContact NE2-OE1 3.49Å; T985-E989 WeakPolarHBondContact O-CG 3.46Å; T985-E989 PolarHBondContact O-N 3.32Å; T986-E989 VanDerWaalsContact CA-OE2 3.25Å; T986-E989 WeakPolarHBondContact CA-OE2 3.47Å; E989-M991 PolarHBondContact O-N 2.87Å; E989-L992 PolarHBondContact O-N 3.38Å; E989-H993 PolarHBondContact O-CD2 3.28Å; E989-H993 PolarHBondContact O-N 2.84Å; E989-V1008 HydrophobicContact CB-CG1 4.31Å; E989-V1012 HydrophobicContact CG-CB 4.47Å; E989-V1012 HydrophobicContact CG-CG1 4.43Å; E989-V1012 HydrophobicContact CG-CG2 4.04Å
990	Q	82.9	Confident	71.6	Confident	129 Å²	129	59.4 Å²	59.4	60%	0.603	35%	0.345	S	S	*	.	H	α-helix	trans	-60.6	-40	179.2	-73.8	170.6	-3.6	0	0	113.7	T986 A994	T986-Q990 WeakPolarHBondContact O-CB 3.46Å; T986-Q990 WeakPolarHBondContact O-CG 3.49Å; T986-Q990 PolarHBondContact O-N 2.91Å; Q990-A994 PolarHBondContact O-N 2.89Å; Q990-A994 VanDerWaalsContact O-N 3.16Å
991	M	82.3	Confident	72.1	Confident	48 Å²	48	60.1 Å²	60.1	24%	0.236	34%	0.344	C	S	.	.	H	α-helix	trans	-72.9	-37.3	179.7	-167.3	61	62.9	0	0	111.8	W987 C988 E989 A994 L995 F1041	W987-M991 HydrophobicContact CZ2-CB 4.47Å; W987-M991 HydrophobicContact CZ2-CE 4.31Å; W987-M991 HydrophobicContact CZ2-CG 4.37Å; W987-M991 VanDerWaalsContact O-CB 3.27Å; W987-M991 WeakPolarHBondContact O-CB 3.35Å; W987-M991 PolarHBondContact O-N 3.47Å; C988-M991 PolarHBondContact O-N 3.17Å; E989-M991 PolarHBondContact O-N 2.87Å; M991-A994 PolarHBondContact O-N 3.47Å; M991-L995 HydrophobicContact CG-CD1 4.15Å; M991-L995 VanDerWaalsContact O-CG 3.27Å; M991-L995 WeakPolarHBondContact O-CG 3.43Å; M991-L995 PolarHBondContact O-N 3.18Å; M991-F1041 HydrophobicContact CB-CD2 4.04Å; M991-F1041 HydrophobicContact CB-CE2 4.04Å; M991-F1041 HydrophobicContact CG-CD2 3.49Å; M991-F1041 VanDerWaalsContact CG-CD2 3.49Å; M991-F1041 HydrophobicContact CG-CE2 4.02Å; M991-F1041 HydrophobicContact CG-CG 4.24Å
992	L	81.1	Confident	72.3	Confident	5 Å²	5	62 Å²	62	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-68.6	-40.5	175.8	-76.1	165.1	0	0	0	112.2	C988 E989 A994 L995 N996 V1008 I1011 V1012 L1015 L1032 F1041	C988-L992 WeakPolarHBondContact O-CB 3.26Å; C988-L992 WeakPolarHBondContact O-CD1 3.28Å; C988-L992 VanDerWaalsContact O-CG 3.32Å; C988-L992 WeakPolarHBondContact O-CG 3.49Å; C988-L992 PolarHBondContact O-N 3.48Å; E989-L992 PolarHBondContact O-N 3.38Å; L992-A994 VanDerWaalsContact C-N 3.29Å; L992-A994 PolarHBondContact O-N 2.98Å; L992-L995 PolarHBondContact O-N 3.29Å; L992-N996 VanDerWaalsContact O-CB 3.29Å; L992-N996 WeakPolarHBondContact O-CB 3.36Å; L992-N996 PolarHBondContact O-N 2.92Å; L992-V1008 HydrophobicContact CB-CG1 3.71Å; L992-V1008 HydrophobicContact CB-CG2 4.5Å; L992-V1008 HydrophobicContact CD1-CG1 4.24Å; L992-I1011 HydrophobicContact CD1-CG2 3.9Å; L992-I1011 HydrophobicContact CD2-CG2 4.35Å; L992-V1012 HydrophobicContact CD1-CG2 3.3Å; L992-L1015 HydrophobicContact CD1-CD1 4.11Å; L992-L1032 HydrophobicContact CD2-CD1 3.59Å; L992-F1041 HydrophobicContact CD1-CE1 4.48Å; L992-F1041 HydrophobicContact CD1-CZ 4.06Å; L992-F1041 HydrophobicContact CD2-CD1 4.28Å; L992-F1041 HydrophobicContact CD2-CE1 3.52Å; L992-F1041 HydrophobicContact CD2-CZ 3.83Å; L992-F1041 HydrophobicContact CG-CE1 3.96Å; L992-F1041 HydrophobicContact CG-CE2 4.45Å; L992-F1041 HydrophobicContact CG-CZ 3.7Å
993	H	77.1	Confident	71.4	Confident	101 Å²	101	62.8 Å²	62.8	47%	0.468	38%	0.379	S	S	.	.	H	α-helix	trans	-59.4	-39.7	170.8	-77.7	-66.2	0	0	0	112	E989 T997	E989-H993 PolarHBondContact O-CD2 3.28Å; E989-H993 PolarHBondContact O-N 2.84Å; H993-T997 WeakPolarHBondContact O-CB 3.39Å; H993-T997 PolarHBondContact O-N 2.9Å; H993-T997 VanDerWaalsContact O-N 3.17Å; H993-T997 PolarHBondContact O-OG1 2.81Å
994	A	77.4	Confident	70.1	Confident	54 Å²	54	62.6 Å²	62.6	45%	0.446	37%	0.367	S	S	.	.	H	α-helix	trans	-64.5	-45.6	176.6	0	0	0	0	0	112.4	Q990 M991 L992 T997 S998	Q990-A994 PolarHBondContact O-N 2.89Å; Q990-A994 VanDerWaalsContact O-N 3.16Å; M991-A994 PolarHBondContact O-N 3.47Å; L992-A994 VanDerWaalsContact C-N 3.29Å; L992-A994 PolarHBondContact O-N 2.98Å; A994-T997 WeakPolarHBondContact O-CB 3.25Å; A994-T997 PolarHBondContact O-N 3.39Å; A994-T997 VanDerWaalsContact O-N 3.1Å; A994-S998 PolarHBondContact O-N 3.33Å
995	L	70.6	Confident	68.3	Low	11 Å²	11	67.8 Å²	67.8	6%	0.058	41%	0.406	C	S	.	.	H	α-helix	trans	-68.9	-36.7	179.6	-65.7	164.8	0	0	0	112.7	M991 L992 T997 S998 A999 L1032 E1037 F1041	M991-L995 HydrophobicContact CG-CD1 4.15Å; M991-L995 VanDerWaalsContact O-CG 3.27Å; M991-L995 WeakPolarHBondContact O-CG 3.43Å; M991-L995 PolarHBondContact O-N 3.18Å; L992-L995 PolarHBondContact O-N 3.29Å; L995-T997 PolarHBondContact O-N 3.38Å; L995-S998 PolarHBondContact O-N 3.39Å; L995-S998 PolarHBondContact O-OG 3Å; L995-A999 PolarHBondContact O-N 2.72Å; L995-L1032 HydrophobicContact CB-CD2 4.09Å; L995-L1032 HydrophobicContact CD1-CD1 4.34Å; L995-E1037 HydrophobicContact CD2-CB 3.51Å; L995-F1041 HydrophobicContact CD1-CB 3.65Å; L995-F1041 HydrophobicContact CD1-CD1 3.92Å; L995-F1041 HydrophobicContact CD1-CD2 4.36Å; L995-F1041 HydrophobicContact CD1-CG 3.7Å
996	N	69.4	Low	67.1	Low	65 Å²	65	71.5 Å²	71.5	35%	0.348	43%	0.425	S	S	.	.	H	α-helix	trans	-73.7	-5	172.9	-154.2	26.4	0	0	0	112.8	L992	L992-N996 VanDerWaalsContact O-CB 3.29Å; L992-N996 WeakPolarHBondContact O-CB 3.36Å; L992-N996 PolarHBondContact O-N 2.92Å
997	T	67.6	Low	66.5	Low	108 Å²	108	73.8 Å²	73.8	66%	0.663	44%	0.436	S	S	*	.	H	α-helix	trans	-100.1	-24.2	169.9	-51.5	0	0	0	0	112	H993 A994 L995	H993-T997 WeakPolarHBondContact O-CB 3.39Å; H993-T997 PolarHBondContact O-N 2.9Å; H993-T997 VanDerWaalsContact O-N 3.17Å; H993-T997 PolarHBondContact O-OG1 2.81Å; A994-T997 WeakPolarHBondContact O-CB 3.25Å; A994-T997 PolarHBondContact O-N 3.39Å; A994-T997 VanDerWaalsContact O-N 3.1Å; L995-T997 PolarHBondContact O-N 3.38Å
998	S	56.7	Low	66	Low	64 Å²	64	72.6 Å²	72.6	45%	0.448	43%	0.432	S	S	.	.	H	α-helix	trans	-82.3	-32.6	172.8	64.2	0	0	0	0	112.5	A994 L995 N1000 E1037	A994-S998 PolarHBondContact O-N 3.33Å; L995-S998 PolarHBondContact O-N 3.39Å; L995-S998 PolarHBondContact O-OG 3Å; S998-N1000 PolarHBondContact O-N 2.87Å; S998-E1037 PolarHBondContact OG-OE2 2.93Å
999	A	55.3	Low	65.4	Low	30 Å²	30	74.9 Å²	74.9	25%	0.248	45%	0.451	C	S	.	.	S	Bend	trans	-80.3	105.8	169	0	0	0	0	0	111.1	L995 N1001	L995-A999 PolarHBondContact O-N 2.72Å; A999-N1001 PolarHBondContact O-N 3.29Å
1000	N	53	Low	65.3	Low	154 Å²	154	77 Å²	77	82%	0.824	47%	0.466	S	S	*	.			trans	-71.7	52.2	175.4	-81.7	-32.9	0	0	0	113.4	S998	S998-N1000 PolarHBondContact O-N 2.87Å
1001	N	51.3	Low	65.2	Low	113 Å²	113	72 Å²	72	60%	0.604	44%	0.444	S	S	*	.			trans	-111.7	88.4	173.8	-79.9	-21.2	0	0	0	109.7	A999 S1003	A999-N1001 PolarHBondContact O-N 3.29Å; N1001-S1003 PolarHBondContact O-N 2.65Å
1002	S	50.4	Low	65.2	Low	135 Å²	135	69.8 Å²	69.8	94%	0.944	43%	0.433	S	S	*	.			trans	-71	37.1	175.3	-49.5	0	0	0	0	113.3
1003	S	43.8	Very low	65.2	Low	93 Å²	93	71.8 Å²	71.8	65%	0.65	45%	0.45	S	S	*	.			trans	-138.1	29.8	-160	62.4	0	0	0	0	114.4	N1001	N1001-S1003 PolarHBondContact O-N 2.65Å
1004	S	47.9	Very low	65.4	Low	64 Å²	64	72.1 Å²	72.1	45%	0.448	45%	0.448	S	S	.	.			trans	-157.5	113.1	148.1	53.8	0	0	0	0	111.2	L1006	S1004-L1006 PolarHBondContact O-N 2.93Å
1005	S	43.8	Very low	65.8	Low	132 Å²	132	69.6 Å²	69.6	92%	0.923	43%	0.427	S	S	*	.			trans	-83.5	42.3	179.4	60.1	0	0	0	0	112.5
1006	L	57.4	Low	66.1	Low	80 Å²	80	72.5 Å²	72.5	42%	0.419	44%	0.439	S	S	.	.			trans	-82.4	119.8	175.4	-83.6	164.9	0	0	0	109.6	S1004 V1008 I1011 Y1031	S1004-L1006 PolarHBondContact O-N 2.93Å; L1006-V1008 PolarHBondContact O-N 3.22Å; L1006-I1011 HydrophobicContact CB-CD1 4.3Å; L1006-I1011 HydrophobicContact CB-CG1 4.44Å; L1006-Y1031 HydrophobicContact CD1-CE1 3.72Å
1007	D	70.9	Confident	66.6	Low	96 Å²	96	76.7 Å²	76.7	51%	0.513	46%	0.456	S	S	.	.			trans	-56.1	132.4	-178.9	-177.2	3.3	0	0	0	110.8	A1009 T1010 I1011	D1007-A1009 PolarHBondContact O-N 3.43Å; D1007-A1009 PolarHBondContact OD1-N 2.9Å; D1007-A1009 WeakPolarHBondContact OD2-CB 3.31Å; D1007-T1010 WeakPolarHBondContact O-CA 3.41Å; D1007-T1010 WeakPolarHBondContact O-CB 3.16Å; D1007-T1010 PolarHBondContact O-N 2.8Å; D1007-I1011 PolarHBondContact O-N 2.88Å
1008	V	75.3	Confident	67.3	Low	6 Å²	6	72.7 Å²	72.7	4%	0.036	43%	0.432	C	S	.	.	H	α-helix	trans	-59	-30.4	176.6	173	0	0	0	0	110.8	E989 L992 L1006 T1010 I1011 V1012	E989-V1008 HydrophobicContact CB-CG1 4.31Å; L992-V1008 HydrophobicContact CB-CG1 3.71Å; L992-V1008 HydrophobicContact CB-CG2 4.5Å; L992-V1008 HydrophobicContact CD1-CG1 4.24Å; L1006-V1008 PolarHBondContact O-N 3.22Å; V1008-T1010 VanDerWaalsContact C-N 3.34Å; V1008-T1010 PolarHBondContact O-N 3.14Å; V1008-I1011 PolarHBondContact O-N 3.05Å; V1008-V1012 HydrophobicContact CG1-CG2 4.13Å; V1008-V1012 WeakPolarHBondContact O-CB 3.31Å; V1008-V1012 WeakPolarHBondContact O-CG2 3.49Å; V1008-V1012 PolarHBondContact O-N 3.28Å
1009	A	75.5	Confident	68.2	Low	47 Å²	47	76.3 Å²	76.3	39%	0.388	44%	0.442	S	S	.	.	H	α-helix	trans	-60.6	-41.2	171.9	0	0	0	0	0	112.4	D1007 V1012 A1013	D1007-A1009 PolarHBondContact O-N 3.43Å; D1007-A1009 PolarHBondContact OD1-N 2.9Å; D1007-A1009 WeakPolarHBondContact OD2-CB 3.31Å; A1009-V1012 PolarHBondContact O-N 3.34Å; A1009-A1013 WeakPolarHBondContact O-CB 3.34Å; A1009-A1013 PolarHBondContact O-N 2.92Å
1010	T	81.1	Confident	69.4	Low	81 Å²	81	77.5 Å²	77.5	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-68.5	-44.2	176.5	-53.1	0	0	0	0	111.7	D1007 V1008 V1012 A1013 Y1014	D1007-T1010 WeakPolarHBondContact O-CA 3.41Å; D1007-T1010 WeakPolarHBondContact O-CB 3.16Å; D1007-T1010 PolarHBondContact O-N 2.8Å; V1008-T1010 VanDerWaalsContact C-N 3.34Å; V1008-T1010 PolarHBondContact O-N 3.14Å; T1010-V1012 VanDerWaalsContact C-N 3.28Å; T1010-V1012 PolarHBondContact O-N 3.21Å; T1010-A1013 PolarHBondContact O-N 3.27Å; T1010-Y1014 PolarHBondContact O-N 3.06Å
1011	I	81.4	Confident	70.8	Confident	25 Å²	25	73 Å²	73	13%	0.128	43%	0.428	C	S	.	.	H	α-helix	trans	-58.6	-42.7	175.4	-64.5	174.4	0	0	0	110.3	L992 L1006 D1007 V1008 L1015 F1027	L992-I1011 HydrophobicContact CD1-CG2 3.9Å; L992-I1011 HydrophobicContact CD2-CG2 4.35Å; L1006-I1011 HydrophobicContact CB-CD1 4.3Å; L1006-I1011 HydrophobicContact CB-CG1 4.44Å; D1007-I1011 PolarHBondContact O-N 2.88Å; V1008-I1011 PolarHBondContact O-N 3.05Å; I1011-L1015 HydrophobicContact CG2-CD1 4.09Å; I1011-L1015 WeakPolarHBondContact O-CB 3.12Å; I1011-L1015 VanDerWaalsContact O-CG 3.3Å; I1011-L1015 WeakPolarHBondContact O-CG 3.39Å; I1011-L1015 PolarHBondContact O-N 3.46Å; I1011-F1027 HydrophobicContact CG2-CE1 4.06Å
1012	V	81.8	Confident	72.4	Confident	2 Å²	2	75.7 Å²	75.7	1%	0.012	43%	0.43	C	S	.	.	H	α-helix	trans	-72.9	-33.5	178.7	174.7	0	0	0	0	112.8	T985 C988 E989 L992 V1008 A1009 T1010 K1016	T985-V1012 HydrophobicContact CG2-CG1 3.27Å; C988-V1012 HydrophobicContact CB-CG1 4.06Å; C988-V1012 HydrophobicContact CB-CG2 3.94Å; E989-V1012 HydrophobicContact CG-CB 4.47Å; E989-V1012 HydrophobicContact CG-CG1 4.43Å; E989-V1012 HydrophobicContact CG-CG2 4.04Å; L992-V1012 HydrophobicContact CD1-CG2 3.3Å; V1008-V1012 HydrophobicContact CG1-CG2 4.13Å; V1008-V1012 WeakPolarHBondContact O-CB 3.31Å; V1008-V1012 WeakPolarHBondContact O-CG2 3.49Å; V1008-V1012 PolarHBondContact O-N 3.28Å; A1009-V1012 PolarHBondContact O-N 3.34Å; T1010-V1012 VanDerWaalsContact C-N 3.28Å; T1010-V1012 PolarHBondContact O-N 3.21Å; V1012-K1016 HydrophobicContact CG1-CD 4.04Å; V1012-K1016 WeakPolarHBondContact O-CB 3.41Å; V1012-K1016 VanDerWaalsContact O-CG 3.28Å; V1012-K1016 WeakPolarHBondContact O-CG 3.5Å; V1012-K1016 PolarHBondContact O-N 3.39Å; V1012-K1016 VanDerWaalsContact O-N 3.09Å
1013	A	80.6	Confident	74.1	Confident	47 Å²	47	71.1 Å²	71.1	39%	0.388	40%	0.401	S	S	.	.	H	α-helix	trans	-61	-53.1	172	0	0	0	0	0	110.7	A1009 T1010 L1015 K1016 E1017	A1009-A1013 WeakPolarHBondContact O-CB 3.34Å; A1009-A1013 PolarHBondContact O-N 2.92Å; T1010-A1013 PolarHBondContact O-N 3.27Å; A1013-L1015 PolarHBondContact O-N 3.11Å; A1013-K1016 WeakPolarHBondContact O-CB 3.35Å; A1013-K1016 PolarHBondContact O-N 2.75Å; A1013-E1017 PolarHBondContact O-N 2.73Å; A1013-E1017 VanDerWaalsContact O-N 3.12Å
1014	Y	83.3	Confident	76.1	Confident	108 Å²	108	66.7 Å²	66.7	42%	0.424	37%	0.37	S	S	.	.	H	α-helix	trans	-57	-47.2	177.5	-178.5	-95.4	0	0	0	112.4	T1010 K1016 E1017 V1018 F1027	T1010-Y1014 PolarHBondContact O-N 3.06Å; Y1014-K1016 PolarHBondContact O-N 3.5Å; Y1014-E1017 PolarHBondContact O-N 2.89Å; Y1014-V1018 HydrophobicContact CD1-CG2 3.88Å; Y1014-V1018 HydrophobicContact CD2-CG2 4.26Å; Y1014-V1018 HydrophobicContact CE1-CG2 3.39Å; Y1014-V1018 HydrophobicContact CE2-CG2 3.83Å; Y1014-V1018 HydrophobicContact CG-CG2 4.29Å; Y1014-V1018 WeakPolarHBondContact O-CG2 2.96Å; Y1014-V1018 PolarHBondContact O-N 3.45Å; Y1014-F1027 AromaticContact CD1-CD1 3.95Å; Y1014-F1027 HydrophobicContact CD1-CD1 3.95Å; Y1014-F1027 AromaticContact CD1-CD2 3.75Å; Y1014-F1027 HydrophobicContact CD1-CD2 3.75Å; Y1014-F1027 AromaticContact CD1-CE1 3.66Å; Y1014-F1027 HydrophobicContact CD1-CE1 3.66Å; Y1014-F1027 AromaticContact CD1-CE2 3.44Å; Y1014-F1027 HydrophobicContact CD1-CE2 3.44Å; Y1014-F1027 VanDerWaalsContact CD1-CE2 3.44Å; Y1014-F1027 AromaticContact CD1-CG 3.98Å; Y1014-F1027 HydrophobicContact CD1-CG 3.98Å; Y1014-F1027 AromaticContact CD1-CZ 3.4Å; Y1014-F1027 HydrophobicContact CD1-CZ 3.4Å; Y1014-F1027 HydrophobicContact CE1-CB 4.27Å; Y1014-F1027 HydrophobicContact CE1-CD1 4.05Å; Y1014-F1027 AromaticContact CE1-CD2 3.23Å; Y1014-F1027 HydrophobicContact CE1-CD2 3.23Å; Y1014-F1027 HydrophobicContact CE1-CE1 4.15Å; Y1014-F1027 AromaticContact CE1-CE2 3.35Å; Y1014-F1027 HydrophobicContact CE1-CE2 3.35Å; Y1014-F1027 AromaticContact CE1-CG 3.6Å; Y1014-F1027 HydrophobicContact CE1-CG 3.6Å; Y1014-F1027 AromaticContact CE1-CZ 3.83Å; Y1014-F1027 HydrophobicContact CE1-CZ 3.83Å; Y1014-F1027 HydrophobicContact CG-CE2 4.27Å; Y1014-F1027 HydrophobicContact CG-CZ 4.14Å
1015	L	83.8	Confident	77.8	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-27.8	176.4	-77.7	172.9	0	0	0	113.6	L992 I1011 A1013 V1024 F1027 I1028 F1041 F1045 R1049	L992-L1015 HydrophobicContact CD1-CD1 4.11Å; I1011-L1015 HydrophobicContact CG2-CD1 4.09Å; I1011-L1015 WeakPolarHBondContact O-CB 3.12Å; I1011-L1015 VanDerWaalsContact O-CG 3.3Å; I1011-L1015 WeakPolarHBondContact O-CG 3.39Å; I1011-L1015 PolarHBondContact O-N 3.46Å; A1013-L1015 PolarHBondContact O-N 3.11Å; L1015-V1024 HydrophobicContact CD2-CG1 4.06Å; L1015-V1024 HydrophobicContact CD2-CG2 4.33Å; L1015-F1027 HydrophobicContact CD2-CD1 3.78Å; L1015-F1027 HydrophobicContact CD2-CE1 4.25Å; L1015-F1027 HydrophobicContact CG-CD1 4.14Å; L1015-F1027 HydrophobicContact CG-CE1 4.08Å; L1015-I1028 HydrophobicContact CD2-CD1 4.12Å; L1015-I1028 HydrophobicContact CD2-CG1 4.13Å; L1015-F1041 HydrophobicContact CD1-CE1 4.46Å; L1015-F1045 HydrophobicContact CB-CE1 4.33Å; L1015-F1045 HydrophobicContact CB-CE2 4.12Å; L1015-F1045 HydrophobicContact CB-CZ 3.71Å; L1015-F1045 VanDerWaalsContact O-CZ 3.29Å; L1015-F1045 WeakPolarHBondContact O-CZ 3.35Å; L1015-R1049 PolarHBondContact O-NH1 2.81Å
1016	K	78.3	Confident	79.7	Confident	71 Å²	71	64.3 Å²	64.3	31%	0.309	34%	0.341	S	S	.	.	H	α-helix	trans	-79	-27.1	175.1	-76	172.6	66.1	168.7	0	112.8	D982 T985 V1012 A1013 Y1014 R1049	D982-K1016 IonicContact OD2-NZ 3.3Å; T985-K1016 HydrophobicContact CG2-CD 3.83Å; T985-K1016 PolarHBondContact OG1-NZ 3.31Å; V1012-K1016 HydrophobicContact CG1-CD 4.04Å; V1012-K1016 WeakPolarHBondContact O-CB 3.41Å; V1012-K1016 VanDerWaalsContact O-CG 3.28Å; V1012-K1016 WeakPolarHBondContact O-CG 3.5Å; V1012-K1016 PolarHBondContact O-N 3.39Å; V1012-K1016 VanDerWaalsContact O-N 3.09Å; A1013-K1016 WeakPolarHBondContact O-CB 3.35Å; A1013-K1016 PolarHBondContact O-N 2.75Å; Y1014-K1016 PolarHBondContact O-N 3.5Å; K1016-R1049 PolarHBondContact O-NH2 3.17Å
1017	E	79	Confident	81	Confident	153 Å²	153	61.6 Å²	61.6	72%	0.715	33%	0.326	S	S	*	.	H	α-helix	trans	-84.6	-45.1	179.2	-69.9	178	178.2	0	0	113	A1013 Y1014 E1019	A1013-E1017 PolarHBondContact O-N 2.73Å; A1013-E1017 VanDerWaalsContact O-N 3.12Å; Y1014-E1017 PolarHBondContact O-N 2.89Å; E1017-E1019 PolarHBondContact O-N 3.37Å
1018	V	83.4	Confident	81.7	Confident	24 Å²	24	57.3 Å²	57.3	15%	0.145	30%	0.303	C	S	.	.			trans	-59.7	109.1	-179.8	173.4	0	0	0	0	111.1	Y1014 A1023 V1024 R1049	Y1014-V1018 HydrophobicContact CD1-CG2 3.88Å; Y1014-V1018 HydrophobicContact CD2-CG2 4.26Å; Y1014-V1018 HydrophobicContact CE1-CG2 3.39Å; Y1014-V1018 HydrophobicContact CE2-CG2 3.83Å; Y1014-V1018 HydrophobicContact CG-CG2 4.29Å; Y1014-V1018 WeakPolarHBondContact O-CG2 2.96Å; Y1014-V1018 PolarHBondContact O-N 3.45Å; V1018-A1023 HydrophobicContact CG1-CB 3.56Å; V1018-V1024 HydrophobicContact CB-CG2 4.38Å; V1018-V1024 HydrophobicContact CG1-CG2 4.06Å; V1018-R1049 PolarHBondContact O-NH1 2.9Å; V1018-R1049 PolarHBondContact O-NH2 2.91Å
1019	E	74.1	Confident	82	Confident	140 Å²	140	62.2 Å²	62.2	65%	0.654	32%	0.321	S	S	*	.			trans	-85.4	-16.9	-174.3	-170.6	155.3	-134.3	0	0	114.2	E1017 K1053	E1017-E1019 PolarHBondContact O-N 3.37Å; E1019-K1053 IonicContact OE1-NZ 2.66Å; E1019-K1053 PolarHBondContact OE1-NZ 2.85Å
1020	S	81.8	Confident	82.2	Confident	55 Å²	55	64 Å²	64	39%	0.385	33%	0.331	S	S	.	.			trans	-76.3	128.4	176.2	177.5	0	0	0	0	111.9	Y1022 V1024	S1020-Y1022 VanDerWaalsContact C-N 3.27Å; S1020-Y1022 PolarHBondContact O-N 3.17Å; S1020-Y1022 PolarHBondContact OG-N 3.32Å; S1020-V1024 PolarHBondContact O-N 3.46Å
1021	P	82.4	Confident	81.9	Confident	60 Å²	60	65.2 Å²	65.2	39%	0.39	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-24.4	178.7	29.8	-35.3	0	0	0	113	L1025 L1046	P1021-L1025 PolarHBondContact O-N 2.85Å; P1021-L1046 HydrophobicContact CB-CD1 4.05Å; P1021-L1046 HydrophobicContact CB-CD2 3.93Å
1022	Y	84.9	Confident	81.6	Confident	169 Å²	169	65.1 Å²	65.1	66%	0.663	33%	0.327	S	S	*	.	H	α-helix	trans	-76.6	-46	178	-58.4	-73.8	0	0	0	111	S1020 V1024 L1025 D1026	S1020-Y1022 VanDerWaalsContact C-N 3.27Å; S1020-Y1022 PolarHBondContact O-N 3.17Å; S1020-Y1022 PolarHBondContact OG-N 3.32Å; Y1022-V1024 PolarHBondContact O-N 3.32Å; Y1022-L1025 WeakPolarHBondContact O-CA 3.36Å; Y1022-L1025 WeakPolarHBondContact O-CB 3.26Å; Y1022-L1025 PolarHBondContact O-N 3.02Å; Y1022-D1026 PolarHBondContact O-N 2.88Å
1023	A	85.7	Confident	81.4	Confident	39 Å²	39	66.5 Å²	66.5	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-60.2	-32.6	175.5	0	0	0	0	0	112.7	V1018 F1027	V1018-A1023 HydrophobicContact CG1-CB 3.56Å; A1023-F1027 WeakPolarHBondContact O-CB 3.25Å; A1023-F1027 PolarHBondContact O-N 3.4Å
1024	V	85.9	Confident	81.4	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-41.1	170	165.8	0	0	0	0	112.2	L1015 V1018 S1020 Y1022 I1028 F1045 L1046	L1015-V1024 HydrophobicContact CD2-CG1 4.06Å; L1015-V1024 HydrophobicContact CD2-CG2 4.33Å; V1018-V1024 HydrophobicContact CB-CG2 4.38Å; V1018-V1024 HydrophobicContact CG1-CG2 4.06Å; S1020-V1024 PolarHBondContact O-N 3.46Å; Y1022-V1024 PolarHBondContact O-N 3.32Å; V1024-I1028 HydrophobicContact CG1-CD1 3.86Å; V1024-I1028 WeakPolarHBondContact O-CB 3.43Å; V1024-I1028 WeakPolarHBondContact O-CD1 3.26Å; V1024-I1028 VanDerWaalsContact O-CG1 3.26Å; V1024-I1028 WeakPolarHBondContact O-CG1 3.25Å; V1024-I1028 PolarHBondContact O-N 2.84Å; V1024-F1045 HydrophobicContact CG1-CD1 3.86Å; V1024-F1045 HydrophobicContact CG1-CE1 4.14Å; V1024-F1045 HydrophobicContact CG2-CE1 4.4Å; V1024-L1046 HydrophobicContact CB-CD2 4.24Å; V1024-L1046 HydrophobicContact CG1-CD2 4.01Å; V1024-L1046 HydrophobicContact CG1-CG 4.24Å; V1024-L1046 HydrophobicContact CG2-CD2 4.46Å
1025	L	83.3	Confident	81.4	Confident	65 Å²	65	66.1 Å²	66.1	34%	0.34	34%	0.343	S	S	.	.	H	α-helix	trans	-68.3	-44.2	178	-75.9	159.2	0	0	0	111.7	P1021 Y1022 I1028 R1029 A1042 L1046	P1021-L1025 PolarHBondContact O-N 2.85Å; Y1022-L1025 WeakPolarHBondContact O-CA 3.36Å; Y1022-L1025 WeakPolarHBondContact O-CB 3.26Å; Y1022-L1025 PolarHBondContact O-N 3.02Å; L1025-I1028 PolarHBondContact O-N 3.21Å; L1025-R1029 VanDerWaalsContact O-CB 3.28Å; L1025-R1029 WeakPolarHBondContact O-CB 3.38Å; L1025-R1029 PolarHBondContact O-N 3.48Å; L1025-A1042 HydrophobicContact CD2-CB 3.53Å; L1025-A1042 HydrophobicContact CG-CB 4.42Å; L1025-L1046 HydrophobicContact CD1-CD1 4.4Å; L1025-L1046 HydrophobicContact CG-CD1 4.34Å
1026	D	83.5	Confident	81.3	Confident	80 Å²	80	68.7 Å²	68.7	43%	0.428	36%	0.359	S	S	.	.	H	α-helix	trans	-75.5	-30.9	-177.4	-63	-46.9	0	0	0	112.6	Y1022 R1029 S1030	Y1022-D1026 PolarHBondContact O-N 2.88Å; D1026-R1029 IonicContact OD1-NH1 2.78Å; D1026-R1029 PolarHBondContact OD1-NH1 2.8Å; D1026-S1030 WeakPolarHBondContact O-CB 3.5Å; D1026-S1030 PolarHBondContact O-N 2.95Å; D1026-S1030 PolarHBondContact O-OG 2.94Å
1027	F	84.4	Confident	81.4	Confident	24 Å²	24	69.2 Å²	69.2	11%	0.105	36%	0.362	C	S	.	.	H	α-helix	trans	-65.2	-47	167.2	-176.2	-97.9	0	0	0	111.5	I1011 Y1014 L1015 A1023 R1029 S1030 Y1031	I1011-F1027 HydrophobicContact CG2-CE1 4.06Å; Y1014-F1027 AromaticContact CD1-CD1 3.95Å; Y1014-F1027 HydrophobicContact CD1-CD1 3.95Å; Y1014-F1027 AromaticContact CD1-CD2 3.75Å; Y1014-F1027 HydrophobicContact CD1-CD2 3.75Å; Y1014-F1027 AromaticContact CD1-CE1 3.66Å; Y1014-F1027 HydrophobicContact CD1-CE1 3.66Å; Y1014-F1027 AromaticContact CD1-CE2 3.44Å; Y1014-F1027 HydrophobicContact CD1-CE2 3.44Å; Y1014-F1027 VanDerWaalsContact CD1-CE2 3.44Å; Y1014-F1027 AromaticContact CD1-CG 3.98Å; Y1014-F1027 HydrophobicContact CD1-CG 3.98Å; Y1014-F1027 AromaticContact CD1-CZ 3.4Å; Y1014-F1027 HydrophobicContact CD1-CZ 3.4Å; Y1014-F1027 HydrophobicContact CE1-CB 4.27Å; Y1014-F1027 HydrophobicContact CE1-CD1 4.05Å; Y1014-F1027 AromaticContact CE1-CD2 3.23Å; Y1014-F1027 HydrophobicContact CE1-CD2 3.23Å; Y1014-F1027 HydrophobicContact CE1-CE1 4.15Å; Y1014-F1027 AromaticContact CE1-CE2 3.35Å; Y1014-F1027 HydrophobicContact CE1-CE2 3.35Å; Y1014-F1027 AromaticContact CE1-CG 3.6Å; Y1014-F1027 HydrophobicContact CE1-CG 3.6Å; Y1014-F1027 AromaticContact CE1-CZ 3.83Å; Y1014-F1027 HydrophobicContact CE1-CZ 3.83Å; Y1014-F1027 HydrophobicContact CG-CE2 4.27Å; Y1014-F1027 HydrophobicContact CG-CZ 4.14Å; L1015-F1027 HydrophobicContact CD2-CD1 3.78Å; L1015-F1027 HydrophobicContact CD2-CE1 4.25Å; L1015-F1027 HydrophobicContact CG-CD1 4.14Å; L1015-F1027 HydrophobicContact CG-CE1 4.08Å; A1023-F1027 WeakPolarHBondContact O-CB 3.25Å; A1023-F1027 PolarHBondContact O-N 3.4Å; F1027-R1029 VanDerWaalsContact C-N 3.32Å; F1027-R1029 PolarHBondContact O-N 3.06Å; F1027-S1030 WeakPolarHBondContact CA-OG 3.35Å; F1027-S1030 PolarHBondContact O-N 3.31Å; F1027-S1030 PolarHBondContact O-OG 3.3Å; F1027-S1030 VanDerWaalsContact O-OG 3.06Å; F1027-Y1031 HydrophobicContact CD1-CD2 4.38Å; F1027-Y1031 AromaticContact CD2-CD2 3.75Å; F1027-Y1031 HydrophobicContact CD2-CD2 3.75Å; F1027-Y1031 AromaticContact CD2-CE2 3.48Å; F1027-Y1031 HydrophobicContact CD2-CE2 3.48Å; F1027-Y1031 VanDerWaalsContact CD2-CE2 3.48Å; F1027-Y1031 HydrophobicContact CE1-CD2 4.3Å; F1027-Y1031 AromaticContact CE2-CD2 3.65Å; F1027-Y1031 HydrophobicContact CE2-CD2 3.65Å; F1027-Y1031 HydrophobicContact CE2-CE1 4.4Å; F1027-Y1031 AromaticContact CE2-CE2 3.14Å; F1027-Y1031 HydrophobicContact CE2-CE2 3.14Å; F1027-Y1031 HydrophobicContact CE2-CG 4.46Å; F1027-Y1031 AromaticContact CE2-CZ 3.58Å; F1027-Y1031 HydrophobicContact CG-CD2 4.13Å; F1027-Y1031 HydrophobicContact CG-CE2 4.32Å; F1027-Y1031 AromaticContact CZ-CD2 3.94Å; F1027-Y1031 HydrophobicContact CZ-CD2 3.94Å; F1027-Y1031 HydrophobicContact CZ-CE1 4.34Å; F1027-Y1031 AromaticContact CZ-CE2 3.75Å; F1027-Y1031 HydrophobicContact CZ-CE2 3.75Å; F1027-Y1031 HydrophobicContact CZ-CG 4.32Å; F1027-Y1031 AromaticContact CZ-CZ 3.95Å; F1027-Y1031 WeakPolarHBondContact O-CD2 3.36Å; F1027-Y1031 PolarHBondContact O-N 2.69Å
1028	I	85.3	Confident	81.7	Confident	5 Å²	5	62 Å²	62	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-62.6	-40.1	176.4	-74.4	167.7	0	0	0	111.2	L1015 V1024 L1025 L1032 A1038 F1041 A1042	L1015-I1028 HydrophobicContact CD2-CD1 4.12Å; L1015-I1028 HydrophobicContact CD2-CG1 4.13Å; V1024-I1028 HydrophobicContact CG1-CD1 3.86Å; V1024-I1028 WeakPolarHBondContact O-CB 3.43Å; V1024-I1028 WeakPolarHBondContact O-CD1 3.26Å; V1024-I1028 VanDerWaalsContact O-CG1 3.26Å; V1024-I1028 WeakPolarHBondContact O-CG1 3.25Å; V1024-I1028 PolarHBondContact O-N 2.84Å; L1025-I1028 PolarHBondContact O-N 3.21Å; I1028-L1032 HydrophobicContact CG2-CD1 4.24Å; I1028-L1032 WeakPolarHBondContact O-CB 3.32Å; I1028-L1032 PolarHBondContact O-N 2.81Å; I1028-A1038 HydrophobicContact CG2-CB 3.86Å; I1028-A1038 WeakPolarHBondContact CG2-O 3.37Å; I1028-F1041 HydrophobicContact CD1-CD1 3.82Å; I1028-F1041 HydrophobicContact CD1-CE1 3.63Å; I1028-F1041 HydrophobicContact CG1-CD1 4.36Å; I1028-F1041 HydrophobicContact CG1-CE1 4.15Å; I1028-F1041 HydrophobicContact CG2-CD1 4.33Å; I1028-A1042 HydrophobicContact CB-CB 4.4Å; I1028-A1042 HydrophobicContact CD1-CB 3.56Å; I1028-A1042 HydrophobicContact CG2-CB 4.16Å
1029	R	83.1	Confident	81.8	Confident	109 Å²	109	65 Å²	65	41%	0.411	34%	0.339	S	S	.	.	H	α-helix	trans	-62.4	-38.7	174.3	162.4	-176.8	-83.8	144	-6.4	113.5	L1025 D1026 F1027 G1033 D1034	L1025-R1029 VanDerWaalsContact O-CB 3.28Å; L1025-R1029 WeakPolarHBondContact O-CB 3.38Å; L1025-R1029 PolarHBondContact O-N 3.48Å; D1026-R1029 IonicContact OD1-NH1 2.78Å; D1026-R1029 PolarHBondContact OD1-NH1 2.8Å; F1027-R1029 VanDerWaalsContact C-N 3.32Å; F1027-R1029 PolarHBondContact O-N 3.06Å; R1029-G1033 CarbonylContact O-C 3.21Å; R1029-G1033 WeakPolarHBondContact O-CA 3.22Å; R1029-G1033 PolarHBondContact O-N 2.81Å; R1029-G1033 VanDerWaalsContact O-N 3.11Å; R1029-D1034 IonicContact CZ-OD1 3.5Å; R1029-D1034 IonicContact CZ-OD2 3.61Å; R1029-D1034 VanDerWaalsContact NE-CG 3.29Å; R1029-D1034 IonicContact NE-OD1 3.64Å; R1029-D1034 PolarHBondContact NE-OD1 3.36Å; R1029-D1034 IonicContact NE-OD2 2.76Å; R1029-D1034 PolarHBondContact NE-OD2 2.98Å; R1029-D1034 IonicContact NH2-OD1 3.32Å; R1029-D1034 PolarHBondContact NH2-OD1 3.36Å; R1029-D1034 IonicContact NH2-OD2 3.67Å; R1029-D1034 PolarHBondContact NH2-OD2 3.48Å
1030	S	79.2	Confident	82.3	Confident	86 Å²	86	60.1 Å²	60.1	60%	0.601	32%	0.317	S	S	*	.	H	α-helix	trans	-78.3	-32	-178.2	43	0	0	0	0	112.8	D1026 F1027	D1026-S1030 WeakPolarHBondContact O-CB 3.5Å; D1026-S1030 PolarHBondContact O-N 2.95Å; D1026-S1030 PolarHBondContact O-OG 2.94Å; F1027-S1030 WeakPolarHBondContact CA-OG 3.35Å; F1027-S1030 PolarHBondContact O-N 3.31Å; F1027-S1030 PolarHBondContact O-OG 3.3Å; F1027-S1030 VanDerWaalsContact O-OG 3.06Å
1031	Y	74.3	Confident	82.6	Confident	105 Å²	105	57.5 Å²	57.5	41%	0.412	30%	0.299	S	S	.	.	H	α-helix	trans	-90.8	-33.9	-179.8	-79.2	-103	0	0	0	114.3	L1006 F1027	L1006-Y1031 HydrophobicContact CD1-CE1 3.72Å; F1027-Y1031 HydrophobicContact CD1-CD2 4.38Å; F1027-Y1031 AromaticContact CD2-CD2 3.75Å; F1027-Y1031 HydrophobicContact CD2-CD2 3.75Å; F1027-Y1031 AromaticContact CD2-CE2 3.48Å; F1027-Y1031 HydrophobicContact CD2-CE2 3.48Å; F1027-Y1031 VanDerWaalsContact CD2-CE2 3.48Å; F1027-Y1031 HydrophobicContact CE1-CD2 4.3Å; F1027-Y1031 AromaticContact CE2-CD2 3.65Å; F1027-Y1031 HydrophobicContact CE2-CD2 3.65Å; F1027-Y1031 HydrophobicContact CE2-CE1 4.4Å; F1027-Y1031 AromaticContact CE2-CE2 3.14Å; F1027-Y1031 HydrophobicContact CE2-CE2 3.14Å; F1027-Y1031 HydrophobicContact CE2-CG 4.46Å; F1027-Y1031 AromaticContact CE2-CZ 3.58Å; F1027-Y1031 HydrophobicContact CG-CD2 4.13Å; F1027-Y1031 HydrophobicContact CG-CE2 4.32Å; F1027-Y1031 AromaticContact CZ-CD2 3.94Å; F1027-Y1031 HydrophobicContact CZ-CD2 3.94Å; F1027-Y1031 HydrophobicContact CZ-CE1 4.34Å; F1027-Y1031 AromaticContact CZ-CE2 3.75Å; F1027-Y1031 HydrophobicContact CZ-CE2 3.75Å; F1027-Y1031 HydrophobicContact CZ-CG 4.32Å; F1027-Y1031 AromaticContact CZ-CZ 3.95Å; F1027-Y1031 WeakPolarHBondContact O-CD2 3.36Å; F1027-Y1031 PolarHBondContact O-N 2.69Å
1032	L	75.2	Confident	83	Confident	23 Å²	23	54.7 Å²	54.7	12%	0.12	28%	0.28	C	S	.	.	H	α-helix	trans	-116	9.6	-176.2	-62.3	160.9	0	0	0	112.9	L992 L995 I1028 T1035 A1038	L992-L1032 HydrophobicContact CD2-CD1 3.59Å; L995-L1032 HydrophobicContact CB-CD2 4.09Å; L995-L1032 HydrophobicContact CD1-CD1 4.34Å; I1028-L1032 HydrophobicContact CG2-CD1 4.24Å; I1028-L1032 WeakPolarHBondContact O-CB 3.32Å; I1028-L1032 PolarHBondContact O-N 2.81Å; L1032-T1035 PolarHBondContact O-OG1 2.96Å; L1032-A1038 HydrophobicContact CB-CB 3.82Å
1033	G	78.2	Confident	83.1	Confident	32 Å²	32	52.7 Å²	52.7	33%	0.33	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	71	175.7	-177.3	0	0	0	0	0	113.9	R1029 T1035	R1029-G1033 CarbonylContact O-C 3.21Å; R1029-G1033 WeakPolarHBondContact O-CA 3.22Å; R1029-G1033 PolarHBondContact O-N 2.81Å; R1029-G1033 VanDerWaalsContact O-N 3.11Å; G1033-T1035 PolarHBondContact O-N 3.08Å
1034	D	81	Confident	83.1	Confident	83 Å²	83	52.9 Å²	52.9	44%	0.444	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	27.5	175.6	-125.6	-48.5	0	0	0	112.5	R1029 K1039	R1029-D1034 IonicContact CZ-OD1 3.5Å; R1029-D1034 IonicContact CZ-OD2 3.61Å; R1029-D1034 VanDerWaalsContact NE-CG 3.29Å; R1029-D1034 IonicContact NE-OD1 3.64Å; R1029-D1034 PolarHBondContact NE-OD1 3.36Å; R1029-D1034 IonicContact NE-OD2 2.76Å; R1029-D1034 PolarHBondContact NE-OD2 2.98Å; R1029-D1034 IonicContact NH2-OD1 3.32Å; R1029-D1034 PolarHBondContact NH2-OD1 3.36Å; R1029-D1034 IonicContact NH2-OD2 3.67Å; R1029-D1034 PolarHBondContact NH2-OD2 3.48Å; D1034-K1039 PolarHBondContact O-NZ 3.19Å; D1034-K1039 WeakPolarHBondContact OD1-CE 3.22Å; D1034-K1039 IonicContact OD1-NZ 3.03Å; D1034-K1039 PolarHBondContact OD1-NZ 3.19Å
1035	T	81.7	Confident	83.3	Confident	63 Å²	63	52.8 Å²	52.8	39%	0.387	27%	0.269	S	S	.	.			trans	-66.7	150.6	-178.9	64.4	0	0	0	0	111.2	L1032 G1033 A1038 K1039	L1032-T1035 PolarHBondContact O-OG1 2.96Å; G1033-T1035 PolarHBondContact O-N 3.08Å; T1035-A1038 PolarHBondContact O-N 2.91Å; T1035-A1038 WeakPolarHBondContact OG1-CB 3.27Å; T1035-A1038 PolarHBondContact OG1-N 3.45Å; T1035-K1039 WeakPolarHBondContact O-CG 3.24Å; T1035-K1039 PolarHBondContact O-N 3.5Å
1036	V	81.7	Confident	83.5	Confident	56 Å²	56	51.7 Å²	51.7	34%	0.339	26%	0.263	S	S	.	.	H	α-helix	trans	-80.2	-27.8	-176.3	-165.2	0	0	0	0	111.4	A1038 K1039 E1040 D1125 P1126	V1036-A1038 PolarHBondContact O-N 3.32Å; V1036-K1039 HydrophobicContact CG2-CD 4.45Å; V1036-K1039 PolarHBondContact O-N 3.02Å; V1036-E1040 PolarHBondContact O-N 3.02Å; V1036-D1125 VanDerWaalsContact CB-OD1 3.3Å; V1036-D1125 WeakPolarHBondContact CB-OD1 3.3Å; V1036-D1125 WeakPolarHBondContact CB-OD2 3.48Å; V1036-D1125 WeakPolarHBondContact CG1-OD1 3.33Å; V1036-P1126 HydrophobicContact CG2-CG 4.11Å
1037	E	82.1	Confident	83.8	Confident	82 Å²	82	52.8 Å²	52.8	38%	0.383	27%	0.266	S	S	.	.	H	α-helix	trans	-53.7	-50.4	162.4	-53.9	-165.4	141.8	0	0	112.1	L995 S998 E1040 F1041 H1123	L995-E1037 HydrophobicContact CD2-CB 3.51Å; S998-E1037 PolarHBondContact OG-OE2 2.93Å; E1037-E1040 PolarHBondContact O-N 2.92Å; E1037-F1041 WeakPolarHBondContact O-CB 3.48Å; E1037-F1041 PolarHBondContact O-N 2.92Å; E1037-H1123 PolarHBondContact O-CE1 2.65Å
1038	A	85.7	Confident	83.8	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.008	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-38.3	178.2	0	0	0	0	0	112.5	I1028 L1032 T1035 V1036 F1041 A1042	I1028-A1038 HydrophobicContact CG2-CB 3.86Å; I1028-A1038 WeakPolarHBondContact CG2-O 3.37Å; L1032-A1038 HydrophobicContact CB-CB 3.82Å; T1035-A1038 PolarHBondContact O-N 2.91Å; T1035-A1038 WeakPolarHBondContact OG1-CB 3.27Å; T1035-A1038 PolarHBondContact OG1-N 3.45Å; V1036-A1038 PolarHBondContact O-N 3.32Å; A1038-F1041 PolarHBondContact O-N 2.94Å; A1038-A1042 PolarHBondContact O-N 3.39Å
1039	K	84.6	Confident	83.8	Confident	86 Å²	86	57.8 Å²	57.8	37%	0.374	28%	0.283	S	S	.	.	H	α-helix	trans	-60.5	-45.4	174.1	-75.8	163.1	172.1	143.1	0	112.4	D1034 T1035 V1036 A1042 K1043	D1034-K1039 PolarHBondContact O-NZ 3.19Å; D1034-K1039 WeakPolarHBondContact OD1-CE 3.22Å; D1034-K1039 IonicContact OD1-NZ 3.03Å; D1034-K1039 PolarHBondContact OD1-NZ 3.19Å; T1035-K1039 WeakPolarHBondContact O-CG 3.24Å; T1035-K1039 PolarHBondContact O-N 3.5Å; V1036-K1039 HydrophobicContact CG2-CD 4.45Å; V1036-K1039 PolarHBondContact O-N 3.02Å; K1039-A1042 PolarHBondContact O-N 3.08Å; K1039-K1043 WeakPolarHBondContact O-CB 3.49Å; K1039-K1043 PolarHBondContact O-N 3.19Å
1040	E	85.5	Confident	83.9	Confident	39 Å²	39	55.6 Å²	55.6	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-77.7	-24.6	178.3	-172.5	142.2	-126.7	0	0	112.7	V1036 E1037 K1043 Q1044 H1123	V1036-E1040 PolarHBondContact O-N 3.02Å; E1037-E1040 PolarHBondContact O-N 2.92Å; E1040-K1043 HydrophobicContact CG-CD 4.2Å; E1040-K1043 VanDerWaalsContact OE1-CE 3.31Å; E1040-K1043 WeakPolarHBondContact OE1-CE 3.26Å; E1040-K1043 IonicContact OE1-NZ 3.63Å; E1040-K1043 PolarHBondContact OE1-NZ 2.91Å; E1040-Q1044 WeakPolarHBondContact O-CG 3.27Å; E1040-Q1044 PolarHBondContact O-N 2.77Å; E1040-H1123 WeakPolarHBondContact OE2-CB 3.38Å; E1040-H1123 IonicContact OE2-CD2 3.31Å; E1040-H1123 IonicContact OE2-CG 2.65Å; E1040-H1123 VanDerWaalsContact OE2-CG 3.3Å; E1040-H1123 IonicContact OE2-ND1 3.02Å
1041	F	87.9	Confident	84.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-51.8	163.6	167.4	-114	0	0	0	111.9	W987 M991 L992 L995 L1015 I1028 E1037 A1038 K1043 Q1044 F1045	W987-F1041 AromaticContact CH2-CD2 3.9Å; W987-F1041 HydrophobicContact CH2-CD2 3.9Å; W987-F1041 AromaticContact CH2-CE2 3.9Å; W987-F1041 HydrophobicContact CH2-CE2 3.9Å; W987-F1041 HydrophobicContact CZ2-CD2 4.36Å; W987-F1041 HydrophobicContact CZ3-CE2 4.13Å; M991-F1041 HydrophobicContact CB-CD2 4.04Å; M991-F1041 HydrophobicContact CB-CE2 4.04Å; M991-F1041 HydrophobicContact CG-CD2 3.49Å; M991-F1041 VanDerWaalsContact CG-CD2 3.49Å; M991-F1041 HydrophobicContact CG-CE2 4.02Å; M991-F1041 HydrophobicContact CG-CG 4.24Å; L992-F1041 HydrophobicContact CD1-CE1 4.48Å; L992-F1041 HydrophobicContact CD1-CZ 4.06Å; L992-F1041 HydrophobicContact CD2-CD1 4.28Å; L992-F1041 HydrophobicContact CD2-CE1 3.52Å; L992-F1041 HydrophobicContact CD2-CZ 3.83Å; L992-F1041 HydrophobicContact CG-CE1 3.96Å; L992-F1041 HydrophobicContact CG-CE2 4.45Å; L992-F1041 HydrophobicContact CG-CZ 3.7Å; L995-F1041 HydrophobicContact CD1-CB 3.65Å; L995-F1041 HydrophobicContact CD1-CD1 3.92Å; L995-F1041 HydrophobicContact CD1-CD2 4.36Å; L995-F1041 HydrophobicContact CD1-CG 3.7Å; L1015-F1041 HydrophobicContact CD1-CE1 4.46Å; I1028-F1041 HydrophobicContact CD1-CD1 3.82Å; I1028-F1041 HydrophobicContact CD1-CE1 3.63Å; I1028-F1041 HydrophobicContact CG1-CD1 4.36Å; I1028-F1041 HydrophobicContact CG1-CE1 4.15Å; I1028-F1041 HydrophobicContact CG2-CD1 4.33Å; E1037-F1041 WeakPolarHBondContact O-CB 3.48Å; E1037-F1041 PolarHBondContact O-N 2.92Å; A1038-F1041 PolarHBondContact O-N 2.94Å; F1041-K1043 VanDerWaalsContact C-N 3.3Å; F1041-K1043 PolarHBondContact O-N 3.22Å; F1041-Q1044 PolarHBondContact O-N 3.25Å; F1041-Q1044 VanDerWaalsContact O-N 3.12Å; F1041-F1045 HydrophobicContact CE2-CB 4.41Å; F1041-F1045 HydrophobicContact CZ-CB 4.5Å; F1041-F1045 HydrophobicContact CZ-CD2 4.25Å; F1041-F1045 WeakPolarHBondContact O-CB 3.47Å; F1041-F1045 PolarHBondContact O-N 3.43Å
1042	A	89.1	Confident	84.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-57.6	-43.1	177.7	0	0	0	0	0	112	L1025 I1028 A1038 K1039 F1045 L1046	L1025-A1042 HydrophobicContact CD2-CB 3.53Å; L1025-A1042 HydrophobicContact CG-CB 4.42Å; I1028-A1042 HydrophobicContact CB-CB 4.4Å; I1028-A1042 HydrophobicContact CD1-CB 3.56Å; I1028-A1042 HydrophobicContact CG2-CB 4.16Å; A1038-A1042 PolarHBondContact O-N 3.39Å; K1039-A1042 PolarHBondContact O-N 3.08Å; A1042-F1045 PolarHBondContact O-N 3.22Å; A1042-L1046 WeakPolarHBondContact O-CB 3.27Å; A1042-L1046 WeakPolarHBondContact O-CG 3.42Å; A1042-L1046 PolarHBondContact O-N 2.79Å
1043	K	87.5	Confident	84.6	Confident	128 Å²	128	60.2 Å²	60.2	56%	0.557	30%	0.3	S	S	*	.	H	α-helix	trans	-57.7	-48.1	173.2	178	-176.6	169	-167.1	0	112.3	K1039 E1040 F1041 E1047	K1039-K1043 WeakPolarHBondContact O-CB 3.49Å; K1039-K1043 PolarHBondContact O-N 3.19Å; E1040-K1043 HydrophobicContact CG-CD 4.2Å; E1040-K1043 VanDerWaalsContact OE1-CE 3.31Å; E1040-K1043 WeakPolarHBondContact OE1-CE 3.26Å; E1040-K1043 IonicContact OE1-NZ 3.63Å; E1040-K1043 PolarHBondContact OE1-NZ 2.91Å; F1041-K1043 VanDerWaalsContact C-N 3.3Å; F1041-K1043 PolarHBondContact O-N 3.22Å; K1043-E1047 WeakPolarHBondContact O-CB 3.36Å; K1043-E1047 PolarHBondContact O-N 3.48Å
1044	Q	86.4	Confident	84.8	Confident	42 Å²	42	61 Å²	61	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-67.6	-38	176.7	-76.3	-160.6	42.8	0	0	112.8	W987 E1040 F1041 E1047 R1048 H1123	W987-Q1044 HydrophobicContact CH2-CB 3.7Å; W987-Q1044 HydrophobicContact CZ2-CB 3.95Å; E1040-Q1044 WeakPolarHBondContact O-CG 3.27Å; E1040-Q1044 PolarHBondContact O-N 2.77Å; F1041-Q1044 PolarHBondContact O-N 3.25Å; F1041-Q1044 VanDerWaalsContact O-N 3.12Å; Q1044-E1047 PolarHBondContact O-N 3.47Å; Q1044-R1048 WeakPolarHBondContact O-CB 3.5Å; Q1044-R1048 VanDerWaalsContact O-CG 3.27Å; Q1044-R1048 WeakPolarHBondContact O-CG 3.48Å; Q1044-R1048 PolarHBondContact O-N 3.39Å; Q1044-H1123 PolarHBondContact NE2-CD2 3.13Å; Q1044-H1123 PolarHBondContact NE2-NE2 3.1Å
1045	F	88.7	Confident	84.8	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.9	-51.5	176.9	179.9	-90.3	0	0	0	110.5	F984 W987 C988 L1015 V1024 F1041 A1042 E1047 R1048 R1049	F984-F1045 AromaticContact CE1-CE2 3.97Å; F984-F1045 HydrophobicContact CE1-CE2 3.97Å; F984-F1045 HydrophobicContact CE1-CZ 4.28Å; F984-F1045 HydrophobicContact CE2-CD2 4.09Å; F984-F1045 HydrophobicContact CE2-CE2 4.32Å; F984-F1045 AromaticContact CZ-CD2 3.59Å; F984-F1045 HydrophobicContact CZ-CD2 3.59Å; F984-F1045 AromaticContact CZ-CE2 3.43Å; F984-F1045 HydrophobicContact CZ-CE2 3.43Å; F984-F1045 VanDerWaalsContact CZ-CE2 3.43Å; F984-F1045 HydrophobicContact CZ-CG 4.2Å; F984-F1045 AromaticContact CZ-CZ 3.93Å; F984-F1045 HydrophobicContact CZ-CZ 3.93Å; W987-F1045 HydrophobicContact CZ3-CB 4.45Å; C988-F1045 HydrophobicContact CB-CE2 4.49Å; C988-F1045 VanDerWaalsContact SG-CD2 3.52Å; C988-F1045 VanDerWaalsContact SG-CE2 3.54Å; L1015-F1045 HydrophobicContact CB-CE1 4.33Å; L1015-F1045 HydrophobicContact CB-CE2 4.12Å; L1015-F1045 HydrophobicContact CB-CZ 3.71Å; L1015-F1045 VanDerWaalsContact O-CZ 3.29Å; L1015-F1045 WeakPolarHBondContact O-CZ 3.35Å; V1024-F1045 HydrophobicContact CG1-CD1 3.86Å; V1024-F1045 HydrophobicContact CG1-CE1 4.14Å; V1024-F1045 HydrophobicContact CG2-CE1 4.4Å; F1041-F1045 HydrophobicContact CE2-CB 4.41Å; F1041-F1045 HydrophobicContact CZ-CB 4.5Å; F1041-F1045 HydrophobicContact CZ-CD2 4.25Å; F1041-F1045 WeakPolarHBondContact O-CB 3.47Å; F1041-F1045 PolarHBondContact O-N 3.43Å; A1042-F1045 PolarHBondContact O-N 3.22Å; F1045-E1047 PolarHBondContact O-N 2.84Å; F1045-R1048 PolarHBondContact O-N 2.99Å; F1045-R1049 VanDerWaalsContact O-CB 3.25Å; F1045-R1049 WeakPolarHBondContact O-CB 3.17Å; F1045-R1049 PolarHBondContact O-N 3.21Å
1046	L	89.3	Confident	84.6	Confident	42 Å²	42	64.1 Å²	64.1	22%	0.22	31%	0.314	C	S	.	.	H	α-helix	trans	-62.7	-41.3	176.7	-67.8	174.5	0	0	0	112.1	P1021 V1024 L1025 A1042 A1050	P1021-L1046 HydrophobicContact CB-CD1 4.05Å; P1021-L1046 HydrophobicContact CB-CD2 3.93Å; V1024-L1046 HydrophobicContact CB-CD2 4.24Å; V1024-L1046 HydrophobicContact CG1-CD2 4.01Å; V1024-L1046 HydrophobicContact CG1-CG 4.24Å; V1024-L1046 HydrophobicContact CG2-CD2 4.46Å; L1025-L1046 HydrophobicContact CD1-CD1 4.4Å; L1025-L1046 HydrophobicContact CG-CD1 4.34Å; A1042-L1046 WeakPolarHBondContact O-CB 3.27Å; A1042-L1046 WeakPolarHBondContact O-CG 3.42Å; A1042-L1046 PolarHBondContact O-N 2.79Å; L1046-A1050 WeakPolarHBondContact O-CB 3.36Å; L1046-A1050 PolarHBondContact O-N 2.94Å
1047	E	88.6	Confident	84.3	Confident	103 Å²	103	66.9 Å²	66.9	48%	0.481	32%	0.323	S	S	.	.	H	α-helix	trans	-64.7	-42.6	177.7	-158.4	-152.7	-178.1	0	0	112.2	K1043 Q1044 F1045 K1051	K1043-E1047 WeakPolarHBondContact O-CB 3.36Å; K1043-E1047 PolarHBondContact O-N 3.48Å; Q1044-E1047 PolarHBondContact O-N 3.47Å; F1045-E1047 PolarHBondContact O-N 2.84Å; E1047-K1051 WeakPolarHBondContact O-CB 3.32Å; E1047-K1051 WeakPolarHBondContact O-CD 3.34Å; E1047-K1051 VanDerWaalsContact O-CG 3.26Å; E1047-K1051 WeakPolarHBondContact O-CG 3.41Å; E1047-K1051 PolarHBondContact O-N 2.95Å; E1047-K1051 WeakPolarHBondContact OE1-CE 3.46Å; E1047-K1051 IonicContact OE1-NZ 2.7Å; E1047-K1051 PolarHBondContact OE1-NZ 3.46Å; E1047-K1051 IonicContact OE2-NZ 2.64Å; E1047-K1051 PolarHBondContact OE2-NZ 3.4Å
1048	R	85.4	Confident	84.1	Confident	87 Å²	87	70.6 Å²	70.6	33%	0.328	33%	0.334	S	S	.	.	H	α-helix	trans	-68.9	-42.9	177.7	-71.6	175.5	-168.6	-137	9.7	111.8	F984 W987 Q1044 F1045 K1051 Q1052	F984-R1048 HydrophobicContact CD2-CB 3.76Å; F984-R1048 HydrophobicContact CE2-CB 3.54Å; W987-R1048 VanDerWaalsContact CD2-CZ 3.42Å; W987-R1048 VanDerWaalsContact CE2-NH2 3.32Å; Q1044-R1048 WeakPolarHBondContact O-CB 3.5Å; Q1044-R1048 VanDerWaalsContact O-CG 3.27Å; Q1044-R1048 WeakPolarHBondContact O-CG 3.48Å; Q1044-R1048 PolarHBondContact O-N 3.39Å; F1045-R1048 PolarHBondContact O-N 2.99Å; R1048-K1051 WeakPolarHBondContact O-CB 3.46Å; R1048-K1051 PolarHBondContact O-N 3.19Å; R1048-Q1052 PolarHBondContact O-N 3.22Å
1049	R	84	Confident	83.4	Confident	47 Å²	47	76.1 Å²	76.1	18%	0.177	36%	0.359	C	S	.	.	H	α-helix	trans	-63.5	-40.9	176	-165.9	173.8	-178.7	-155.3	3.4	111.7	F984 L1015 K1016 V1018 F1045 Q1052 K1053	F984-R1049 HydrophobicContact CE1-CB 4.34Å; F984-R1049 HydrophobicContact CE1-CG 4.49Å; F984-R1049 HydrophobicContact CZ-CB 3.98Å; L1015-R1049 PolarHBondContact O-NH1 2.81Å; K1016-R1049 PolarHBondContact O-NH2 3.17Å; V1018-R1049 PolarHBondContact O-NH1 2.9Å; V1018-R1049 PolarHBondContact O-NH2 2.91Å; F1045-R1049 VanDerWaalsContact O-CB 3.25Å; F1045-R1049 WeakPolarHBondContact O-CB 3.17Å; F1045-R1049 PolarHBondContact O-N 3.21Å; R1049-Q1052 PolarHBondContact O-N 3.34Å; R1049-K1053 WeakPolarHBondContact O-CB 3.21Å; R1049-K1053 PolarHBondContact O-N 2.93Å
1050	A	85.6	Confident	82.5	Confident	62 Å²	62	77.8 Å²	77.8	51%	0.512	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-42.5	172.8	0	0	0	0	0	112.2	L1046 A1054	L1046-A1050 WeakPolarHBondContact O-CB 3.36Å; L1046-A1050 PolarHBondContact O-N 2.94Å; A1050-A1054 VanDerWaalsContact O-CB 3.27Å; A1050-A1054 WeakPolarHBondContact O-CB 3.32Å; A1050-A1054 PolarHBondContact O-N 2.86Å
1051	K	84.1	Confident	81.4	Confident	114 Å²	114	80.5 Å²	80.5	50%	0.496	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-42.6	172.9	-74.4	164.9	-177.8	168.2	0	111.8	E1047 R1048 A1054 N1055	E1047-K1051 WeakPolarHBondContact O-CB 3.32Å; E1047-K1051 WeakPolarHBondContact O-CD 3.34Å; E1047-K1051 VanDerWaalsContact O-CG 3.26Å; E1047-K1051 WeakPolarHBondContact O-CG 3.41Å; E1047-K1051 PolarHBondContact O-N 2.95Å; E1047-K1051 WeakPolarHBondContact OE1-CE 3.46Å; E1047-K1051 IonicContact OE1-NZ 2.7Å; E1047-K1051 PolarHBondContact OE1-NZ 3.46Å; E1047-K1051 IonicContact OE2-NZ 2.64Å; E1047-K1051 PolarHBondContact OE2-NZ 3.4Å; R1048-K1051 WeakPolarHBondContact O-CB 3.46Å; R1048-K1051 PolarHBondContact O-N 3.19Å; K1051-A1054 PolarHBondContact O-N 3.1Å; K1051-N1055 WeakPolarHBondContact O-CB 3.24Å; K1051-N1055 PolarHBondContact O-N 2.78Å
1052	Q	78.9	Confident	79.9	Confident	76 Å²	76	86.4 Å²	86.4	36%	0.355	41%	0.408	S	S	.	.	H	α-helix	trans	-63.1	-50.1	177.3	-170.1	176.3	4.3	0	0	111.3	F984 R1048 R1049 A1054 N1055 Q1056	F984-Q1052 VanDerWaalsContact CD1-OE1 3.22Å; R1048-Q1052 PolarHBondContact O-N 3.22Å; R1049-Q1052 PolarHBondContact O-N 3.34Å; Q1052-A1054 VanDerWaalsContact C-N 3.34Å; Q1052-A1054 PolarHBondContact O-N 2.88Å; Q1052-N1055 PolarHBondContact O-N 2.99Å; Q1052-N1055 VanDerWaalsContact O-N 3.11Å; Q1052-Q1056 WeakPolarHBondContact O-CB 3.48Å; Q1052-Q1056 PolarHBondContact O-N 3.14Å
1053	K	81.7	Confident	77.8	Confident	121 Å²	121	91.7 Å²	91.7	53%	0.526	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-40.7	177.5	-163.3	168	-175.4	177.3	0	111.9	E1019 R1049 N1055 Q1057	E1019-K1053 IonicContact OE1-NZ 2.66Å; E1019-K1053 PolarHBondContact OE1-NZ 2.85Å; R1049-K1053 WeakPolarHBondContact O-CB 3.21Å; R1049-K1053 PolarHBondContact O-N 2.93Å; K1053-N1055 PolarHBondContact O-N 3.26Å; K1053-Q1057 WeakPolarHBondContact O-CB 3.21Å; K1053-Q1057 PolarHBondContact O-N 2.81Å
1054	A	81.9	Confident	75.8	Confident	48 Å²	48	89.2 Å²	89.2	40%	0.397	44%	0.435	S	S	.	.	H	α-helix	trans	-66.6	-33.5	174.5	0	0	0	0	0	113.5	A1050 K1051 Q1052 R1058	A1050-A1054 VanDerWaalsContact O-CB 3.27Å; A1050-A1054 WeakPolarHBondContact O-CB 3.32Å; A1050-A1054 PolarHBondContact O-N 2.86Å; K1051-A1054 PolarHBondContact O-N 3.1Å; Q1052-A1054 VanDerWaalsContact C-N 3.34Å; Q1052-A1054 PolarHBondContact O-N 2.88Å; A1054-R1058 WeakPolarHBondContact O-CG 3.31Å; A1054-R1058 PolarHBondContact O-N 3.42Å
1055	N	80.4	Confident	73.8	Confident	96 Å²	96	94.1 Å²	94.1	51%	0.513	46%	0.456	S	S	.	.	H	α-helix	trans	-77.2	-36.8	178	-141.1	34.4	0	0	0	111.8	K1051 Q1052 K1053 R1058 Q1059	K1051-N1055 WeakPolarHBondContact O-CB 3.24Å; K1051-N1055 PolarHBondContact O-N 2.78Å; Q1052-N1055 PolarHBondContact O-N 2.99Å; Q1052-N1055 VanDerWaalsContact O-N 3.11Å; K1053-N1055 PolarHBondContact O-N 3.26Å; N1055-R1058 WeakPolarHBondContact O-CB 3.39Å; N1055-R1058 PolarHBondContact O-N 2.94Å; N1055-Q1059 PolarHBondContact O-N 3.34Å
1056	Q	76.9	Confident	71.3	Confident	117 Å²	117	99.7 Å²	99.7	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-62.9	-42.6	170.8	-171.6	-179.8	52.2	0	0	111.3	Q1052 R1058 Q1059 Q1060	Q1052-Q1056 WeakPolarHBondContact O-CB 3.48Å; Q1052-Q1056 PolarHBondContact O-N 3.14Å; Q1056-R1058 VanDerWaalsContact C-N 3.27Å; Q1056-R1058 PolarHBondContact O-N 2.99Å; Q1056-Q1059 PolarHBondContact O-N 3.19Å; Q1056-Q1059 VanDerWaalsContact O-N 3.13Å; Q1056-Q1060 PolarHBondContact O-N 3.46Å
1057	Q	76.7	Confident	68.9	Low	113 Å²	113	103.3 Å²	103.3	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-31.9	173.4	-165.7	178.3	47	0	0	112.2	K1053 Q1061	K1053-Q1057 WeakPolarHBondContact O-CB 3.21Å; K1053-Q1057 PolarHBondContact O-N 2.81Å; Q1057-Q1061 VanDerWaalsContact O-CG 3.31Å; Q1057-Q1061 WeakPolarHBondContact O-CG 3.21Å; Q1057-Q1061 PolarHBondContact O-N 3.16Å
1058	R	77.6	Confident	66.5	Low	161 Å²	161	101.3 Å²	101.3	61%	0.608	51%	0.513	S	S	*	.	H	α-helix	trans	-68.9	-37.9	170.3	-79	175.9	173	-170.7	-1.1	113.1	A1054 N1055 Q1056 Q1061 Q1062	A1054-R1058 WeakPolarHBondContact O-CG 3.31Å; A1054-R1058 PolarHBondContact O-N 3.42Å; N1055-R1058 WeakPolarHBondContact O-CB 3.39Å; N1055-R1058 PolarHBondContact O-N 2.94Å; Q1056-R1058 VanDerWaalsContact C-N 3.27Å; Q1056-R1058 PolarHBondContact O-N 2.99Å; R1058-Q1061 CarbonylContact O-C 3.47Å; R1058-Q1061 PolarHBondContact O-N 3.38Å; R1058-Q1062 WeakPolarHBondContact O-CG 3.21Å; R1058-Q1062 PolarHBondContact O-N 3.13Å
1059	Q	71.1	Confident	63.9	Low	117 Å²	117	100.1 Å²	100.1	55%	0.547	53%	0.527	S	S	.	.	H	α-helix	trans	-64.8	-41.8	173.2	-78.6	179.5	-36.7	0	0	111.4	N1055 Q1056 Q1061 Q1062 L1063	N1055-Q1059 PolarHBondContact O-N 3.34Å; Q1056-Q1059 PolarHBondContact O-N 3.19Å; Q1056-Q1059 VanDerWaalsContact O-N 3.13Å; Q1059-Q1061 VanDerWaalsContact C-N 3.31Å; Q1059-Q1061 PolarHBondContact O-N 3.04Å; Q1059-Q1062 PolarHBondContact O-N 3.41Å; Q1059-L1063 WeakPolarHBondContact O-CG 3.42Å; Q1059-L1063 PolarHBondContact O-N 3Å
1060	Q	64.5	Low	61.5	Low	121 Å²	121	105.2 Å²	105.2	57%	0.565	56%	0.557	S	S	*	*	H	α-helix	trans	-58.4	-41.6	170.6	-71.4	177.5	-13.2	0	0	111.9	Q1056 Q1062 L1063 S1064	Q1056-Q1060 PolarHBondContact O-N 3.46Å; Q1060-Q1062 VanDerWaalsContact C-N 3.25Å; Q1060-Q1062 PolarHBondContact O-N 3.45Å; Q1060-L1063 PolarHBondContact O-N 2.75Å; Q1060-S1064 WeakPolarHBondContact O-CB 3.47Å; Q1060-S1064 PolarHBondContact O-N 3.38Å
1061	Q	63.7	Low	58.9	Low	95 Å²	95	110 Å²	110	44%	0.444	57%	0.574	S	S	.	*	H	α-helix	trans	-71.9	-10.5	173.9	-71.5	175.5	20.8	0	0	115	Q1057 R1058 Q1059 S1064 K1065	Q1057-Q1061 VanDerWaalsContact O-CG 3.31Å; Q1057-Q1061 WeakPolarHBondContact O-CG 3.21Å; Q1057-Q1061 PolarHBondContact O-N 3.16Å; R1058-Q1061 CarbonylContact O-C 3.47Å; R1058-Q1061 PolarHBondContact O-N 3.38Å; Q1059-Q1061 VanDerWaalsContact C-N 3.31Å; Q1059-Q1061 PolarHBondContact O-N 3.04Å; Q1061-S1064 WeakPolarHBondContact CA-OG 3.41Å; Q1061-S1064 PolarHBondContact O-OG 3.47Å; Q1061-K1065 VanDerWaalsContact O-CD 3.25Å; Q1061-K1065 WeakPolarHBondContact O-CD 3.44Å; Q1061-K1065 VanDerWaalsContact O-CG 3.25Å; Q1061-K1065 WeakPolarHBondContact O-CG 3.4Å
1062	Q	55.3	Low	56.8	Low	124 Å²	124	112.5 Å²	112.5	58%	0.579	59%	0.59	S	S	*	*	H	α-helix	trans	-93	-42.4	172.6	-77.3	172.1	-19.7	0	0	110.6	R1058 Q1059 Q1060 S1064 K1065 E1066	R1058-Q1062 WeakPolarHBondContact O-CG 3.21Å; R1058-Q1062 PolarHBondContact O-N 3.13Å; Q1059-Q1062 PolarHBondContact O-N 3.41Å; Q1060-Q1062 VanDerWaalsContact C-N 3.25Å; Q1060-Q1062 PolarHBondContact O-N 3.45Å; Q1062-S1064 VanDerWaalsContact C-N 3.31Å; Q1062-S1064 PolarHBondContact O-N 2.91Å; Q1062-K1065 CarbonylContact O-C 3.47Å; Q1062-K1065 WeakPolarHBondContact O-CA 3.45Å; Q1062-K1065 WeakPolarHBondContact O-CB 3.25Å; Q1062-K1065 PolarHBondContact O-N 3.49Å; Q1062-E1066 PolarHBondContact O-N 3.44Å
1063	L	44.7	Very low	54.3	Low	111 Å²	111	115 Å²	115	58%	0.581	61%	0.606	S	S	*	*	H	α-helix	trans	-57.9	-44.3	169.3	-68.5	167.4	0	0	0	110.9	Q1059 Q1060 K1065 E1066 V1067	Q1059-L1063 WeakPolarHBondContact O-CG 3.42Å; Q1059-L1063 PolarHBondContact O-N 3Å; Q1060-L1063 PolarHBondContact O-N 2.75Å; L1063-K1065 PolarHBondContact O-N 3.16Å; L1063-E1066 PolarHBondContact O-N 2.67Å; L1063-V1067 WeakPolarHBondContact O-CG2 3.4Å; L1063-V1067 PolarHBondContact O-N 3.34Å; L1063-V1067 VanDerWaalsContact O-N 3.16Å
1064	S	46.5	Very low	51.5	Low	76 Å²	76	115.7 Å²	115.7	53%	0.531	61%	0.609	S	S	.	*	H	α-helix	trans	-68.5	-1	173.4	86.1	0	0	0	0	114.6	Q1060 Q1061 Q1062	Q1060-S1064 WeakPolarHBondContact O-CB 3.47Å; Q1060-S1064 PolarHBondContact O-N 3.38Å; Q1061-S1064 WeakPolarHBondContact CA-OG 3.41Å; Q1061-S1064 PolarHBondContact O-OG 3.47Å; Q1062-S1064 VanDerWaalsContact C-N 3.31Å; Q1062-S1064 PolarHBondContact O-N 2.91Å
1065	K	44.3	Very low	49.6	Very low	146 Å²	146	118.5 Å²	118.5	64%	0.635	62%	0.623	S	S	*	*	H	α-helix	trans	-110.1	-30.5	175.5	-79.3	176.8	-175.3	169.4	0	113.2	Q1061 Q1062 L1063 V1067 G1068	Q1061-K1065 VanDerWaalsContact O-CD 3.25Å; Q1061-K1065 WeakPolarHBondContact O-CD 3.44Å; Q1061-K1065 VanDerWaalsContact O-CG 3.25Å; Q1061-K1065 WeakPolarHBondContact O-CG 3.4Å; Q1062-K1065 CarbonylContact O-C 3.47Å; Q1062-K1065 WeakPolarHBondContact O-CA 3.45Å; Q1062-K1065 WeakPolarHBondContact O-CB 3.25Å; Q1062-K1065 PolarHBondContact O-N 3.49Å; L1063-K1065 PolarHBondContact O-N 3.16Å; K1065-V1067 VanDerWaalsContact C-N 3.32Å; K1065-G1068 PolarHBondContact O-N 2.8Å
1066	E	36.4	Very low	47.1	Very low	117 Å²	117	121.7 Å²	121.7	55%	0.547	64%	0.639	S	S	.	*	H	α-helix	trans	-66.1	-37.8	165.6	-69.8	-166.3	163.5	0	0	110.7	K590 Q1062 L1063 G1068 G1069	K590-E1066 IonicContact NZ-OE1 3.96Å; K590-E1066 PolarHBondContact NZ-OE1 3.16Å; K590-E1066 IonicContact NZ-OE2 2.66Å; K590-E1066 PolarHBondContact NZ-OE2 3.4Å; Q1062-E1066 PolarHBondContact O-N 3.44Å; L1063-E1066 PolarHBondContact O-N 2.67Å; E1066-G1068 PolarHBondContact O-N 3.29Å; E1066-G1069 PolarHBondContact O-N 3.44Å
1067	V	39.8	Very low	44.9	Very low	117 Å²	117	124 Å²	124	71%	0.709	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-66.4	-23	170.6	177.1	0	0	0	0	112.6	L1063 K1065 G1069	L1063-V1067 WeakPolarHBondContact O-CG2 3.4Å; L1063-V1067 PolarHBondContact O-N 3.34Å; L1063-V1067 VanDerWaalsContact O-N 3.16Å; K1065-V1067 VanDerWaalsContact C-N 3.32Å; V1067-G1069 VanDerWaalsContact C-N 3.26Å; V1067-G1069 PolarHBondContact O-N 3.24Å
1068	G	36.4	Very low	42.6	Very low	62 Å²	62	129.1 Å²	129.1	64%	0.639	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-82	7.6	176.7	0	0	0	0	0	115.2	K1065 E1066	K1065-G1068 PolarHBondContact O-N 2.8Å; E1066-G1068 PolarHBondContact O-N 3.29Å
1069	G	32.6	Very low	40.6	Very low	62 Å²	62	127.2 Å²	127.2	64%	0.639	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-91.1	-10.3	-171.9	0	0	0	0	0	116.7	E1066 V1067	E1066-G1069 PolarHBondContact O-N 3.44Å; V1067-G1069 VanDerWaalsContact C-N 3.26Å; V1067-G1069 PolarHBondContact O-N 3.24Å
1070	L	32.5	Very low	38.5	Very low	154 Å²	154	131.9 Å²	131.9	81%	0.806	69%	0.687	S	S	*	*	S	Bend	trans	-109.7	150.3	-177.7	-65.2	179.4	0	0	0	112.4
1071	N	31.8	Very low	36.9	Very low	163 Å²	163	135.4 Å²	135.4	87%	0.872	70%	0.701	S	S	*	*			trans	-80.1	155.8	-159.5	-164.1	17.7	0	0	0	114.1
1072	M	38.7	Very low	35.3	Very low	166 Å²	166	136.6 Å²	136.6	82%	0.818	71%	0.71	S	S	*	*			trans	-89.2	146.1	-167.4	-48	-143.7	-54.5	0	0	113.9
1073	N	26.1	Very low	34.2	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	72%	0.721	S	S	*	*			trans	-157.6	163	137.7	-140.9	-22.8	0	0	0	113.5
1074	F	23.9	Very low	33.7	Very low	134 Å²	134	139.9 Å²	139.9	59%	0.588	74%	0.738	S	S	*	*			trans	76.6	146.9	176.2	-78.6	-96.7	0	0	0	120.2	M861	M861-F1074 HydrophobicContact CE-CE1 3.98Å; M861-F1074 HydrophobicContact CE-CZ 3.7Å; M861-F1074 HydrophobicContact SD-CE1 3.3Å; M861-F1074 WeakPolarHBondContact SD-CE1 3.49Å; M861-F1074 HydrophobicContact SD-CZ 3.42Å; M861-F1074 WeakPolarHBondContact SD-CZ 3.45Å
1075	P	41.7	Very low	33.2	Very low	107 Å²	107	145.5 Å²	145.5	70%	0.695	75%	0.747	S	S	*	*			trans	-132.3	113.9	-156.8	35.8	-14	0	0	0	114.9
1076	L	28.7	Very low	32.5	Very low	164 Å²	164	142.5 Å²	142.5	86%	0.859	76%	0.758	S	S	*	*			trans	-137.9	143.6	162.9	-82.2	-178.9	0	0	0	113.8
1077	Q	29.8	Very low	32.3	Very low	165 Å²	165	144.1 Å²	144.1	77%	0.771	77%	0.767	S	S	*	*			trans	31.5	102.8	161.4	-79	163.9	-32.2	0	0	120	H1079	Q1077-H1079 HydrophobicContact CB-CB 4.47Å; Q1077-H1079 PolarHBondContact O-N 3.27Å
1078	F	29.4	Very low	31.9	Very low	221 Å²	221	144.7 Å²	144.7	97%	0.969	77%	0.766	S	S	*	*	S	Bend	trans	-62.9	75.1	146.2	-145.1	-85.1	0	0	0	110.4
1079	H	34.4	Very low	31.9	Very low	120 Å²	120	145.9 Å²	145.9	56%	0.556	76%	0.763	S	S	*	*			trans	-150.1	36.7	174.1	-147.4	-72.6	0	0	0	115.7	Q1077	Q1077-H1079 HydrophobicContact CB-CB 4.47Å; Q1077-H1079 PolarHBondContact O-N 3.27Å
1080	F	27.5	Very low	31.9	Very low	215 Å²	215	147.3 Å²	147.3	94%	0.943	76%	0.763	S	S	*	*	S	Bend	trans	-125.8	60.6	170.6	-105.5	-81	0	0	0	113.3
1081	K	31.5	Very low	32.2	Very low	196 Å²	196	145.6 Å²	145.6	85%	0.852	76%	0.759	S	S	*	*	S	Bend	trans	-138.7	8	150.1	-144.8	177	178	178.7	0	115
1082	D	30.2	Very low	32.3	Very low	120 Å²	120	146 Å²	146	64%	0.642	76%	0.76	S	S	*	*	S	Bend	trans	-119.2	62.6	-174.5	-64.8	-66.5	0	0	0	111.9
1083	S	32.3	Very low	32.2	Very low	114 Å²	114	147.2 Å²	147.2	80%	0.797	76%	0.764	S	S	*	*	S	Bend	trans	-168.2	65.1	160.6	-84.3	0	0	0	0	111.6
1084	M	33.6	Very low	32.5	Very low	189 Å²	189	146.1 Å²	146.1	93%	0.931	77%	0.766	S	S	*	*	S	Bend	trans	-170.6	29.3	152.2	-108.8	-60.2	-141.7	0	0	112.3
1085	R	36.5	Very low	32.8	Very low	195 Å²	195	148.2 Å²	148.2	74%	0.736	78%	0.78	S	S	*	*			trans	-151	52.4	168	-143.7	174.3	-154	-143.9	-0.8	113.5	M1087	R1085-M1087 PolarHBondContact O-N 3.18Å
1086	G	29.3	Very low	32.2	Very low	83 Å²	83	152.3 Å²	152.3	86%	0.856	79%	0.787	S	S	*	*			trans	-71.6	42.1	169.2	0	0	0	0	0	113.9
1087	M	31.5	Very low	32.2	Very low	150 Å²	150	153.5 Å²	153.5	74%	0.739	79%	0.788	S	S	*	*	S	Bend	trans	-153.4	135.8	168.1	-155.6	61.3	74	0	0	109.8	R1085	R1085-M1087 PolarHBondContact O-N 3.18Å
1088	N	32.3	Very low	32	Very low	129 Å²	129	149.8 Å²	149.8	69%	0.69	79%	0.786	S	S	*	*			trans	-82.1	126	-155.4	-69.1	-62.3	0	0	0	115	S1090	N1088-S1090 PolarHBondContact O-N 3.37Å
1089	P	36.6	Very low	31.8	Very low	88 Å²	88	145.5 Å²	145.5	57%	0.571	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	39.1	166.7	38	-35.8	0	0	0	112.4
1090	S	32.7	Very low	31.6	Very low	91 Å²	91	147.8 Å²	147.8	64%	0.636	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-17.6	-170.8	-54.7	0	0	0	0	114.2	N1088	N1088-S1090 PolarHBondContact O-N 3.37Å
1091	T	38.3	Very low	31.4	Very low	118 Å²	118	146.2 Å²	146.2	72%	0.724	78%	0.782	S	S	*	*	S	Bend	trans	-97.6	-22	-172.8	-33.1	0	0	0	0	113.3
1092	L	34.3	Very low	31.2	Very low	173 Å²	173	140 Å²	140	91%	0.906	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	38.1	-177.1	-71.8	177.9	0	0	0	114.5
1093	Q	35.1	Very low	31.1	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.4	25.8	161.7	-143.4	160.2	46.8	0	0	114.8
1094	S	32.3	Very low	30.7	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	79%	0.788	S	S	*	*	S	Bend	trans	-118.7	18.8	175.9	-164	0	0	0	0	114.3
1095	M	30.4	Very low	30.3	Very low	178 Å²	178	138.4 Å²	138.4	88%	0.877	78%	0.781	S	S	*	*	S	Bend	trans	-123.8	0.8	178	-87.2	-177.3	145.8	0	0	115.1
1096	F	30.1	Very low	29.7	Very low	193 Å²	193	136.5 Å²	136.5	85%	0.846	79%	0.785	S	S	*	*	S	Bend	trans	-130.5	72.1	174.5	-90.1	-81.5	0	0	0	112.9
1097	Q	28.2	Very low	29.6	Very low	188 Å²	188	142.5 Å²	142.5	88%	0.879	78%	0.783	S	S	*	*				170.7	97.3	109.3	-90	179.1	18	0	0	113.2
1098	A	25	Very low	29.2	Very low	88 Å²	88	141 Å²	141	73%	0.727	78%	0.778	S	S	*	*			trans	-166.3	132.7	154.9	0	0	0	0	0	106.8
1099	N	26.7	Very low	29	Very low	131 Å²	131	139.7 Å²	139.7	70%	0.701	77%	0.771	S	S	*	*			cis	-123.4	-173.3	-5.5	-65.6	-68.3	0	0	0	107.6
1100	H	29.9	Very low	28.5	Very low	167 Å²	167	138.7 Å²	138.7	77%	0.773	76%	0.759	S	S	*	*			cis	-150.3	158.8	25.5	-69.1	-98	0	0	0	108.1
1101	M	23.3	Very low	28.2	Very low	182 Å²	182	137.6 Å²	137.6	90%	0.897	76%	0.762	S	S	*	*			cis	58.9	88.9	47.4	-69.8	-165.7	72.2	0	0	115.1
1102	G	27.3	Very low	27.8	Very low	66 Å²	66	133.9 Å²	133.9	68%	0.68	75%	0.746	S	S	*	*			cis	149.4	-161.2	5.2	0	0	0	0	0	111.2
1103	K	28	Very low	27.7	Very low	217 Å²	217	130.5 Å²	130.5	94%	0.943	72%	0.724	S	S	*	*			trans	72.4	152.1	179.2	-58.1	177.8	179.2	176.1	0	115.9
1104	A	24	Very low	27.6	Very low	97 Å²	97	127 Å²	127	80%	0.802	71%	0.709	S	S	*	*			cis	-167.6	143.3	-26.6	0	0	0	0	0	111.9
1105	G	24.4	Very low	27.5	Very low	76 Å²	76	131 Å²	131	78%	0.784	71%	0.713	S	S	*	*			trans	84.5	163.9	162	0	0	0	0	0	117
1106	L	25.2	Very low	27.7	Very low	155 Å²	155	132.1 Å²	132.1	81%	0.812	71%	0.713	S	S	*	*			cis	-163	168.3	-18.8	-172.2	53.3	0	0	0	109.3
1107	Y	25.3	Very low	27.8	Very low	209 Å²	209	132.3 Å²	132.3	82%	0.82	71%	0.714	S	S	*	*			trans	74	133.5	174.4	105.2	-101.1	0	0	0	115.2
1108	D	24.4	Very low	28.7	Very low	119 Å²	119	129.4 Å²	129.4	64%	0.636	71%	0.711	S	S	*	*			cis	109	140.8	22.2	-87.2	-96.5	0	0	0	112
1109	N	28.2	Very low	29.2	Very low	100 Å²	100	130.4 Å²	130.4	54%	0.535	71%	0.71	S	S	.	*			cis	-162.7	172.5	-26.5	-138.2	-41.4	0	0	0	112.7
1110	Q	25.5	Very low	29.4	Very low	68 Å²	68	131.7 Å²	131.7	32%	0.318	71%	0.714	S	S	.	*			trans	38.8	104	150.6	-71.9	139.2	35	0	0	123.7	Q678 L682	Q678-Q1110 PolarHBondContact NE2-O 2.83Å; L682-Q1110 HydrophobicContact CG-CG 4.35Å
1111	G	27	Very low	29.6	Very low	68 Å²	68	132.7 Å²	132.7	70%	0.701	72%	0.721	S	S	*	*				88.5	161.8	117	0	0	0	0	0	119.2	Q678	Q678-G1111 VanDerWaalsContact NE2-C 3.3Å; Q678-G1111 PolarHBondContact NE2-O 3.46Å
1112	G	30	Very low	30.2	Very low	39 Å²	39	131 Å²	131	40%	0.402	72%	0.715	S	S	.	*			cis	133.4	102	-12.7	0	0	0	0	0	115.6	K681	K681-G1112 WeakPolarHBondContact CD-O 3.47Å; K681-G1112 VanDerWaalsContact CE-O 3.32Å; K681-G1112 WeakPolarHBondContact CE-O 3.46Å; K681-G1112 PolarHBondContact NZ-O 3.31Å
1113	K	31.1	Very low	30.4	Very low	102 Å²	102	131.2 Å²	131.2	44%	0.443	70%	0.698	S	S	.	*			trans	-140.5	113.7	173.8	-58.5	-177	178.1	-165.4	0	108.6	T675 E677	T675-K1113 PolarHBondContact OG1-NZ 3.07Å; E677-K1113 VanDerWaalsContact OE2-CD 3.29Å; E677-K1113 WeakPolarHBondContact OE2-CD 3.5Å; E677-K1113 WeakPolarHBondContact OE2-CE 3.35Å; E677-K1113 IonicContact OE2-NZ 3.85Å; E677-K1113 PolarHBondContact OE2-NZ 3.29Å
1114	M	33.3	Very low	30.6	Very low	116 Å²	116	126 Å²	126	57%	0.571	69%	0.689	S	S	*	*				49.6	131.2	101.2	-55.5	-144.1	-169.8	0	0	114.2	K681	K681-M1114 HydrophobicContact CD-CE 4.16Å; K681-M1114 HydrophobicContact CG-CE 4.4Å
1115	K	31.3	Very low	30.7	Very low	192 Å²	192	125.3 Å²	125.3	84%	0.835	67%	0.672	S	S	*	*			cis	-148.9	154.4	29.8	-63.4	169.9	-179.9	167.6	0	114.8
1116	K	33.5	Very low	31.9	Very low	201 Å²	201	126 Å²	126	87%	0.874	66%	0.662	S	S	*	*			trans	17.1	112	154.5	-67.3	-177.3	173.9	-179.2	0	121.5
1117	K	32.8	Very low	32.2	Very low	198 Å²	198	124.2 Å²	124.2	86%	0.861	66%	0.663	S	S	*	*				174.8	163	112.5	-95.5	175.6	-179.6	-176.2	0	110.4
1118	P	45.9	Very low	32.7	Very low	126 Å²	126	122.6 Å²	122.6	82%	0.818	67%	0.667	S	S	*	*			trans	-97.6	129.4	-162.9	35.3	-32.9	0	0	0	115.4
1119	P	36.4	Very low	33.1	Very low	109 Å²	109	125 Å²	125	71%	0.708	68%	0.679	S	S	*	*			trans	-147.3	166.1	145.9	38.4	-22.2	0	0	0	115.6
1120	M	30.6	Very low	33	Very low	159 Å²	159	123 Å²	123	78%	0.783	68%	0.681	S	S	*	*			trans	42.2	141.2	145.9	-63	172.3	75.3	0	0	122.7	L1122	M1120-L1122 HydrophobicContact CE-CD1 4.02Å; M1120-L1122 HydrophobicContact CE-CG 4.42Å
1121	M	34.4	Very low	33	Very low	188 Å²	188	130 Å²	130	93%	0.926	71%	0.707	S	S	*	*			trans	-115.3	136.5	155.7	-73.4	174.9	59.3	0	0	108.9
1122	L	34.7	Very low	33.1	Very low	147 Å²	147	131.3 Å²	131.3	77%	0.77	71%	0.705	S	S	*	*			trans	-130.7	161.2	172.1	-94.2	168.9	0	0	0	109.7	M1120	M1120-L1122 HydrophobicContact CE-CD1 4.02Å; M1120-L1122 HydrophobicContact CE-CG 4.42Å
1123	H	32.7	Very low	32.9	Very low	69 Å²	69	137.3 Å²	137.3	32%	0.319	72%	0.72	S	S	.	*			trans	-63.4	169.5	172.8	-69.3	-157.2	0	0	0	111.3	E1037 E1040 Q1044	E1037-H1123 PolarHBondContact O-CE1 2.65Å; E1040-H1123 WeakPolarHBondContact OE2-CB 3.38Å; E1040-H1123 IonicContact OE2-CD2 3.31Å; E1040-H1123 IonicContact OE2-CG 2.65Å; E1040-H1123 VanDerWaalsContact OE2-CG 3.3Å; E1040-H1123 IonicContact OE2-ND1 3.02Å; Q1044-H1123 PolarHBondContact NE2-CD2 3.13Å; Q1044-H1123 PolarHBondContact NE2-NE2 3.1Å
1124	S	31.3	Very low	32.7	Very low	108 Å²	108	140 Å²	140	76%	0.755	73%	0.734	S	S	*	*			trans	-137.6	95.6	163.2	62	0	0	0	0	110.4
1125	D	27.8	Very low	32.3	Very low	82 Å²	82	140.9 Å²	140.9	44%	0.439	74%	0.741	S	S	.	*			trans	-78.7	156.5	176.9	-117.3	40.9	0	0	0	112.1	V1036	V1036-D1125 VanDerWaalsContact CB-OD1 3.3Å; V1036-D1125 WeakPolarHBondContact CB-OD1 3.3Å; V1036-D1125 WeakPolarHBondContact CB-OD2 3.48Å; V1036-D1125 WeakPolarHBondContact CG1-OD1 3.33Å
1126	P	49.2	Very low	32.1	Very low	90 Å²	90	137.6 Å²	137.6	58%	0.584	74%	0.737	S	S	*	*			trans	-96.1	107.5	-158.9	34.3	-32.1	0	0	0	113.6	V1036	V1036-P1126 HydrophobicContact CG2-CG 4.11Å
1127	S	31.3	Very low	31.6	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	73%	0.729	S	S	*	*			trans	-155.4	54.4	175.6	-79	0	0	0	0	115.8
1128	I	34.6	Very low	31.5	Very low	176 Å²	176	131.1 Å²	131.1	90%	0.903	73%	0.732	S	S	*	*	S	Bend	trans	-129.9	57.1	155.7	-50.1	-176.8	0	0	0	109.4
1129	L	32.8	Very low	30.6	Very low	169 Å²	169	131.8 Å²	131.8	89%	0.885	74%	0.738	S	S	*	*			trans	-146.1	64.3	166.7	-116.4	160	0	0	0	107.7	Y1131	L1129-Y1131 PolarHBondContact O-N 3.02Å
1130	G	26.7	Very low	30.1	Very low	57 Å²	57	134.7 Å²	134.7	59%	0.588	75%	0.747	S	S	*	*			trans	-78.1	119.2	175.5	0	0	0	0	0	110.3
1131	Y	26.1	Very low	29.8	Very low	216 Å²	216	132.4 Å²	132.4	85%	0.847	75%	0.746	S	S	*	*			trans	71.6	141.5	166.3	-47.8	-71.7	0	0	0	115	L1129	L1129-Y1131 PolarHBondContact O-N 3.02Å
1132	S	29	Very low	29.4	Very low	96 Å²	96	130.5 Å²	130.5	67%	0.671	74%	0.737	S	S	*	*			cis	154.5	148.8	-7.5	-97.8	0	0	0	0	104.5
1133	F	25	Very low	28.9	Very low	164 Å²	164	130.3 Å²	130.3	72%	0.719	74%	0.736	S	S	*	*			cis	-170.4	163	-14.2	-148.8	-80.9	0	0	0	106.9
1134	H	27.7	Very low	28.7	Very low	160 Å²	160	134.9 Å²	134.9	74%	0.741	76%	0.758	S	S	*	*			trans	76.8	161	168.5	-51.5	104	0	0	0	119.2
1135	N	25	Very low	28.6	Very low	134 Å²	134	136.6 Å²	136.6	72%	0.717	76%	0.758	S	S	*	*			cis	-173.9	179.9	-41.1	-163.2	14.9	0	0	0	108.9
1136	T	25.9	Very low	28.6	Very low	122 Å²	122	140.9 Å²	140.9	75%	0.748	78%	0.775	S	S	*	*			trans	73.3	136.1	159.5	57.3	0	0	0	0	118.4
1137	G	25	Very low	27.5	Very low	69 Å²	69	144.7 Å²	144.7	71%	0.711	79%	0.788	S	S	*	*			trans	-109.7	-164.2	155.1	0	0	0	0	0	110.7
1138	E	30.1	Very low	27.6	Very low	194 Å²	194	144.7 Å²	144.7	91%	0.907	78%	0.782	S	S	*	*			trans	69.3	104	177.1	-58.8	-168.4	158.6	0	0	118
1139	C	26.6	Very low	27.5	Very low	140 Å²	140	143.7 Å²	143.7	95%	0.946	77%	0.774	S	S	*	*			trans	-148.2	159	133.5	-98.8	0	0	0	0	109.3
1140	L	26.5	Very low	27.5	Very low	171 Å²	171	142 Å²	142	90%	0.895	77%	0.766	S	S	*	*			trans	-118	162	-164.7	-70.7	165.2	0	0	0	113.5
1141	S	23.5	Very low	27.8	Very low	111 Å²	111	153.4 Å²	153.4	78%	0.776	79%	0.793	S	S	*	*			trans	88.4	158	144.7	-151.8	0	0	0	0	120.4
1142	M	25.6	Very low	27.9	Very low	147 Å²	147	150.3 Å²	150.3	72%	0.724	79%	0.79	S	S	*	*			trans	62.1	115.5	-179.9	-56.1	-152.8	68.3	0	0	115.4
1143	N	24.5	Very low	27.9	Very low	143 Å²	143	153.2 Å²	153.2	77%	0.765	80%	0.797	S	S	*	*			cis	62.6	86.3	21.5	-169	103.7	0	0	0	114.5
1144	E	28.1	Very low	28	Very low	166 Å²	166	152.6 Å²	152.6	78%	0.776	80%	0.801	S	S	*	*			trans	-140.1	168.7	149.7	-167.2	150	-146.7	0	0	110.2
1145	L	29.9	Very low	28.1	Very low	144 Å²	144	152.1 Å²	152.1	75%	0.754	80%	0.804	S	S	*	*			trans	-52.9	168.7	-175.2	-88.7	56.7	0	0	0	114.7
1146	E	27.3	Very low	28.2	Very low	171 Å²	171	153.3 Å²	153.3	80%	0.799	81%	0.81	S	S	*	*			cis	-151.2	164.6	34.4	-149	176.5	171.7	0	0	114.2
1147	M	26.4	Very low	28.4	Very low	171 Å²	171	155.3 Å²	155.3	84%	0.842	81%	0.814	S	S	*	*			trans	-74.7	160.8	155.8	-51.1	-177.2	-53.7	0	0	109.4
1148	V	34.1	Very low	28.6	Very low	118 Å²	118	161.5 Å²	161.5	72%	0.715	82%	0.821	S	S	*	*			trans	-163.9	155.4	134.3	134.6	0	0	0	0	107
1149	E	31	Very low	28.5	Very low	154 Å²	154	159 Å²	159	72%	0.72	82%	0.815	S	S	*	*			trans	-25.3	138.8	174.3	-77.7	76.6	175.3	0	0	115.4
1150	D	33.3	Very low	28.7	Very low	134 Å²	134	160.6 Å²	160.6	72%	0.717	80%	0.804	S	S	*	*			cis	-140.2	138.1	37.2	-92.3	-52.9	0	0	0	115.2
1151	Y	34.3	Very low	28.9	Very low	297 Å²	297	159.6 Å²	159.6	100%	1.165	80%	0.796	S	S	*	*			trans	53.5	0	156.4	-74	-90.5	0	0	0	121.5

Retrieved 1,151 of 1,151 residues in 1435.8 ms (Link to these results)

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