A0A3Q0KMQ1_SCHMA Loading...

AAA domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KMQ1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 931 aa.

						>A0A3Q0KMQ1_SCHMA|A0A3Q0KMQ1
MKSEPGNHDPANNTVQSLNSKGNKIDVQENNITKMSYTEFLTSLKNGLCVDERCNSDANIQNKFHESLSKSIDLHVRANEHVCNTGVAIAEDFSNTVPLCNPKVEFSCTRSSEDSLIVVPDIITEALVCSEPNMQQSCFSGLNQSPSQTKQEMADIYLSKTIDSDTCLRKIVDDHPNFPIFECFQKFQSFTTGCTKSRQIPSASNESLLWVDKYMPSSCSSFLNTCPSIIKLLMWLKKWKYKNSKVENSMEPSLSKNKTTKSTKKRLRSSPRYSSDEDFVVKSPAHKRHKYNVHVPGSVENINENPTLNLPIGYIRNQIDVSSSSSSDEDNSTESDEEHNGNPNKRRLRANWQSKAFLLVGPHGTGKSALIYALAKDLGFKIFELNPSSRRSGKDIISQFHTALGSHHVAKDYLSTSFSTFQMITSSSLTKNNSETIRKSAANFFKPVPKKNVSSKKNTSSTKDSESLNLNCNSIVLFDEVDVLFESDRGFWSGLSSLLQLARRPVILTASDSSVVHNLPVPAYICHFTSASLELVVPYIRVLCLNEGYNLDVQTANSLIKSIQSPNLTIDKLSSEHCDLRRLINELQWFCTSASHEEANRKYNHIKNENSLILNEFIDDPLNLVQKISPSLCNLSGYIVNPKPSVNSKCVIENDLCDLFTTDAENVPDQVAGKTATNEIVKENVIETNCQDSVEKNQKSSLLIDFSLNSLKEMTENLSFWDICQSGVTRASLLSVTDSISQIIDIKSDSNNNGSNNSPSNTNPSVNITSDSSMCTVSTKRVINVPTQHWGPVCAFDIINDDFFNVFWIQILLNQSRTNLEEAESKLTTDNYSYSNGSVKTDMLLKSCDLSQSLSLSKCVNDLNRCGIGTNCHDHLKTLACDYLPILRLLASGENSRQIVSTKRRFLHYFDRISLFLSPSTREFLSKSSFL
					

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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	28.5	Very low	34.6	Very low	243 Å²	243	137.5 Å²	137.5	100%	1.197	79%	0.788	S	S	*	*				0	135.3	0	-70	173.4	169.9	0	0	107
2	K	34.9	Very low	34.3	Very low	187 Å²	187	137.4 Å²	137.4	81%	0.813	78%	0.783	S	S	*	*			trans	20.2	139.9	160.7	-59.1	-175.2	-179.2	-174.9	0	119.8
3	S	35.8	Very low	33.8	Very low	98 Å²	98	137.5 Å²	137.5	69%	0.685	78%	0.779	S	S	*	*			cis	-177	147.7	-8	48.1	0	0	0	0	111.1
4	E	33.8	Very low	33.6	Very low	155 Å²	155	136.2 Å²	136.2	72%	0.724	78%	0.776	S	S	*	*			cis	-165.6	147.2	-22.4	-124.5	82.4	-109.3	0	0	105.5
5	P	41.6	Very low	33.3	Very low	133 Å²	133	134.4 Å²	134.4	86%	0.864	77%	0.769	S	S	*	*			trans	-91.9	158	-169	35.7	-36	0	0	0	115.5
6	G	34.5	Very low	32.9	Very low	78 Å²	78	137 Å²	137	80%	0.804	77%	0.772	S	S	*	*			trans	-142	155	175.5	0	0	0	0	0	112.7
7	N	32	Very low	32.6	Very low	136 Å²	136	134 Å²	134	73%	0.727	76%	0.762	S	S	*	*			trans	-151.9	154.2	-162.6	-166.4	18.7	0	0	0	112.3
8	H	34.1	Very low	32.4	Very low	146 Å²	146	134.1 Å²	134.1	68%	0.676	76%	0.759	S	S	*	*			trans	65.3	153.3	177.1	-64.6	-72.6	0	0	0	116.3
9	D	32.7	Very low	32.1	Very low	140 Å²	140	134.5 Å²	134.5	75%	0.749	76%	0.759	S	S	*	*			cis	-153.9	-176.5	-1.8	-121.9	8.5	0	0	0	111.9
10	P	41.5	Very low	31.9	Very low	111 Å²	111	132.3 Å²	132.3	72%	0.721	75%	0.753	S	S	*	*			trans	-111.8	173.8	-149	43.4	-40.8	0	0	0	117.8
11	A	31.7	Very low	31.9	Very low	85 Å²	85	135.7 Å²	135.7	70%	0.702	76%	0.759	S	S	*	*				160.2	143.4	118.6	0	0	0	0	0	116.2
12	N	30.7	Very low	31.8	Very low	137 Å²	137	127.4 Å²	127.4	73%	0.733	74%	0.736	S	S	*	*			trans	65.4	117.6	147.3	-70	-8.5	0	0	0	124
13	N	27.4	Very low	31.4	Very low	138 Å²	138	125.9 Å²	125.9	74%	0.738	74%	0.736	S	S	*	*			trans	73.7	154.2	140.2	-53.6	-22.2	0	0	0	117.8
14	T	30.9	Very low	31	Very low	120 Å²	120	129.7 Å²	129.7	74%	0.736	74%	0.741	S	S	*	*			cis	-155.3	138.6	17.3	-20.6	0	0	0	0	112.7
15	V	29.5	Very low	30.4	Very low	109 Å²	109	127.9 Å²	127.9	66%	0.661	74%	0.735	S	S	*	*			trans	57.4	116	134.3	165.9	0	0	0	0	121.7
16	Q	27.6	Very low	29.6	Very low	176 Å²	176	127.7 Å²	127.7	82%	0.822	73%	0.726	S	S	*	*			trans	61.8	151.6	134	-66.8	176.5	3.6	0	0	120.9
17	S	27.6	Very low	29.1	Very low	86 Å²	86	130.3 Å²	130.3	60%	0.601	73%	0.727	S	S	*	*			cis	-173.2	-178.3	-9.8	53.9	0	0	0	0	112.2
18	L	28.1	Very low	28.7	Very low	135 Å²	135	132.1 Å²	132.1	71%	0.707	73%	0.731	S	S	*	*			trans	71.6	116	150.5	-71.8	164.9	0	0	0	120.8
19	N	27.2	Very low	28.3	Very low	142 Å²	142	132.6 Å²	132.6	76%	0.759	73%	0.733	S	S	*	*				61.6	159.7	125.5	-69	4	0	0	0	122
20	S	27.7	Very low	27.9	Very low	91 Å²	91	132.2 Å²	132.2	64%	0.636	73%	0.731	S	S	*	*			cis	-173.3	159.1	-29.4	61.1	0	0	0	0	109.3
21	K	32.1	Very low	27.3	Very low	204 Å²	204	134 Å²	134	89%	0.887	74%	0.735	S	S	*	*			trans	141	134	160.3	-81.9	157.8	-175.6	176.3	0	110
22	G	26.3	Very low	26.9	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	74%	0.743	S	S	*	*			cis	120.5	106.7	-14	0	0	0	0	0	115.3
23	N	27.1	Very low	26.8	Very low	155 Å²	155	137.4 Å²	137.4	83%	0.829	74%	0.744	S	S	*	*			trans	-143.2	139.3	153.9	-85.8	-27.6	0	0	0	105.7
24	K	26.3	Very low	26.8	Very low	179 Å²	179	140.4 Å²	140.4	78%	0.778	75%	0.75	S	S	*	*			cis	73.5	131	36.7	-70.4	-161.5	156.1	-157.8	0	113.3
25	I	22.7	Very low	26.7	Very low	117 Å²	117	140.4 Å²	140.4	60%	0.6	74%	0.744	S	S	*	*			cis	-158.9	162.5	-1.3	-132.3	172.2	0	0	0	112.8
26	D	23.6	Very low	27	Very low	128 Å²	128	137.2 Å²	137.2	68%	0.684	73%	0.726	S	S	*	*			trans	38	127.6	157.3	-50.9	-26.9	0	0	0	125
27	V	23.9	Very low	27.2	Very low	134 Å²	134	137.1 Å²	137.1	81%	0.812	72%	0.719	S	S	*	*				29.5	110.2	129.4	-169.6	0	0	0	0	119.3
28	Q	24.3	Very low	27.7	Very low	173 Å²	173	137.5 Å²	137.5	81%	0.808	72%	0.718	S	S	*	*				-159	143.9	126.9	-113.7	169.8	-0	0	0	112.7
29	E	24.7	Very low	28.2	Very low	156 Å²	156	136.2 Å²	136.2	73%	0.729	71%	0.708	S	S	*	*			trans	40.2	135.2	152.4	-68.5	-175.2	-178.7	0	0	123.9
30	N	24.9	Very low	28.6	Very low	132 Å²	132	134.5 Å²	134.5	71%	0.706	69%	0.694	S	S	*	*			trans	55.5	88	140.9	-60.9	-32.3	0	0	0	119.4
31	N	28.4	Very low	28.9	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	68%	0.684	S	S	*	*			trans	-159	92.9	137.6	-103.5	-50.3	0	0	0	112	T33	N31-T33 PolarHBondContact O-N 3.17Å
32	I	23.7	Very low	29.3	Very low	172 Å²	172	127.8 Å²	127.8	88%	0.882	66%	0.663	S	S	*	*			trans	-84.3	84.8	167.5	-57.5	177.5	0	0	0	107.9
33	T	28.7	Very low	29.7	Very low	121 Å²	121	128.7 Å²	128.7	74%	0.742	66%	0.659	S	S	*	*			trans	-75.4	127.6	169.1	41.5	0	0	0	0	109.7	N31 M35	N31-T33 PolarHBondContact O-N 3.17Å; T33-M35 PolarHBondContact O-N 2.82Å
34	K	27.8	Very low	30	Very low	201 Å²	201	126.7 Å²	126.7	87%	0.874	65%	0.648	S	S	*	*			trans	-73.2	108.4	-175.8	-64.9	176.8	-179.7	177.2	0	110.5
35	M	29.4	Very low	30.3	Very low	120 Å²	120	126.8 Å²	126.8	59%	0.591	65%	0.648	S	S	*	*			trans	-61.2	133.4	160.6	-172.4	179.8	-167.5	0	0	108.8	T33 E39	T33-M35 PolarHBondContact O-N 2.82Å; M35-E39 HydrophobicContact CE-CB 3.9Å; M35-E39 HydrophobicContact CG-CB 4.15Å
36	S	35.1	Very low	30.7	Very low	41 Å²	41	127.5 Å²	127.5	29%	0.287	65%	0.653	S	S	.	*			trans	-74.4	148	178.9	71	0	0	0	0	111.5	T38 E39 F40	S36-T38 WeakPolarHBondContact CB-OG1 3.34Å; S36-T38 PolarHBondContact O-N 3.02Å; S36-T38 PolarHBondContact OG-OG1 2.95Å; S36-E39 WeakPolarHBondContact CB-OE2 3.34Å; S36-E39 PolarHBondContact N-OE2 3.42Å; S36-E39 PolarHBondContact O-N 3.46Å; S36-E39 VanDerWaalsContact OG-CD 3.25Å; S36-E39 VanDerWaalsContact OG-CG 3.23Å; S36-E39 WeakPolarHBondContact OG-CG 3.47Å; S36-E39 PolarHBondContact OG-N 3.29Å; S36-E39 VanDerWaalsContact OG-N 3.09Å; S36-E39 PolarHBondContact OG-OE2 3.23Å; S36-F40 PolarHBondContact O-N 2.67Å; S36-F40 VanDerWaalsContact O-N 3.08Å
37	Y	32.5	Very low	30.8	Very low	174 Å²	174	124.1 Å²	124.1	68%	0.682	65%	0.649	S	S	*	*	H	α-helix	trans	-57.2	-32.8	174.1	-175.2	-111.6	0	0	0	111.8	F40 L41	Y37-F40 PolarHBondContact O-N 3.34Å; Y37-L41 HydrophobicContact CD1-CD1 3.9Å; Y37-L41 HydrophobicContact CE1-CD1 3.47Å; Y37-L41 VanDerWaalsContact CE1-CD1 3.47Å; Y37-L41 HydrophobicContact CE1-CG 4.3Å; Y37-L41 WeakPolarHBondContact O-CG 3.3Å; Y37-L41 PolarHBondContact O-N 3.18Å
38	T	38.2	Very low	31	Very low	94 Å²	94	126.3 Å²	126.3	58%	0.577	66%	0.655	S	S	*	*	H	α-helix	trans	-63.4	-43	172.1	31	0	0	0	0	113.8	S36 T42	S36-T38 WeakPolarHBondContact CB-OG1 3.34Å; S36-T38 PolarHBondContact O-N 3.02Å; S36-T38 PolarHBondContact OG-OG1 2.95Å; T38-T42 WeakPolarHBondContact O-CB 3.44Å; T38-T42 PolarHBondContact O-N 2.87Å; T38-T42 PolarHBondContact O-OG1 2.95Å
39	E	38.2	Very low	31	Very low	108 Å²	108	124.1 Å²	124.1	51%	0.505	66%	0.657	S	S	.	*	H	α-helix	trans	-68.6	-39	176	-73.1	158.3	123.2	0	0	111.5	M35 S36 T42 S43	M35-E39 HydrophobicContact CE-CB 3.9Å; M35-E39 HydrophobicContact CG-CB 4.15Å; S36-E39 WeakPolarHBondContact CB-OE2 3.34Å; S36-E39 PolarHBondContact N-OE2 3.42Å; S36-E39 PolarHBondContact O-N 3.46Å; S36-E39 VanDerWaalsContact OG-CD 3.25Å; S36-E39 VanDerWaalsContact OG-CG 3.23Å; S36-E39 WeakPolarHBondContact OG-CG 3.47Å; S36-E39 PolarHBondContact OG-N 3.29Å; S36-E39 VanDerWaalsContact OG-N 3.09Å; S36-E39 PolarHBondContact OG-OE2 3.23Å; E39-T42 PolarHBondContact O-N 3.18Å; E39-S43 WeakPolarHBondContact O-CB 3.38Å; E39-S43 PolarHBondContact O-N 2.9Å
40	F	35.6	Very low	31.1	Very low	107 Å²	107	123.5 Å²	123.5	47%	0.469	66%	0.664	S	S	.	*	H	α-helix	trans	-60.3	-48.4	175.4	178.3	-104.3	0	0	0	111.7	S36 Y37 S43 L44	S36-F40 PolarHBondContact O-N 2.67Å; S36-F40 VanDerWaalsContact O-N 3.08Å; Y37-F40 PolarHBondContact O-N 3.34Å; F40-S43 PolarHBondContact O-N 3.22Å; F40-L44 HydrophobicContact CD1-CD1 4.03Å; F40-L44 HydrophobicContact CE1-CD1 3.58Å; F40-L44 HydrophobicContact CE2-CD1 4.45Å; F40-L44 HydrophobicContact CZ-CD1 3.82Å; F40-L44 PolarHBondContact O-N 3.26Å; F40-L44 VanDerWaalsContact O-N 3.13Å
41	L	33.9	Very low	31.1	Very low	78 Å²	78	124.6 Å²	124.6	41%	0.408	67%	0.67	S	S	.	*	H	α-helix	trans	-66.5	-34.6	175.3	-70.7	178.9	0	0	0	113.1	Y37 L44 K45	Y37-L41 HydrophobicContact CD1-CD1 3.9Å; Y37-L41 HydrophobicContact CE1-CD1 3.47Å; Y37-L41 VanDerWaalsContact CE1-CD1 3.47Å; Y37-L41 HydrophobicContact CE1-CG 4.3Å; Y37-L41 WeakPolarHBondContact O-CG 3.3Å; Y37-L41 PolarHBondContact O-N 3.18Å; L41-L44 HydrophobicContact CD2-CD1 4.47Å; L41-L44 PolarHBondContact O-N 3.41Å; L41-K45 WeakPolarHBondContact O-CB 3.17Å; L41-K45 PolarHBondContact O-N 3.14Å
42	T	39.8	Very low	30.9	Very low	75 Å²	75	125.3 Å²	125.3	46%	0.46	67%	0.668	S	S	.	*	H	α-helix	trans	-69.6	-36.8	177.5	-55.9	0	0	0	0	111.6	T38 E39 K45 N46	T38-T42 WeakPolarHBondContact O-CB 3.44Å; T38-T42 PolarHBondContact O-N 2.87Å; T38-T42 PolarHBondContact O-OG1 2.95Å; E39-T42 PolarHBondContact O-N 3.18Å; T42-K45 PolarHBondContact O-N 3.1Å; T42-N46 PolarHBondContact O-N 2.83Å
43	S	35.9	Very low	30.9	Very low	87 Å²	87	127.7 Å²	127.7	61%	0.608	67%	0.666	S	S	*	*	H	α-helix	trans	-62.9	-40.9	172.3	-167.5	0	0	0	0	111.9	E39 F40	E39-S43 WeakPolarHBondContact O-CB 3.38Å; E39-S43 PolarHBondContact O-N 2.9Å; F40-S43 PolarHBondContact O-N 3.22Å
44	L	33.1	Very low	30.8	Very low	113 Å²	113	128.3 Å²	128.3	59%	0.592	67%	0.674	S	S	*	*	H	α-helix	trans	-68	-31.9	174.1	-74.7	167	0	0	0	113.6	F40 L41	F40-L44 HydrophobicContact CD1-CD1 4.03Å; F40-L44 HydrophobicContact CE1-CD1 3.58Å; F40-L44 HydrophobicContact CE2-CD1 4.45Å; F40-L44 HydrophobicContact CZ-CD1 3.82Å; F40-L44 PolarHBondContact O-N 3.26Å; F40-L44 VanDerWaalsContact O-N 3.13Å; L41-L44 HydrophobicContact CD2-CD1 4.47Å; L41-L44 PolarHBondContact O-N 3.41Å
45	K	31.8	Very low	30.7	Very low	182 Å²	182	126.1 Å²	126.1	79%	0.791	67%	0.671	S	S	*	*	H	α-helix	trans	-81.5	-21.4	-175.1	-161.8	169.9	-175.5	178.4	0	114.1	L41 T42	L41-K45 WeakPolarHBondContact O-CB 3.17Å; L41-K45 PolarHBondContact O-N 3.14Å; T42-K45 PolarHBondContact O-N 3.1Å
46	N	30.4	Very low	30.6	Very low	131 Å²	131	125.5 Å²	125.5	70%	0.701	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	18.4	-172.7	-68.1	-8.7	0	0	0	114.2	T42	T42-N46 PolarHBondContact O-N 2.83Å
47	G	26.9	Very low	30.4	Very low	58 Å²	58	129.5 Å²	129.5	60%	0.598	70%	0.697	S	S	*	*			trans	-135.5	41.1	-162.3	0	0	0	0	0	117.4
48	L	27.9	Very low	30.3	Very low	180 Å²	180	124.7 Å²	124.7	94%	0.942	69%	0.693	S	S	*	*			trans	-153.3	76.3	170.9	-116.6	170	0	0	0	112.9
49	C	23.8	Very low	30.1	Very low	127 Å²	127	125.6 Å²	125.6	86%	0.858	70%	0.695	S	S	*	*			trans	-147.9	85.9	173.2	-154.4	0	0	0	0	110.8
50	V	27.7	Very low	29.8	Very low	143 Å²	143	126.5 Å²	126.5	87%	0.867	70%	0.702	S	S	*	*			trans	-142.9	133.1	168.8	-176.6	0	0	0	0	108.2
51	D	23.8	Very low	29.6	Very low	154 Å²	154	128.5 Å²	128.5	82%	0.824	71%	0.713	S	S	*	*			trans	-74.6	178.4	-174.5	-69.9	-70.8	0	0	0	115.2	R53	D51-R53 PolarHBondContact O-N 3.37Å
52	E	24.2	Very low	29.6	Very low	165 Å²	165	129.9 Å²	129.9	77%	0.771	72%	0.72	S	S	*	*	S	Bend	trans	-45.6	118	177.5	-54.6	-179.5	154.6	0	0	114.4
53	R	23.8	Very low	29.3	Very low	223 Å²	223	133.5 Å²	133.5	84%	0.842	73%	0.73	S	S	*	*				152.6	103.2	129.2	-79.5	152.6	-156.3	-159.8	6.8	111.8	D51	D51-R53 PolarHBondContact O-N 3.37Å
54	C	28.1	Very low	29.1	Very low	134 Å²	134	136.4 Å²	136.4	91%	0.905	73%	0.732	S	S	*	*				-173.2	148.5	129.4	-107.1	0	0	0	0	110.6
55	N	24.4	Very low	29.3	Very low	154 Å²	154	137.4 Å²	137.4	82%	0.824	73%	0.733	S	S	*	*			trans	-91	165.9	172.9	-89.7	-41.8	0	0	0	111.1
56	S	27.1	Very low	29.5	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	72%	0.718	S	S	*	*			trans	54.1	96.5	163.7	57.7	0	0	0	0	117.7
57	D	30.8	Very low	29.7	Very low	125 Å²	125	131.3 Å²	131.3	67%	0.668	71%	0.712	S	S	*	*				-160.6	103.9	113.1	-121.3	-25.3	0	0	0	113.1	N59	D57-N59 VanDerWaalsContact C-N 3.28Å; D57-N59 PolarHBondContact O-N 2.94Å
58	A	31	Very low	30.1	Very low	72 Å²	72	132.5 Å²	132.5	60%	0.595	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-12.1	-173	0	0	0	0	0	114.4	I60	A58-I60 PolarHBondContact O-N 2.79Å
59	N	34.7	Very low	30.5	Very low	114 Å²	114	127.4 Å²	127.4	61%	0.61	68%	0.684	S	S	*	*	H	α-helix	trans	-78.4	-16.9	-171.9	-82.6	-43.8	0	0	0	115	D57	D57-N59 VanDerWaalsContact C-N 3.28Å; D57-N59 PolarHBondContact O-N 2.94Å
60	I	30.6	Very low	31.1	Very low	127 Å²	127	127.1 Å²	127.1	65%	0.651	67%	0.668	S	S	*	*	H	α-helix	trans	-84.9	-42.5	-177.3	-61.4	178.8	0	0	0	111.2	A58 N62 K63 F64	A58-I60 PolarHBondContact O-N 2.79Å; I60-N62 PolarHBondContact O-N 3.43Å; I60-K63 PolarHBondContact O-N 3.18Å; I60-F64 PolarHBondContact O-N 3.01Å
61	Q	31.3	Very low	31.4	Very low	149 Å²	149	124 Å²	124	70%	0.696	65%	0.652	S	S	*	*	H	α-helix	trans	-62.3	-41.8	178.4	-71.5	-177	-18.8	0	0	112.2	K63 F64 H65	Q61-K63 PolarHBondContact O-N 3.16Å; Q61-F64 PolarHBondContact O-N 2.71Å; Q61-H65 PolarHBondContact O-N 3.18Å
62	N	34.3	Very low	31.9	Very low	106 Å²	106	121.3 Å²	121.3	57%	0.567	64%	0.637	S	S	*	*	H	α-helix	trans	-60.6	-43.7	178.4	-72.8	-13.8	0	0	0	112.4	I60 F64 H65 E66	I60-N62 PolarHBondContact O-N 3.43Å; N62-F64 VanDerWaalsContact C-N 3.34Å; N62-F64 PolarHBondContact O-N 3.03Å; N62-H65 PolarHBondContact O-N 3.3Å; N62-E66 WeakPolarHBondContact O-CB 3.37Å; N62-E66 PolarHBondContact O-N 3.34Å
63	K	33.7	Very low	32.5	Very low	152 Å²	152	116.9 Å²	116.9	66%	0.661	62%	0.619	S	S	*	*	H	α-helix	trans	-66.2	-33.7	177.9	-73.6	-174.8	176.2	-176.7	0	113.1	I60 Q61 S67	I60-K63 PolarHBondContact O-N 3.18Å; Q61-K63 PolarHBondContact O-N 3.16Å; K63-S67 WeakPolarHBondContact O-CB 3.39Å; K63-S67 PolarHBondContact O-N 3.31Å; K63-S67 VanDerWaalsContact O-N 3.16Å
64	F	32.8	Very low	33	Very low	147 Å²	147	112.2 Å²	112.2	65%	0.645	61%	0.61	S	S	*	*	H	α-helix	trans	-67.4	-45.8	174.2	-167.1	-96.2	0	0	0	111.2	I60 Q61 N62 E66 S67 L68	I60-F64 PolarHBondContact O-N 3.01Å; Q61-F64 PolarHBondContact O-N 2.71Å; N62-F64 VanDerWaalsContact C-N 3.34Å; N62-F64 PolarHBondContact O-N 3.03Å; F64-E66 PolarHBondContact O-N 3.45Å; F64-S67 PolarHBondContact O-N 3Å; F64-L68 WeakPolarHBondContact O-CB 3.45Å; F64-L68 PolarHBondContact O-N 3.07Å
65	H	35.6	Very low	33.2	Very low	134 Å²	134	112.3 Å²	112.3	62%	0.62	60%	0.597	S	S	*	*	H	α-helix	trans	-60.5	-42.7	175.5	-109.8	-78.2	0	0	0	113	Q61 N62 L68 S69	Q61-H65 PolarHBondContact O-N 3.18Å; N62-H65 PolarHBondContact O-N 3.3Å; H65-L68 PolarHBondContact O-N 3.27Å; H65-S69 VanDerWaalsContact O-CB 3.3Å; H65-S69 WeakPolarHBondContact O-CB 3.48Å; H65-S69 PolarHBondContact O-N 2.99Å
66	E	36.6	Very low	33.7	Very low	103 Å²	103	108.2 Å²	108.2	48%	0.481	58%	0.577	S	S	.	*	H	α-helix	trans	-65.6	-40	-179.9	-161.2	-166.2	158.4	0	0	112	N62 F64 K70	N62-E66 WeakPolarHBondContact O-CB 3.37Å; N62-E66 PolarHBondContact O-N 3.34Å; F64-E66 PolarHBondContact O-N 3.45Å; E66-K70 WeakPolarHBondContact O-CG 3.3Å; E66-K70 PolarHBondContact O-N 3.47Å; E66-K70 VanDerWaalsContact O-N 3.1Å; E66-K70 WeakPolarHBondContact OE1-CE 3.2Å; E66-K70 IonicContact OE1-NZ 3.76Å; E66-K70 PolarHBondContact OE1-NZ 2.87Å
67	S	34.6	Very low	34	Very low	83 Å²	83	110.1 Å²	110.1	58%	0.58	57%	0.568	S	S	*	*	H	α-helix	trans	-69.4	-43.3	176.7	-161.6	0	0	0	0	112	K63 F64 S69 K70 S71	K63-S67 WeakPolarHBondContact O-CB 3.39Å; K63-S67 PolarHBondContact O-N 3.31Å; K63-S67 VanDerWaalsContact O-N 3.16Å; F64-S67 PolarHBondContact O-N 3Å; S67-S69 PolarHBondContact O-N 2.97Å; S67-K70 PolarHBondContact O-N 3.43Å; S67-S71 PolarHBondContact O-N 3.39Å
68	L	35.4	Very low	34.1	Very low	82 Å²	82	107.1 Å²	107.1	43%	0.429	56%	0.561	S	S	.	*	H	α-helix	trans	-61.9	-43.5	175.7	-167.9	73.3	0	0	0	111.3	F64 H65 K70 S71 I72	F64-L68 WeakPolarHBondContact O-CB 3.45Å; F64-L68 PolarHBondContact O-N 3.07Å; H65-L68 PolarHBondContact O-N 3.27Å; L68-K70 PolarHBondContact O-N 3.29Å; L68-S71 PolarHBondContact O-N 2.78Å; L68-I72 HydrophobicContact CG-CD1 4.13Å; L68-I72 WeakPolarHBondContact O-CG1 3.49Å; L68-I72 PolarHBondContact O-N 2.86Å
69	S	36.7	Very low	34.1	Very low	74 Å²	74	108.6 Å²	108.6	52%	0.517	56%	0.558	S	S	.	*	H	α-helix	trans	-59.7	-46.8	176.2	-168.4	0	0	0	0	111.9	H65 S67 S71 I72 D73	H65-S69 VanDerWaalsContact O-CB 3.3Å; H65-S69 WeakPolarHBondContact O-CB 3.48Å; H65-S69 PolarHBondContact O-N 2.99Å; S67-S69 PolarHBondContact O-N 2.97Å; S69-S71 VanDerWaalsContact C-N 3.3Å; S69-S71 PolarHBondContact O-N 3.39Å; S69-I72 PolarHBondContact O-N 2.87Å; S69-D73 WeakPolarHBondContact O-CB 3.34Å; S69-D73 PolarHBondContact O-N 3.09Å
70	K	36.9	Very low	34	Very low	120 Å²	120	109 Å²	109	52%	0.522	56%	0.556	S	S	.	*	H	α-helix	trans	-65.1	-32.3	178.4	-72.8	171.5	-173.8	173.4	0	112.8	E66 S67 L68 L74	E66-K70 WeakPolarHBondContact O-CG 3.3Å; E66-K70 PolarHBondContact O-N 3.47Å; E66-K70 VanDerWaalsContact O-N 3.1Å; E66-K70 WeakPolarHBondContact OE1-CE 3.2Å; E66-K70 IonicContact OE1-NZ 3.76Å; E66-K70 PolarHBondContact OE1-NZ 2.87Å; S67-K70 PolarHBondContact O-N 3.43Å; L68-K70 PolarHBondContact O-N 3.29Å; K70-L74 PolarHBondContact O-N 3.32Å
71	S	33.4	Very low	33.9	Very low	77 Å²	77	111.1 Å²	111.1	54%	0.538	56%	0.563	S	S	.	*	H	α-helix	trans	-69.5	-43.8	174.7	-174.1	0	0	0	0	112.2	S67 L68 S69 H75	S67-S71 PolarHBondContact O-N 3.39Å; L68-S71 PolarHBondContact O-N 2.78Å; S69-S71 VanDerWaalsContact C-N 3.3Å; S69-S71 PolarHBondContact O-N 3.39Å; S71-H75 PolarHBondContact O-N 3.11Å
72	I	34.9	Very low	33.9	Very low	98 Å²	98	109.7 Å²	109.7	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-64	-45.5	176.1	-67.9	165.7	0	0	0	110.7	L68 S69 L74 H75 V76	L68-I72 HydrophobicContact CG-CD1 4.13Å; L68-I72 WeakPolarHBondContact O-CG1 3.49Å; L68-I72 PolarHBondContact O-N 2.86Å; S69-I72 PolarHBondContact O-N 2.87Å; I72-L74 VanDerWaalsContact C-N 3.31Å; I72-L74 PolarHBondContact O-N 2.57Å; I72-H75 CarbonylContact O-C 3.07Å; I72-H75 WeakPolarHBondContact O-CA 3.22Å; I72-H75 WeakPolarHBondContact O-CB 3.5Å; I72-H75 PolarHBondContact O-N 3.24Å; I72-V76 HydrophobicContact CG2-CG2 4.26Å; I72-V76 WeakPolarHBondContact O-CG2 3.48Å; I72-V76 PolarHBondContact O-N 2.99Å
73	D	35.1	Very low	33.5	Very low	72 Å²	72	109.7 Å²	109.7	39%	0.385	57%	0.571	S	S	.	*	H	α-helix	trans	-66.8	-31.2	-176.1	-164.6	58.9	0	0	0	113	S69 R77	S69-D73 WeakPolarHBondContact O-CB 3.34Å; S69-D73 PolarHBondContact O-N 3.09Å; D73-R77 PolarHBondContact O-N 2.96Å; D73-R77 VanDerWaalsContact O-N 3.15Å; D73-R77 IonicContact OD2-CZ 3.62Å; D73-R77 IonicContact OD2-NE 2.67Å; D73-R77 PolarHBondContact OD2-NE 2.82Å; D73-R77 IonicContact OD2-NH2 2.6Å; D73-R77 PolarHBondContact OD2-NH2 2.97Å
74	L	35.3	Very low	33	Very low	125 Å²	125	109.5 Å²	109.5	65%	0.654	58%	0.578	S	S	*	*	H	α-helix	trans	-65.9	-38.6	166.9	-84.9	165.8	0	0	0	112.5	K70 I72 A78	K70-L74 PolarHBondContact O-N 3.32Å; I72-L74 VanDerWaalsContact C-N 3.31Å; I72-L74 PolarHBondContact O-N 2.57Å; L74-A78 WeakPolarHBondContact O-CB 3.47Å; L74-A78 PolarHBondContact O-N 3.44Å; L74-A78 VanDerWaalsContact O-N 3.1Å
75	H	31	Very low	32.8	Very low	137 Å²	137	109.7 Å²	109.7	63%	0.634	59%	0.591	S	S	*	*	H	α-helix	trans	-75.7	-30.5	-179.7	-133.9	64.6	0	0	0	112.8	S71 I72 N79	S71-H75 PolarHBondContact O-N 3.11Å; I72-H75 CarbonylContact O-C 3.07Å; I72-H75 WeakPolarHBondContact O-CA 3.22Å; I72-H75 WeakPolarHBondContact O-CB 3.5Å; I72-H75 PolarHBondContact O-N 3.24Å; H75-N79 PolarHBondContact O-ND2 3.44Å
76	V	35.7	Very low	32.3	Very low	67 Å²	67	106.8 Å²	106.8	41%	0.406	60%	0.598	S	S	.	*	H	α-helix	trans	-67.9	-51.9	171.5	173.3	0	0	0	0	110.2	I72 A78 N79 E80	I72-V76 HydrophobicContact CG2-CG2 4.26Å; I72-V76 WeakPolarHBondContact O-CG2 3.48Å; I72-V76 PolarHBondContact O-N 2.99Å; V76-A78 PolarHBondContact O-N 3.11Å; V76-N79 PolarHBondContact O-N 2.92Å; V76-E80 HydrophobicContact CG1-CG 4.12Å; V76-E80 PolarHBondContact O-N 2.86Å
77	R	33.4	Very low	31.7	Very low	149 Å²	149	109.3 Å²	109.3	56%	0.562	62%	0.62	S	S	*	*	H	α-helix	trans	-62	-25.8	178	-79.6	-171.2	-97.5	171.2	-11.8	114.1	D73 N79	D73-R77 PolarHBondContact O-N 2.96Å; D73-R77 VanDerWaalsContact O-N 3.15Å; D73-R77 IonicContact OD2-CZ 3.62Å; D73-R77 IonicContact OD2-NE 2.67Å; D73-R77 PolarHBondContact OD2-NE 2.82Å; D73-R77 IonicContact OD2-NH2 2.6Å; D73-R77 PolarHBondContact OD2-NH2 2.97Å; R77-N79 VanDerWaalsContact C-N 3.31Å
78	A	32.9	Very low	31.3	Very low	62 Å²	62	110.1 Å²	110.1	51%	0.512	63%	0.632	S	S	.	*	H	α-helix	trans	-69.2	-25.5	171.7	0	0	0	0	0	113.7	L74 V76	L74-A78 WeakPolarHBondContact O-CB 3.47Å; L74-A78 PolarHBondContact O-N 3.44Å; L74-A78 VanDerWaalsContact O-N 3.1Å; V76-A78 PolarHBondContact O-N 3.11Å
79	N	31.8	Very low	30.8	Very low	102 Å²	102	114.2 Å²	114.2	55%	0.545	65%	0.652	S	S	.	*	H	α-helix	trans	-100.2	-30.2	-177.8	-75.3	-77.3	0	0	0	113.4	H75 V76 R77 H81 V82	H75-N79 PolarHBondContact O-ND2 3.44Å; V76-N79 PolarHBondContact O-N 2.92Å; R77-N79 VanDerWaalsContact C-N 3.31Å; N79-H81 PolarHBondContact O-N 3.49Å; N79-V82 PolarHBondContact O-N 3.21Å
80	E	31.1	Very low	30.1	Very low	123 Å²	123	114.5 Å²	114.5	58%	0.575	66%	0.659	S	S	*	*	H	α-helix	trans	-62.6	-24	177.3	-71.8	-173	127.4	0	0	113.5	V76 V82 C83	V76-E80 HydrophobicContact CG1-CG 4.12Å; V76-E80 PolarHBondContact O-N 2.86Å; E80-V82 PolarHBondContact O-N 2.85Å; E80-C83 PolarHBondContact O-N 3.14Å
81	H	30.2	Very low	29.5	Very low	172 Å²	172	117.4 Å²	117.4	80%	0.796	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-4.3	177.4	-98.6	-73.8	0	0	0	115.3	N79	N79-H81 PolarHBondContact O-N 3.49Å
82	V	29.6	Very low	29	Very low	118 Å²	118	120.5 Å²	120.5	72%	0.715	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-12.7	-179.3	-176.8	0	0	0	0	112.8	N79 E80	N79-V82 PolarHBondContact O-N 3.21Å; E80-V82 PolarHBondContact O-N 2.85Å
83	C	26.3	Very low	28.5	Very low	106 Å²	106	125.1 Å²	125.1	72%	0.716	70%	0.702	S	S	*	*	S	Bend	trans	-127	47.7	-170.3	-71.7	0	0	0	0	114.3	E80	E80-C83 PolarHBondContact O-N 3.14Å
84	N	24.3	Very low	27.9	Very low	149 Å²	149	125.5 Å²	125.5	80%	0.797	71%	0.71	S	S	*	*			trans	-149.6	42.7	177.1	-108.6	-42.6	0	0	0	117.2
85	T	27.6	Very low	27.4	Very low	150 Å²	150	126.4 Å²	126.4	92%	0.92	72%	0.716	S	S	*	*			trans	-148	140.3	156.8	45.3	0	0	0	0	109
86	G	26.2	Very low	27.2	Very low	74 Å²	74	125.5 Å²	125.5	76%	0.763	72%	0.72	S	S	*	*			cis	174.6	135	-11.2	0	0	0	0	0	109.3
87	V	23.5	Very low	26.6	Very low	155 Å²	155	128.5 Å²	128.5	94%	0.939	74%	0.738	S	S	*	*			trans	-105	105.6	-178.2	178.6	0	0	0	0	110.4
88	A	26.2	Very low	26.5	Very low	101 Å²	101	126.4 Å²	126.4	84%	0.835	74%	0.744	S	S	*	*			trans	-152	140.4	169.8	0	0	0	0	0	111.9
89	I	24.7	Very low	26.1	Very low	167 Å²	167	130.9 Å²	130.9	86%	0.856	76%	0.758	S	S	*	*			trans	-78.7	129.9	-163.4	-65.2	160.6	0	0	0	113.7
90	A	22.6	Very low	25.8	Very low	81 Å²	81	131.8 Å²	131.8	67%	0.669	77%	0.771	S	S	*	*			trans	64.6	157.4	144.8	0	0	0	0	0	124.3
91	E	23	Very low	25.4	Very low	181 Å²	181	131.9 Å²	131.9	85%	0.846	78%	0.776	S	S	*	*			trans	74.6	108.5	161	-71.7	171.8	-156.6	0	0	121.1
92	D	22.8	Very low	25.3	Very low	141 Å²	141	129 Å²	129	75%	0.754	77%	0.773	S	S	*	*			trans	27	123	147.3	-56.1	-7.6	0	0	0	122.2
93	F	25.7	Very low	25	Very low	196 Å²	196	131.1 Å²	131.1	86%	0.86	77%	0.772	S	S	*	*				-175	165.5	94.5	-109.1	-84.5	0	0	0	113.3
94	S	22.1	Very low	24.9	Very low	80 Å²	80	132.8 Å²	132.8	56%	0.559	78%	0.778	S	S	*	*			trans	-80.2	167	-165.7	56.7	0	0	0	0	118.7
95	N	25	Very low	24.7	Very low	144 Å²	144	131.4 Å²	131.4	77%	0.77	77%	0.767	S	S	*	*			trans	80.4	143.3	160	-55.1	-33.6	0	0	0	116.6
96	T	26.6	Very low	24.4	Very low	117 Å²	117	133.6 Å²	133.6	72%	0.718	76%	0.764	S	S	*	*			cis	-161	134	-4.2	18.4	0	0	0	0	107
97	V	23.7	Very low	24.2	Very low	130 Å²	130	134.4 Å²	134.4	79%	0.788	76%	0.759	S	S	*	*				70	132.6	70.2	167.7	0	0	0	0	113.9
98	P	31.1	Very low	24	Very low	106 Å²	106	133.4 Å²	133.4	69%	0.688	76%	0.757	S	S	*	*			cis	-143.8	-146.1	-19.7	41.7	-19.4	0	0	0	114.5
99	L	23.9	Very low	23.9	Very low	156 Å²	156	135 Å²	135	82%	0.817	76%	0.756	S	S	*	*			trans	91.2	126.5	171.6	-53.2	170.3	0	0	0	115.4
100	C	25.5	Very low	23.7	Very low	121 Å²	121	138.8 Å²	138.8	82%	0.818	76%	0.76	S	S	*	*			cis	-142.1	155.1	-4.2	-99.7	0	0	0	0	111
101	N	21.7	Very low	23.8	Very low	125 Å²	125	140.8 Å²	140.8	67%	0.668	77%	0.769	S	S	*	*			trans	-133.2	156.5	174.3	-165.8	-2	0	0	0	107.7	K103	N101-K103 PolarHBondContact OD1-N 3.41Å
102	P	29.1	Very low	23.8	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	76%	0.764	S	S	*	*				-149.2	119.5	111	34.5	-16.3	0	0	0	116.4
103	K	23.3	Very low	23.9	Very low	162 Å²	162	139.1 Å²	139.1	70%	0.704	77%	0.768	S	S	*	*				68.4	143.9	125.8	-64.7	178	179.4	-175.7	0	117	N101	N101-K103 PolarHBondContact OD1-N 3.41Å
104	V	24.6	Very low	23.7	Very low	140 Å²	140	137.5 Å²	137.5	85%	0.848	77%	0.769	S	S	*	*			cis	-124.8	131.8	36	171.5	0	0	0	0	113
105	E	19.3	Very low	23.8	Very low	121 Å²	121	138.8 Å²	138.8	57%	0.565	78%	0.777	S	S	*	*			trans	-84	156.6	165.5	-64.2	158.4	117.7	0	0	108.8
106	F	22.7	Very low	23.6	Very low	195 Å²	195	140.3 Å²	140.3	86%	0.855	79%	0.785	S	S	*	*				-169.5	159.3	82.4	-78.6	-84.5	0	0	0	108.6
107	S	21.8	Very low	23.3	Very low	92 Å²	92	141.9 Å²	141.9	64%	0.643	79%	0.787	S	S	*	*			cis	-170.8	128	-28.8	50.4	0	0	0	0	107.1
108	C	19	Very low	23.2	Very low	133 Å²	133	141.8 Å²	141.8	90%	0.899	79%	0.786	S	S	*	*			trans	-93.2	118.7	177	-157.2	0	0	0	0	109.7
109	T	22.9	Very low	22.5	Very low	135 Å²	135	143.2 Å²	143.2	83%	0.828	79%	0.793	S	S	*	*			trans	-97.3	137.6	168.8	44.3	0	0	0	0	110
110	R	20.2	Very low	22.9	Very low	246 Å²	246	141 Å²	141	93%	0.928	79%	0.788	S	S	*	*			trans	-130.4	112.1	-174.1	-177.6	-178.8	-176.3	178.1	0.7	108.6
111	S	26.1	Very low	22.7	Very low	123 Å²	123	141.4 Å²	141.4	86%	0.86	78%	0.782	S	S	*	*			trans	-115.2	159.3	167.6	53.3	0	0	0	0	109.8
112	S	23	Very low	22.6	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	79%	0.785	S	S	*	*			trans	-107.5	-175.5	-163.9	45.9	0	0	0	0	113.6
113	E	25.1	Very low	22.1	Very low	182 Å²	182	144.4 Å²	144.4	85%	0.85	79%	0.789	S	S	*	*			trans	93.1	150.4	161.4	-53.6	-170	168.3	0	0	118
114	D	21.7	Very low	22.1	Very low	163 Å²	163	142 Å²	142	87%	0.872	79%	0.788	S	S	*	*			trans	-85.7	143.5	-165.4	-55.9	-86.9	0	0	0	113
115	S	23.4	Very low	21.9	Very low	106 Å²	106	143.8 Å²	143.8	74%	0.741	79%	0.787	S	S	*	*			trans	-165.1	141	145	28.7	0	0	0	0	112.5
116	L	21.5	Very low	21.9	Very low	176 Å²	176	142.3 Å²	142.3	92%	0.921	80%	0.795	S	S	*	*			trans	-77.8	114.4	165.1	-78.8	129.8	0	0	0	109.1
117	I	20.6	Very low	21.8	Very low	151 Å²	151	140.5 Å²	140.5	77%	0.774	79%	0.793	S	S	*	*			trans	-131.4	134.4	163.3	-62.5	-175.5	0	0	0	109.1
118	V	19.9	Very low	21.9	Very low	127 Å²	127	142.2 Å²	142.2	77%	0.77	80%	0.8	S	S	*	*			trans	-113.1	173	172.5	180	0	0	0	0	107
119	V	17.8	Very low	22	Very low	136 Å²	136	140.4 Å²	140.4	82%	0.824	79%	0.788	S	S	*	*			trans	108.2	142	175.5	179.4	0	0	0	0	112.1
120	P	30.8	Very low	22.1	Very low	110 Å²	110	139 Å²	139	71%	0.714	78%	0.783	S	S	*	*			trans	-126	-105.1	-140	40.3	-22.1	0	0	0	116.3
121	D	21.7	Very low	22.2	Very low	129 Å²	129	134.8 Å²	134.8	69%	0.69	77%	0.774	S	S	*	*			trans	72.8	136	-173.3	-53.3	-23.9	0	0	0	115
122	I	19.6	Very low	22.4	Very low	143 Å²	143	133.1 Å²	133.1	73%	0.733	76%	0.761	S	S	*	*			cis	84	130	34.8	-52.7	162.7	0	0	0	112.3
123	I	19.7	Very low	22.4	Very low	158 Å²	158	134.6 Å²	134.6	81%	0.81	76%	0.76	S	S	*	*			trans	81.7	146.6	174.6	-55.4	-173.8	0	0	0	116.4
124	T	21.7	Very low	22.3	Very low	110 Å²	110	135.1 Å²	135.1	68%	0.675	77%	0.765	S	S	*	*			cis	-168.1	166.8	-35	-76.3	0	0	0	0	107.5
125	E	21.4	Very low	22.4	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	76%	0.755	S	S	*	*			trans	-4.5	134.4	167.8	-64.2	-178	129.7	0	0	123.6
126	A	20	Very low	22.3	Very low	89 Å²	89	137.1 Å²	137.1	74%	0.736	76%	0.757	S	S	*	*				92.5	164.8	122.9	0	0	0	0	0	123.9
127	L	20.5	Very low	22.4	Very low	157 Å²	157	133.9 Å²	133.9	82%	0.822	75%	0.749	S	S	*	*			trans	87.1	125.4	172.7	-54.1	179.1	0	0	0	116.4
128	V	22.2	Very low	22.5	Very low	129 Å²	129	132.3 Å²	132.3	78%	0.782	75%	0.751	S	S	*	*			cis	111.3	144.7	27.7	157.4	0	0	0	0	110.5
129	C	22.1	Very low	22.5	Very low	95 Å²	95	136.4 Å²	136.4	64%	0.642	76%	0.758	S	S	*	*			cis	-106.7	-121.1	2	-161.2	0	0	0	0	111.4
130	S	25.5	Very low	22.8	Very low	104 Å²	104	135.7 Å²	135.7	73%	0.727	76%	0.759	S	S	*	*			cis	-172.6	163.8	-6.1	8.4	0	0	0	0	108
131	E	22.7	Very low	22.4	Very low	158 Å²	158	134.2 Å²	134.2	74%	0.738	76%	0.764	S	S	*	*			cis	178.3	173.3	-23.3	-108.5	-172.5	-106	0	0	107.4
132	P	30.3	Very low	22.4	Very low	89 Å²	89	136.4 Å²	136.4	58%	0.578	78%	0.775	S	S	*	*			cis	-134.4	-168.4	-36.4	37.8	-19.3	0	0	0	113.4
133	N	21.7	Very low	22.5	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	78%	0.78	S	S	*	*			trans	71.1	99.4	155.9	-65.7	-27.5	0	0	0	122
134	M	23.6	Very low	22.8	Very low	193 Å²	193	139 Å²	139	95%	0.951	79%	0.785	S	S	*	*				-143.6	154	111.9	-87.7	-147.4	73.4	0	0	109.8
135	Q	22.9	Very low	22.8	Very low	143 Å²	143	138.4 Å²	138.4	67%	0.668	79%	0.786	S	S	*	*			trans	-115.6	159	-170.1	-71	-167.8	-7.1	0	0	113.8
136	Q	22.6	Very low	23	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	78%	0.783	S	S	*	*			trans	65.6	126	161.2	-65	163.3	38	0	0	115.5
137	S	22.6	Very low	23.2	Very low	108 Å²	108	136.2 Å²	136.2	76%	0.755	78%	0.782	S	S	*	*				-170.2	174.3	61.9	45.6	0	0	0	0	113.6
138	C	23.4	Very low	23.4	Very low	119 Å²	119	137 Å²	137	80%	0.804	78%	0.782	S	S	*	*			trans	68.7	82.6	161.5	-63.1	0	0	0	0	119.5
139	F	20.8	Very low	23.5	Very low	212 Å²	212	136.2 Å²	136.2	93%	0.93	78%	0.777	S	S	*	*			trans	-65.1	128.9	144.5	-101	-106.2	0	0	0	110.6
140	S	22.8	Very low	23.7	Very low	121 Å²	121	141.8 Å²	141.8	85%	0.846	79%	0.791	S	S	*	*			trans	167.3	130.2	137.7	42.5	0	0	0	0	110.4
141	G	22.8	Very low	23.7	Very low	79 Å²	79	145 Å²	145	81%	0.814	79%	0.794	S	S	*	*			trans	150.2	5.6	177.8	0	0	0	0	0	118.6	N143	G141-N143 PolarHBondContact O-N 3.15Å; G141-N143 VanDerWaalsContact O-N 3.09Å
142	L	22	Very low	23.8	Very low	175 Å²	175	145.8 Å²	145.8	92%	0.916	80%	0.798	S	S	*	*			trans	-79.8	90.4	177.1	-79.8	169.9	0	0	0	111.8
143	N	22.4	Very low	23.5	Very low	158 Å²	158	150.6 Å²	150.6	85%	0.845	82%	0.815	S	S	*	*			trans	-161.5	65.6	160.4	-114.1	-16.3	0	0	0	112.7	G141	G141-N143 PolarHBondContact O-N 3.15Å; G141-N143 VanDerWaalsContact O-N 3.09Å
144	Q	25.5	Very low	23.7	Very low	197 Å²	197	146.7 Å²	146.7	92%	0.921	80%	0.802	S	S	*	*			trans	-155.7	142.6	159.8	-113	158.7	53.9	0	0	110.1
145	S	22	Very low	23.9	Very low	98 Å²	98	142.3 Å²	142.3	69%	0.685	78%	0.782	S	S	*	*			trans	-90.2	123.1	-166.9	49	0	0	0	0	113	S147	S145-S147 VanDerWaalsContact C-N 3.26Å; S145-S147 PolarHBondContact O-N 2.91Å
146	P	24.6	Very low	24.6	Very low	118 Å²	118	142.1 Å²	142.1	77%	0.766	78%	0.784	S	S	*	*			trans	-81.5	67.9	176.3	34.3	-35.5	0	0	0	111.6	Q148	P146-Q148 VanDerWaalsContact C-N 3.32Å
147	S	24.2	Very low	26.1	Very low	104 Å²	104	141 Å²	141	73%	0.727	77%	0.774	S	S	*	*			trans	-97.4	37.2	172.5	60.4	0	0	0	0	112.1	S145	S145-S147 VanDerWaalsContact C-N 3.26Å; S145-S147 PolarHBondContact O-N 2.91Å
148	Q	24.9	Very low	27.8	Very low	174 Å²	174	137.1 Å²	137.1	81%	0.813	74%	0.744	S	S	*	*	S	Bend	trans	-163.1	69.5	-177.2	-109.1	169.3	1.1	0	0	109.8	P146	P146-Q148 VanDerWaalsContact C-N 3.32Å
149	T	23.7	Very low	29.7	Very low	112 Å²	112	133.5 Å²	133.5	69%	0.687	72%	0.721	S	S	*	*	S	Bend	trans	-161.8	22.7	176.8	-11.2	0	0	0	0	115.8
150	K	26.1	Very low	31.9	Very low	212 Å²	212	127.6 Å²	127.6	92%	0.922	69%	0.694	S	S	*	*	S	Bend	trans	-133.5	19.2	-179.6	-82.5	-164.9	171.8	-172.6	0	114.9
151	Q	26.2	Very low	33.9	Very low	173 Å²	173	123.5 Å²	123.5	81%	0.808	66%	0.664	S	S	*	*	S	Bend	trans	-147.3	26.4	-168.2	-148.5	164.8	3.5	0	0	114.5
152	E	25.2	Very low	35.8	Very low	174 Å²	174	128.4 Å²	128.4	81%	0.813	67%	0.67	S	S	*	*	S	Bend	trans	-130.3	17.6	-173.6	-64.4	-172.2	132.2	0	0	114.5
153	M	23.7	Very low	38.4	Very low	189 Å²	189	123.5 Å²	123.5	93%	0.931	65%	0.645	S	S	*	*	S	Bend	trans	-130	19.4	-175.8	-83.7	-169.4	164.3	0	0	115.5
154	A	25.1	Very low	41.2	Very low	54 Å²	54	118 Å²	118	45%	0.446	62%	0.618	S	S	.	*	S	Bend	trans	-122.2	-27.7	-175.2	0	0	0	0	0	116.4	Y157	A154-Y157 WeakPolarHBondContact O-CE2 3.45Å
155	D	28.9	Very low	44	Very low	101 Å²	101	112.7 Å²	112.7	54%	0.54	60%	0.596	S	S	.	*	S	Bend	trans	-112.3	19	-148.6	-65.5	-52.6	0	0	0	118
156	I	37.2	Very low	47	Very low	139 Å²	139	111 Å²	111	71%	0.713	58%	0.582	S	S	*	*			trans	-138	74.1	177.7	-42.5	178.9	0	0	0	112.7
157	Y	54	Low	49.9	Very low	143 Å²	143	106.2 Å²	106.2	56%	0.561	55%	0.551	S	S	*	*	S	Bend	trans	-94.5	-14.8	171.6	-65.7	-69	0	0	0	114.4	A154	A154-Y157 WeakPolarHBondContact O-CE2 3.45Å
158	L	57.7	Low	52.9	Low	27 Å²	27	101.4 Å²	101.4	14%	0.141	52%	0.517	C	S	.	.			trans	-154.6	136.6	176.5	-160.6	78.5	0	0	0	108.3	Y549 L551 F590 C591 A594	L158-Y549 HydrophobicContact CD2-CD1 3.45Å; L158-Y549 VanDerWaalsContact CD2-CD1 3.45Å; L158-Y549 HydrophobicContact CD2-CE1 4.13Å; L158-Y549 HydrophobicContact CD2-CG 3.91Å; L158-Y549 HydrophobicContact CG-CD1 3.96Å; L158-Y549 HydrophobicContact CG-CG 4.35Å; L158-L551 HydrophobicContact CD1-CB 4.31Å; L158-L551 HydrophobicContact CD1-CD1 3.94Å; L158-F590 HydrophobicContact CB-CE1 4.03Å; L158-F590 HydrophobicContact CB-CZ 4.42Å; L158-F590 HydrophobicContact CD1-CD1 4.27Å; L158-F590 HydrophobicContact CD1-CE1 3.99Å; L158-F590 HydrophobicContact CD2-CD1 4.3Å; L158-F590 HydrophobicContact CD2-CE1 4.36Å; L158-F590 HydrophobicContact CG-CE1 4.36Å; L158-C591 HydrophobicContact CD2-CB 4.17Å; L158-A594 HydrophobicContact CD2-CB 3.79Å
159	S	63.5	Low	55.9	Low	44 Å²	44	100.3 Å²	100.3	31%	0.308	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.7	177.1	60.2	0	0	0	0	112.1	T161 N550	S159-T161 PolarHBondContact O-N 2.7Å; S159-N550 PolarHBondContact N-O 3.26Å; S159-N550 PolarHBondContact O-N 3.03Å
160	K	67	Low	59	Low	87 Å²	87	100.9 Å²	100.9	38%	0.378	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	130.1	173.2	-73	-176.3	-169.9	148.6	0	110.5	G548 Y549 E598	K160-G548 WeakPolarHBondContact CA-O 3.45Å; K160-Y549 HydrophobicContact CD-CE1 4.23Å; K160-Y549 WeakPolarHBondContact CE-OH 3.38Å; K160-Y549 HydrophobicContact CG-CD1 3.91Å; K160-Y549 HydrophobicContact CG-CE1 3.55Å; K160-E598 VanDerWaalsContact CD-OE2 3.25Å; K160-E598 WeakPolarHBondContact CD-OE2 3.13Å; K160-E598 VanDerWaalsContact CE-OE2 3.24Å; K160-E598 WeakPolarHBondContact CE-OE2 3.04Å; K160-E598 IonicContact NZ-OE2 2.59Å; K160-E598 PolarHBondContact NZ-OE2 3.1Å
161	T	65.8	Low	61.9	Low	35 Å²	35	90.9 Å²	90.9	22%	0.215	46%	0.455	C	S	.	.			trans	-91.3	124.3	-175.5	52.7	0	0	0	0	112.3	S159 L545 G548 N550	S159-T161 PolarHBondContact O-N 2.7Å; T161-L545 HydrophobicContact CG2-CD1 3.74Å; T161-G548 PolarHBondContact N-O 3.31Å; T161-G548 PolarHBondContact OG1-O 2.8Å; T161-N550 HydrophobicContact CG2-CB 3.51Å
162	I	61.3	Low	65	Low	182 Å²	182	84.8 Å²	84.8	93%	0.933	43%	0.43	S	S	*	.	S	Bend	trans	-83	-29.4	167	-58	173	0	0	0	110.7
163	D	78.3	Confident	68	Low	73 Å²	73	82.6 Å²	82.6	39%	0.39	42%	0.424	S	S	.	.			trans	-123.7	111.5	177.8	174.2	8.8	0	0	0	110.5	D165 T166 C167	D163-D165 PolarHBondContact OD1-N 3.21Å; D163-T166 PolarHBondContact OD1-N 3.07Å; D163-T166 VanDerWaalsContact OD1-N 3.15Å; D163-T166 WeakPolarHBondContact OD2-CB 3.49Å; D163-T166 PolarHBondContact OD2-OG1 3.36Å; D163-C167 PolarHBondContact O-SG 3.09Å
164	S	80.5	Confident	71	Confident	41 Å²	41	77.4 Å²	77.4	29%	0.287	40%	0.4	S	S	.	.	H	α-helix	trans	-77.9	-29.7	175.3	54.2	0	0	0	0	113.4	C167 L168	S164-C167 PolarHBondContact O-N 3.26Å; S164-L168 WeakPolarHBondContact O-CG 3.41Å; S164-L168 PolarHBondContact O-N 3.13Å
165	D	83.5	Confident	74	Confident	86 Å²	86	76.5 Å²	76.5	46%	0.46	39%	0.386	S	S	.	.	H	α-helix	trans	-74.1	-38.3	-171.9	-75.7	-10.3	0	0	0	111.8	D163 C167 L168 R169	D163-D165 PolarHBondContact OD1-N 3.21Å; D165-C167 VanDerWaalsContact C-N 3.27Å; D165-C167 PolarHBondContact O-N 3.29Å; D165-L168 PolarHBondContact O-N 2.96Å; D165-R169 WeakPolarHBondContact O-CG 3.29Å; D165-R169 PolarHBondContact O-N 3.33Å; D165-R169 VanDerWaalsContact O-N 3.14Å
166	T	85.2	Confident	76.6	Confident	62 Å²	62	76.4 Å²	76.4	38%	0.38	39%	0.391	S	S	.	.	H	α-helix	trans	-64.5	-34.3	170.7	-66.7	0	0	0	0	111.6	D163 K170	D163-T166 PolarHBondContact OD1-N 3.07Å; D163-T166 VanDerWaalsContact OD1-N 3.15Å; D163-T166 WeakPolarHBondContact OD2-CB 3.49Å; D163-T166 PolarHBondContact OD2-OG1 3.36Å; T166-K170 PolarHBondContact O-N 2.97Å
167	C	85.8	Confident	78.7	Confident	18 Å²	18	77.3 Å²	77.3	12%	0.122	40%	0.398	C	S	.	.	H	α-helix	trans	-71.7	-43.4	177	-61.2	0	0	0	0	111.7	D163 S164 D165 R169 K170 I171 L545	D163-C167 PolarHBondContact O-SG 3.09Å; S164-C167 PolarHBondContact O-N 3.26Å; D165-C167 VanDerWaalsContact C-N 3.27Å; D165-C167 PolarHBondContact O-N 3.29Å; C167-R169 VanDerWaalsContact C-N 3.34Å; C167-R169 PolarHBondContact O-N 3.18Å; C167-K170 PolarHBondContact O-N 3.46Å; C167-I171 WeakPolarHBondContact O-CG1 3.27Å; C167-I171 PolarHBondContact O-N 3.1Å; C167-I171 VanDerWaalsContact O-N 3.13Å; C167-L545 HydrophobicContact CB-CD1 3.68Å; C167-L545 HydrophobicContact CB-CD2 3.69Å; C167-L545 HydrophobicContact CB-CG 4.38Å
168	L	87.5	Confident	80.1	Confident	3 Å²	3	71.1 Å²	71.1	2%	0.016	37%	0.373	C	S	.	.	H	α-helix	trans	-56.8	-44.8	174.9	-75.5	169.7	0	0	0	112.2	S164 D165 K170 I171 V172 I180 F181 F184 L545	S164-L168 WeakPolarHBondContact O-CG 3.41Å; S164-L168 PolarHBondContact O-N 3.13Å; D165-L168 PolarHBondContact O-N 2.96Å; L168-K170 PolarHBondContact O-N 3.47Å; L168-I171 PolarHBondContact O-N 2.8Å; L168-V172 WeakPolarHBondContact O-CG2 3.44Å; L168-V172 PolarHBondContact O-N 2.69Å; L168-I180 HydrophobicContact CD2-CG2 3.92Å; L168-F181 HydrophobicContact CB-CE1 3.91Å; L168-F181 HydrophobicContact CB-CZ 4.47Å; L168-F181 HydrophobicContact CD1-CD1 4.19Å; L168-F181 HydrophobicContact CD1-CE1 3.99Å; L168-F181 HydrophobicContact CG-CE1 4.47Å; L168-F184 HydrophobicContact CD1-CD1 3.67Å; L168-F184 HydrophobicContact CD1-CE1 3.67Å; L168-F184 HydrophobicContact CD1-CG 4.29Å; L168-F184 HydrophobicContact CD1-CZ 4.3Å; L168-F184 HydrophobicContact CD2-CB 4.02Å; L168-F184 HydrophobicContact CD2-CD1 4.04Å; L168-F184 HydrophobicContact CD2-CD2 4.01Å; L168-F184 HydrophobicContact CD2-CE1 4.46Å; L168-F184 HydrophobicContact CD2-CE2 4.43Å; L168-F184 HydrophobicContact CD2-CG 3.78Å; L168-F184 HydrophobicContact CG-CD1 4.43Å; L168-F184 HydrophobicContact CG-CE1 4.48Å; L168-L545 HydrophobicContact CD2-CD2 3.81Å; L168-L545 HydrophobicContact CG-CD2 3.78Å
169	R	87.7	Confident	81.4	Confident	152 Å²	152	71.8 Å²	71.8	57%	0.574	38%	0.38	S	S	*	.	H	α-helix	trans	-59.2	-46.2	178.5	-69.8	174.5	-149.4	-174.1	7.9	111.8	D165 C167 I171 V172 D173	D165-R169 WeakPolarHBondContact O-CG 3.29Å; D165-R169 PolarHBondContact O-N 3.33Å; D165-R169 VanDerWaalsContact O-N 3.14Å; C167-R169 VanDerWaalsContact C-N 3.34Å; C167-R169 PolarHBondContact O-N 3.18Å; R169-I171 VanDerWaalsContact C-N 3.33Å; R169-I171 PolarHBondContact O-N 3.23Å; R169-V172 WeakPolarHBondContact O-CA 3.43Å; R169-V172 WeakPolarHBondContact O-CB 3.46Å; R169-V172 PolarHBondContact O-N 3.39Å; R169-D173 PolarHBondContact O-N 3.04Å
170	K	88.1	Confident	82.6	Confident	123 Å²	123	69.9 Å²	69.9	54%	0.535	37%	0.366	S	S	.	.	H	α-helix	trans	-58.2	-43.6	175.5	-69	178.4	179.9	-177.7	0	112.4	T166 C167 L168 V172 D173 D174	T166-K170 PolarHBondContact O-N 2.97Å; C167-K170 PolarHBondContact O-N 3.46Å; L168-K170 PolarHBondContact O-N 3.47Å; K170-V172 PolarHBondContact O-N 3.05Å; K170-D173 PolarHBondContact O-N 3.25Å; K170-D174 WeakPolarHBondContact O-CB 3.42Å; K170-D174 PolarHBondContact O-N 2.8Å; K170-D174 VanDerWaalsContact O-OD2 3.11Å
171	I	88.4	Confident	83.5	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.01	37%	0.368	C	S	.	.	H	α-helix	trans	-62.7	-33.2	176.5	-57.5	165.6	0	0	0	110.7	C167 L168 R169 H175 I180 P538 R541 V542 L545	C167-I171 WeakPolarHBondContact O-CG1 3.27Å; C167-I171 PolarHBondContact O-N 3.1Å; C167-I171 VanDerWaalsContact O-N 3.13Å; L168-I171 PolarHBondContact O-N 2.8Å; R169-I171 VanDerWaalsContact C-N 3.33Å; R169-I171 PolarHBondContact O-N 3.23Å; I171-H175 WeakPolarHBondContact O-CB 3.49Å; I171-H175 PolarHBondContact O-N 3.05Å; I171-I180 VanDerWaalsContact C-CD1 3.46Å; I171-I180 HydrophobicContact CB-CD1 4.38Å; I171-I180 HydrophobicContact CG2-CD1 3.78Å; I171-I180 HydrophobicContact CG2-CG1 4.05Å; I171-I180 HydrophobicContact CG2-CG2 4.29Å; I171-I180 WeakPolarHBondContact O-CD1 3.41Å; I171-P538 HydrophobicContact CG2-CB 4.48Å; I171-R541 HydrophobicContact CD1-CB 4.16Å; I171-R541 HydrophobicContact CG1-CB 4.49Å; I171-V542 HydrophobicContact CD1-CG2 4.33Å; I171-V542 HydrophobicContact CG2-CG2 4.13Å; I171-L545 HydrophobicContact CD1-CD2 3.87Å
172	V	90.8	Very high	84.4	Confident	45 Å²	45	73.4 Å²	73.4	27%	0.273	38%	0.38	S	S	.	.	H	α-helix	trans	-70.8	-41.4	175.7	172.6	0	0	0	0	112.1	L168 R169 K170 D174 H175 P176 I180 F181	L168-V172 WeakPolarHBondContact O-CG2 3.44Å; L168-V172 PolarHBondContact O-N 2.69Å; R169-V172 WeakPolarHBondContact O-CA 3.43Å; R169-V172 WeakPolarHBondContact O-CB 3.46Å; R169-V172 PolarHBondContact O-N 3.39Å; K170-V172 PolarHBondContact O-N 3.05Å; V172-D174 VanDerWaalsContact C-N 3.32Å; V172-H175 CarbonylContact O-C 3.5Å; V172-H175 PolarHBondContact O-N 2.9Å; V172-P176 WeakPolarHBondContact O-CA 3.25Å; V172-I180 VanDerWaalsContact CA-CD1 3.4Å; V172-I180 HydrophobicContact CB-CD1 4.08Å; V172-I180 HydrophobicContact CG2-CB 3.87Å; V172-I180 HydrophobicContact CG2-CD1 3.58Å; V172-I180 HydrophobicContact CG2-CG1 4.35Å; V172-I180 HydrophobicContact CG2-CG2 3.88Å; V172-F181 HydrophobicContact CG2-CD2 4.21Å; V172-F181 HydrophobicContact CG2-CE2 3.7Å; V172-F181 HydrophobicContact CG2-CZ 4.14Å
173	D	88.5	Confident	85.5	Confident	128 Å²	128	64.8 Å²	64.8	68%	0.684	34%	0.336	S	S	*	.	H	α-helix	trans	-64.5	-38.3	174.5	-59.9	-38.7	0	0	0	111.2	R169 K170	R169-D173 PolarHBondContact O-N 3.04Å; K170-D173 PolarHBondContact O-N 3.25Å
174	D	86.9	Confident	85.9	Confident	80 Å²	80	61.9 Å²	61.9	43%	0.428	32%	0.32	S	S	.	.	H	α-helix	trans	-70.3	-35	176.2	-66.1	-36.5	0	0	0	113.3	K170 V172 R541	K170-D174 WeakPolarHBondContact O-CB 3.42Å; K170-D174 PolarHBondContact O-N 2.8Å; K170-D174 VanDerWaalsContact O-OD2 3.11Å; V172-D174 VanDerWaalsContact C-N 3.32Å; D174-R541 IonicContact OD2-CZ 2.7Å; D174-R541 IonicContact OD2-NH1 3.26Å; D174-R541 PolarHBondContact OD2-NH1 3.25Å; D174-R541 IonicContact OD2-NH2 3.54Å; D174-R541 PolarHBondContact OD2-NH2 2.99Å
175	H	87.6	Confident	86.1	Confident	35 Å²	35	65.9 Å²	65.9	16%	0.162	33%	0.334	C	S	.	.			trans	-138.9	61.6	-168.8	-53	-63.4	0	0	0	113.4	I171 V172 N177 F178 I180 P538 R541	I171-H175 WeakPolarHBondContact O-CB 3.49Å; I171-H175 PolarHBondContact O-N 3.05Å; V172-H175 CarbonylContact O-C 3.5Å; V172-H175 PolarHBondContact O-N 2.9Å; H175-N177 PolarHBondContact O-N 3.31Å; H175-F178 HydrophobicContact CB-CB 4.43Å; H175-F178 PolarHBondContact O-N 3.13Å; H175-I180 HydrophobicContact CB-CD1 4.29Å; H175-P538 HydrophobicContact CB-CB 3.98Å; H175-P538 HydrophobicContact CB-CG 4.22Å; H175-R541 PolarHBondContact CD2-NH1 2.89Å; H175-R541 VanDerWaalsContact CD2-NH1 3.32Å; H175-R541 PolarHBondContact NE2-NH1 3.46Å
176	P	83.6	Confident	86.1	Confident	99 Å²	99	63.8 Å²	63.8	64%	0.643	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.1	-171.6	25.2	-36.2	0	0	0	115.1	V172	V172-P176 WeakPolarHBondContact O-CA 3.25Å
177	N	81	Confident	86	Confident	159 Å²	159	61.4 Å²	61.4	85%	0.85	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-5.2	177.9	-66.7	-23.9	0	0	0	113.8	H175	H175-N177 PolarHBondContact O-N 3.31Å
178	F	84.6	Confident	85.8	Confident	12 Å²	12	64.3 Å²	64.3	5%	0.053	32%	0.317	C	S	.	.	S	Bend	trans	-101.1	137	179.8	-163.9	-89.2	0	0	0	111.2	H175 I180 C183 L223 I312 L535 P538	H175-F178 HydrophobicContact CB-CB 4.43Å; H175-F178 PolarHBondContact O-N 3.13Å; F178-I180 HydrophobicContact CB-CG1 4.18Å; F178-I180 HydrophobicContact CD1-CG1 3.79Å; F178-I180 HydrophobicContact CG-CG1 4.46Å; F178-I180 PolarHBondContact O-N 2.82Å; F178-C183 HydrophobicContact CE1-CB 3.97Å; F178-L223 HydrophobicContact CE2-CD2 3.95Å; F178-L223 HydrophobicContact CZ-CD2 3.95Å; F178-I312 HydrophobicContact CD2-CG2 4.33Å; F178-I312 HydrophobicContact CE2-CG2 3.75Å; F178-I312 HydrophobicContact CZ-CG2 3.93Å; F178-L535 HydrophobicContact CD2-CB 4.49Å; F178-L535 HydrophobicContact CD2-CD2 3.85Å; F178-L535 HydrophobicContact CE2-CB 4.19Å; F178-L535 HydrophobicContact CE2-CD2 4.18Å; F178-L535 VanDerWaalsContact CE2-O 3.3Å; F178-L535 WeakPolarHBondContact CE2-O 3.33Å; F178-P538 HydrophobicContact CB-CB 4.05Å; F178-P538 HydrophobicContact CB-CG 3.92Å; F178-P538 HydrophobicContact CD1-CB 3.92Å; F178-P538 HydrophobicContact CD1-CG 4.22Å; F178-P538 HydrophobicContact CD2-CB 4.2Å; F178-P538 HydrophobicContact CD2-CG 3.58Å; F178-P538 HydrophobicContact CE1-CB 4.41Å; F178-P538 HydrophobicContact CE2-CG 4.1Å; F178-P538 HydrophobicContact CG-CB 3.79Å; F178-P538 HydrophobicContact CG-CG 3.64Å
179	P	84.8	Confident	85	Confident	42 Å²	42	67.2 Å²	67.2	27%	0.273	34%	0.338	S	S	.	.			trans	-79	66.3	-178.5	33.8	-36.8	0	0	0	111.7	F181 E182 C183 I312	P179-F181 PolarHBondContact O-N 3.41Å; P179-E182 HydrophobicContact CB-CB 4.14Å; P179-E182 PolarHBondContact O-N 3.03Å; P179-C183 WeakPolarHBondContact O-CB 3.34Å; P179-C183 PolarHBondContact O-N 3.12Å; P179-I312 HydrophobicContact CG-CG2 3.74Å
180	I	87.6	Confident	83.8	Confident	3 Å²	3	63.4 Å²	63.4	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-58.4	-51.1	-169.5	-70.4	153.5	0	0	0	112.6	L168 I171 V172 H175 F178 E182 C183 F184 V542	L168-I180 HydrophobicContact CD2-CG2 3.92Å; I171-I180 VanDerWaalsContact C-CD1 3.46Å; I171-I180 HydrophobicContact CB-CD1 4.38Å; I171-I180 HydrophobicContact CG2-CD1 3.78Å; I171-I180 HydrophobicContact CG2-CG1 4.05Å; I171-I180 HydrophobicContact CG2-CG2 4.29Å; I171-I180 WeakPolarHBondContact O-CD1 3.41Å; V172-I180 VanDerWaalsContact CA-CD1 3.4Å; V172-I180 HydrophobicContact CB-CD1 4.08Å; V172-I180 HydrophobicContact CG2-CB 3.87Å; V172-I180 HydrophobicContact CG2-CD1 3.58Å; V172-I180 HydrophobicContact CG2-CG1 4.35Å; V172-I180 HydrophobicContact CG2-CG2 3.88Å; H175-I180 HydrophobicContact CB-CD1 4.29Å; F178-I180 HydrophobicContact CB-CG1 4.18Å; F178-I180 HydrophobicContact CD1-CG1 3.79Å; F178-I180 HydrophobicContact CG-CG1 4.46Å; F178-I180 PolarHBondContact O-N 2.82Å; I180-E182 VanDerWaalsContact C-N 3.32Å; I180-E182 PolarHBondContact O-N 3.49Å; I180-C183 PolarHBondContact O-N 2.86Å; I180-F184 WeakPolarHBondContact O-CB 3.48Å; I180-F184 PolarHBondContact O-N 2.8Å; I180-V542 HydrophobicContact CG1-CG2 4.45Å; I180-V542 HydrophobicContact CG2-CG2 3.83Å
181	F	86.5	Confident	82.2	Confident	97 Å²	97	60.8 Å²	60.8	43%	0.425	32%	0.32	S	S	.	.	H	α-helix	trans	-64.1	-36.4	179	-68.2	-67.7	0	0	0	112.5	L168 V172 P179 Q185	L168-F181 HydrophobicContact CB-CE1 3.91Å; L168-F181 HydrophobicContact CB-CZ 4.47Å; L168-F181 HydrophobicContact CD1-CD1 4.19Å; L168-F181 HydrophobicContact CD1-CE1 3.99Å; L168-F181 HydrophobicContact CG-CE1 4.47Å; V172-F181 HydrophobicContact CG2-CD2 4.21Å; V172-F181 HydrophobicContact CG2-CE2 3.7Å; V172-F181 HydrophobicContact CG2-CZ 4.14Å; P179-F181 PolarHBondContact O-N 3.41Å; F181-Q185 VanDerWaalsContact O-CB 3.3Å; F181-Q185 WeakPolarHBondContact O-CB 3.26Å; F181-Q185 WeakPolarHBondContact O-CG 3.42Å; F181-Q185 PolarHBondContact O-N 3.47Å
182	E	83.5	Confident	80.1	Confident	99 Å²	99	64.4 Å²	64.4	46%	0.463	34%	0.342	S	S	.	.	H	α-helix	trans	-68.4	-41.5	176.6	-163.1	-163	142.2	0	0	111.2	P179 I180 K186	P179-E182 HydrophobicContact CB-CB 4.14Å; P179-E182 PolarHBondContact O-N 3.03Å; I180-E182 VanDerWaalsContact C-N 3.32Å; I180-E182 PolarHBondContact O-N 3.49Å; E182-K186 HydrophobicContact CG-CD 4.46Å; E182-K186 WeakPolarHBondContact O-CB 3.29Å; E182-K186 VanDerWaalsContact O-CG 3.29Å; E182-K186 WeakPolarHBondContact O-CG 3.22Å; E182-K186 PolarHBondContact O-N 3.02Å; E182-K186 VanDerWaalsContact OE1-CE 3.32Å; E182-K186 WeakPolarHBondContact OE1-CE 3.4Å; E182-K186 IonicContact OE1-NZ 3.76Å; E182-K186 PolarHBondContact OE1-NZ 2.75Å
183	C	84.2	Confident	77.6	Confident	2 Å²	2	65.8 Å²	65.8	1%	0.014	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-47.4	175.6	-166.3	0	0	0	0	111.3	F178 P179 I180 K186 F187 V542	F178-C183 HydrophobicContact CE1-CB 3.97Å; P179-C183 WeakPolarHBondContact O-CB 3.34Å; P179-C183 PolarHBondContact O-N 3.12Å; I180-C183 PolarHBondContact O-N 2.86Å; C183-K186 WeakPolarHBondContact O-CB 3.21Å; C183-K186 PolarHBondContact O-N 3.38Å; C183-F187 WeakPolarHBondContact O-CG 3.46Å; C183-F187 PolarHBondContact O-N 3.39Å; C183-V542 HydrophobicContact CB-CG1 4.26Å
184	F	86.8	Confident	74.8	Confident	12 Å²	12	63 Å²	63	5%	0.053	36%	0.355	C	S	.	.	H	α-helix	trans	-65	-42.9	177.7	-169.4	-111	0	0	0	112.4	L168 I180 K186 F187 Q188 V542 L545 N546	L168-F184 HydrophobicContact CD1-CD1 3.67Å; L168-F184 HydrophobicContact CD1-CE1 3.67Å; L168-F184 HydrophobicContact CD1-CG 4.29Å; L168-F184 HydrophobicContact CD1-CZ 4.3Å; L168-F184 HydrophobicContact CD2-CB 4.02Å; L168-F184 HydrophobicContact CD2-CD1 4.04Å; L168-F184 HydrophobicContact CD2-CD2 4.01Å; L168-F184 HydrophobicContact CD2-CE1 4.46Å; L168-F184 HydrophobicContact CD2-CE2 4.43Å; L168-F184 HydrophobicContact CD2-CG 3.78Å; L168-F184 HydrophobicContact CG-CD1 4.43Å; L168-F184 HydrophobicContact CG-CE1 4.48Å; I180-F184 WeakPolarHBondContact O-CB 3.48Å; I180-F184 PolarHBondContact O-N 2.8Å; F184-K186 VanDerWaalsContact C-N 3.35Å; F184-K186 PolarHBondContact O-N 3.02Å; F184-F187 PolarHBondContact O-N 3.11Å; F184-Q188 HydrophobicContact CD1-CG 4.29Å; F184-Q188 HydrophobicContact CE1-CG 4.13Å; F184-Q188 HydrophobicContact CZ-CG 4.45Å; F184-Q188 WeakPolarHBondContact O-CG 3.34Å; F184-Q188 PolarHBondContact O-N 3.48Å; F184-V542 HydrophobicContact CB-CG1 3.84Å; F184-V542 HydrophobicContact CD2-CG1 4.01Å; F184-V542 HydrophobicContact CG-CG1 4.44Å; F184-L545 HydrophobicContact CE2-CB 4.4Å; F184-L545 HydrophobicContact CE2-CG 4.15Å; F184-N546 HydrophobicContact CD2-CB 4.25Å; F184-N546 HydrophobicContact CE2-CB 4.01Å
185	Q	85.9	Confident	72	Confident	125 Å²	125	64 Å²	64	58%	0.584	36%	0.364	S	S	*	.	H	α-helix	trans	-64	-38.2	174.7	-74.4	173.7	13	0	0	112.2	F181 F187 Q188 S189	F181-Q185 VanDerWaalsContact O-CB 3.3Å; F181-Q185 WeakPolarHBondContact O-CB 3.26Å; F181-Q185 WeakPolarHBondContact O-CG 3.42Å; F181-Q185 PolarHBondContact O-N 3.47Å; Q185-F187 VanDerWaalsContact C-N 3.35Å; Q185-Q188 PolarHBondContact O-N 3.03Å; Q185-S189 PolarHBondContact O-N 3.39Å
186	K	82.1	Confident	69.4	Low	41 Å²	41	72.9 Å²	72.9	18%	0.178	40%	0.403	C	S	.	.	H	α-helix	trans	-58.9	-45.8	171.1	-81.1	166.9	167.4	168.7	0	110.8	E182 C183 F184 S189 F190 S220	E182-K186 HydrophobicContact CG-CD 4.46Å; E182-K186 WeakPolarHBondContact O-CB 3.29Å; E182-K186 VanDerWaalsContact O-CG 3.29Å; E182-K186 WeakPolarHBondContact O-CG 3.22Å; E182-K186 PolarHBondContact O-N 3.02Å; E182-K186 VanDerWaalsContact OE1-CE 3.32Å; E182-K186 WeakPolarHBondContact OE1-CE 3.4Å; E182-K186 IonicContact OE1-NZ 3.76Å; E182-K186 PolarHBondContact OE1-NZ 2.75Å; C183-K186 WeakPolarHBondContact O-CB 3.21Å; C183-K186 PolarHBondContact O-N 3.38Å; F184-K186 VanDerWaalsContact C-N 3.35Å; F184-K186 PolarHBondContact O-N 3.02Å; K186-S189 WeakPolarHBondContact O-CB 3.31Å; K186-S189 PolarHBondContact O-N 3.3Å; K186-S189 PolarHBondContact O-OG 2.91Å; K186-F190 VanDerWaalsContact O-CD2 3.24Å; K186-F190 WeakPolarHBondContact O-CD2 3.45Å; K186-F190 WeakPolarHBondContact O-CE2 3.4Å; K186-S220 PolarHBondContact NZ-O 2.67Å
187	F	83.8	Confident	66.6	Low	12 Å²	12	71.2 Å²	71.2	5%	0.053	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-45.9	176.6	-65.9	-13.5	0	0	0	113.2	C183 F184 Q185 S189 F190 Y214 Y539 V542 L543 N546	C183-F187 WeakPolarHBondContact O-CG 3.46Å; C183-F187 PolarHBondContact O-N 3.39Å; F184-F187 PolarHBondContact O-N 3.11Å; Q185-F187 VanDerWaalsContact C-N 3.35Å; F187-S189 PolarHBondContact O-N 2.88Å; F187-F190 PolarHBondContact O-N 2.84Å; F187-F190 VanDerWaalsContact O-N 3.08Å; F187-Y214 HydrophobicContact CB-CD1 4.5Å; F187-Y214 HydrophobicContact CB-CE1 3.93Å; F187-Y214 AromaticContact CD1-CD1 3.6Å; F187-Y214 HydrophobicContact CD1-CD1 3.6Å; F187-Y214 AromaticContact CD1-CE1 3.9Å; F187-Y214 HydrophobicContact CD1-CE1 3.9Å; F187-Y214 HydrophobicContact CD2-CD1 4.34Å; F187-Y214 HydrophobicContact CD2-CE1 4.08Å; F187-Y214 AromaticContact CE1-CD1 3.76Å; F187-Y214 HydrophobicContact CE1-CD1 3.76Å; F187-Y214 HydrophobicContact CE1-CE1 4.4Å; F187-Y214 HydrophobicContact CE2-CD1 4.47Å; F187-Y214 AromaticContact CG-CD1 3.91Å; F187-Y214 HydrophobicContact CG-CD1 3.91Å; F187-Y214 AromaticContact CG-CE1 3.72Å; F187-Y214 HydrophobicContact CG-CE1 3.72Å; F187-Y214 HydrophobicContact CZ-CD1 4.19Å; F187-Y539 HydrophobicContact CE1-CE2 4.2Å; F187-Y539 HydrophobicContact CZ-CD2 4.01Å; F187-Y539 AromaticContact CZ-CE2 3.54Å; F187-Y539 HydrophobicContact CZ-CE2 3.54Å; F187-V542 HydrophobicContact CD2-CG1 3.96Å; F187-V542 HydrophobicContact CE2-CG1 3.92Å; F187-L543 HydrophobicContact CE2-CB 3.95Å; F187-L543 HydrophobicContact CE2-CG 4.33Å; F187-N546 HydrophobicContact CB-CB 4.15Å; F187-N546 WeakPolarHBondContact CB-OD1 3.43Å; F187-N546 HydrophobicContact CD2-CB 4.26Å
188	Q	81.9	Confident	64	Low	80 Å²	80	76.2 Å²	76.2	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-30.2	174.2	-73.1	-171.6	-26.2	0	0	112.6	F184 Q185 F190 T191 T192 N546	F184-Q188 HydrophobicContact CD1-CG 4.29Å; F184-Q188 HydrophobicContact CE1-CG 4.13Å; F184-Q188 HydrophobicContact CZ-CG 4.45Å; F184-Q188 WeakPolarHBondContact O-CG 3.34Å; F184-Q188 PolarHBondContact O-N 3.48Å; Q185-Q188 PolarHBondContact O-N 3.03Å; Q188-F190 VanDerWaalsContact C-N 3.25Å; Q188-F190 PolarHBondContact O-N 3.01Å; Q188-T191 PolarHBondContact O-N 3.33Å; Q188-T191 PolarHBondContact O-OG1 3.02Å; Q188-T191 VanDerWaalsContact O-OG1 3.07Å; Q188-T192 WeakPolarHBondContact O-CB 3.44Å; Q188-T192 WeakPolarHBondContact O-CG2 3.33Å; Q188-T192 PolarHBondContact O-N 3.2Å; Q188-T192 PolarHBondContact O-OG1 2.62Å; Q188-N546 PolarHBondContact N-OD1 3.16Å
189	S	70.9	Confident	61.1	Low	64 Å²	64	83 Å²	83	45%	0.448	43%	0.432	S	S	.	.	H	α-helix	trans	-65.5	-27.3	176.8	81.9	0	0	0	0	113.3	Q185 K186 F187 G193	Q185-S189 PolarHBondContact O-N 3.39Å; K186-S189 WeakPolarHBondContact O-CB 3.31Å; K186-S189 PolarHBondContact O-N 3.3Å; K186-S189 PolarHBondContact O-OG 2.91Å; F187-S189 PolarHBondContact O-N 2.88Å; S189-G193 PolarHBondContact O-N 3.14Å
190	F	62.4	Low	58.4	Low	71 Å²	71	88.3 Å²	88.3	31%	0.311	46%	0.456	S	S	.	.	H	α-helix	trans	-78.9	-26.4	175.6	-59.4	-57.3	0	0	0	113.1	K186 F187 Q188	K186-F190 VanDerWaalsContact O-CD2 3.24Å; K186-F190 WeakPolarHBondContact O-CD2 3.45Å; K186-F190 WeakPolarHBondContact O-CE2 3.4Å; F187-F190 PolarHBondContact O-N 2.84Å; F187-F190 VanDerWaalsContact O-N 3.08Å; Q188-F190 VanDerWaalsContact C-N 3.25Å; Q188-F190 PolarHBondContact O-N 3.01Å
191	T	53.4	Low	55.5	Low	68 Å²	68	92.7 Å²	92.7	42%	0.417	49%	0.485	S	S	.	.	H	α-helix	trans	-88.6	-35.2	176	58.6	0	0	0	0	112.8	Q188	Q188-T191 PolarHBondContact O-N 3.33Å; Q188-T191 PolarHBondContact O-OG1 3.02Å; Q188-T191 VanDerWaalsContact O-OG1 3.07Å
192	T	45.9	Very low	52.7	Low	78 Å²	78	91.1 Å²	91.1	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-88.2	-3.1	-175.7	58.6	0	0	0	0	115.1	Q188 C194 T195	Q188-T192 WeakPolarHBondContact O-CB 3.44Å; Q188-T192 WeakPolarHBondContact O-CG2 3.33Å; Q188-T192 PolarHBondContact O-N 3.2Å; Q188-T192 PolarHBondContact O-OG1 2.62Å; T192-C194 PolarHBondContact O-N 3.03Å; T192-T195 PolarHBondContact O-N 3.19Å; T192-T195 VanDerWaalsContact O-N 3.13Å; T192-T195 PolarHBondContact O-OG1 3.46Å
193	G	37.8	Very low	50.5	Low	74 Å²	74	89.7 Å²	89.7	76%	0.763	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-4.5	-176.1	0	0	0	0	0	117.2	S189	S189-G193 PolarHBondContact O-N 3.14Å
194	C	29.7	Very low	48.6	Very low	71 Å²	71	92.6 Å²	92.6	48%	0.48	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-20.2	178.2	-151.5	0	0	0	0	114.1	T192 K196	T192-C194 PolarHBondContact O-N 3.03Å; C194-K196 PolarHBondContact O-N 2.95Å
195	T	27.4	Very low	46.6	Very low	100 Å²	100	95.8 Å²	95.8	61%	0.613	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	54.8	-162.8	49.2	0	0	0	0	115.4	T192	T192-T195 PolarHBondContact O-N 3.19Å; T192-T195 VanDerWaalsContact O-N 3.13Å; T192-T195 PolarHBondContact O-OG1 3.46Å
196	K	32.7	Very low	45.1	Very low	222 Å²	222	97.2 Å²	97.2	97%	0.965	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	2.7	151.8	-85.9	-168.9	176.6	-179	0	114	C194	C194-K196 PolarHBondContact O-N 2.95Å
197	S	25.7	Very low	44.4	Very low	63 Å²	63	99.8 Å²	99.8	44%	0.441	56%	0.559	S	S	.	*	S	Bend	trans	-132.5	151.2	164.3	77.8	0	0	0	0	110.1	Q199	S197-Q199 PolarHBondContact O-N 3.5Å
198	R	26	Very low	44	Very low	264 Å²	264	102.7 Å²	102.7	100%	0.996	58%	0.575	S	S	*	*			trans	-82.7	66.6	-177.9	-163	-177.9	-164.8	175.1	4.5	110
199	Q	24.3	Very low	44.1	Very low	154 Å²	154	103.4 Å²	103.4	72%	0.72	58%	0.581	S	S	*	*			trans	-117.3	154.3	174.6	-67	-168.6	-11.8	0	0	110.5	S197	S197-Q199 PolarHBondContact O-N 3.5Å
200	I	27.9	Very low	45	Very low	154 Å²	154	101.2 Å²	101.2	79%	0.79	56%	0.563	S	S	*	*			trans	-58.2	140.4	-177.5	-60.8	160.2	0	0	0	109	S202	I200-S202 PolarHBondContact O-N 3.44Å; I200-S202 VanDerWaalsContact O-N 3.17Å
201	P	26.5	Very low	46.2	Very low	96 Å²	96	99.5 Å²	99.5	62%	0.623	56%	0.558	S	S	*	*			trans	-51.7	124.1	174.6	-25.6	34.5	0	0	0	110.7	A203	P201-A203 PolarHBondContact O-N 3.26Å; P201-A203 VanDerWaalsContact O-N 3.15Å
202	S	28.8	Very low	47.9	Very low	64 Å²	64	100.4 Å²	100.4	45%	0.448	56%	0.56	S	S	.	*			trans	-69	112.9	172.7	54.8	0	0	0	0	108.3	I200 S204	I200-S202 PolarHBondContact O-N 3.44Å; I200-S202 VanDerWaalsContact O-N 3.17Å; S202-S204 PolarHBondContact O-N 3.2Å; S202-S204 PolarHBondContact O-OG 3.45Å
203	A	36.1	Very low	49.8	Very low	68 Å²	68	98.6 Å²	98.6	56%	0.562	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-0.9	-173.4	0	0	0	0	0	115.9	P201 N205 S207	P201-A203 PolarHBondContact O-N 3.26Å; P201-A203 VanDerWaalsContact O-N 3.15Å; A203-N205 VanDerWaalsContact C-N 3.26Å; A203-N205 PolarHBondContact O-N 3.28Å; A203-S207 PolarHBondContact O-OG 2.66Å
204	S	44.6	Very low	52.3	Low	64 Å²	64	95.4 Å²	95.4	45%	0.448	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.1	176.7	56.7	0	0	0	0	114.9	S202 S207	S202-S204 PolarHBondContact O-N 3.2Å; S202-S204 PolarHBondContact O-OG 3.45Å; S204-S207 PolarHBondContact O-OG 3.5Å
205	N	45.4	Very low	55	Low	78 Å²	78	96.4 Å²	96.4	42%	0.417	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-19.7	-173	-71.8	31.3	0	0	0	113.4	A203	A203-N205 VanDerWaalsContact C-N 3.26Å; A203-N205 PolarHBondContact O-N 3.28Å
206	E	54.3	Low	57.9	Low	155 Å²	155	93 Å²	93	72%	0.724	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-27.6	173.2	-68.3	174.8	147.1	0	0	111.1	L208	E206-L208 VanDerWaalsContact C-N 3.27Å; E206-L208 PolarHBondContact O-N 2.78Å
207	S	66.2	Low	60.3	Low	96 Å²	96	84.1 Å²	84.1	67%	0.671	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	8.3	178.3	65.6	0	0	0	0	115.3	A203 S204	A203-S207 PolarHBondContact O-OG 2.66Å; S204-S207 PolarHBondContact O-OG 3.5Å
208	L	77	Confident	63.2	Low	73 Å²	73	82 Å²	82	38%	0.382	44%	0.44	S	S	.	.	S	Bend	trans	-95.3	140.6	-178.6	-70.7	173.3	0	0	0	111.7	E206 K213	E206-L208 VanDerWaalsContact C-N 3.27Å; E206-L208 PolarHBondContact O-N 2.78Å; L208-K213 HydrophobicContact CB-CB 4.35Å
209	L	83.9	Confident	65.9	Low	95 Å²	95	69.6 Å²	69.6	50%	0.497	39%	0.393	S	S	.	.			trans	-60.2	143.4	167.4	-69.1	171.5	0	0	0	110	V211 D212 K213	L209-V211 PolarHBondContact O-N 3.36Å; L209-D212 PolarHBondContact O-N 3.33Å; L209-K213 WeakPolarHBondContact O-CB 3.33Å; L209-K213 PolarHBondContact O-N 2.7Å
210	W	89.6	Confident	68.5	Low	18 Å²	18	63.3 Å²	63.3	7%	0.068	37%	0.367	C	S	.	.	H	α-helix	trans	-60.3	-33.1	-177.9	-72.7	13.1	0	0	0	111.8	D212 K213 Y214 L543 E547 I584 L587 Q588 C591	W210-D212 VanDerWaalsContact C-N 3.3Å; W210-D212 PolarHBondContact O-N 3.08Å; W210-K213 PolarHBondContact O-N 2.74Å; W210-Y214 HydrophobicContact CB-CD2 4.06Å; W210-Y214 HydrophobicContact CB-CE2 4.38Å; W210-Y214 HydrophobicContact CG-CD2 4.45Å; W210-Y214 HydrophobicContact CG-CE2 4.28Å; W210-Y214 WeakPolarHBondContact O-CB 3.45Å; W210-Y214 VanDerWaalsContact O-CD2 3.3Å; W210-Y214 WeakPolarHBondContact O-CD2 3.44Å; W210-Y214 PolarHBondContact O-N 3.05Å; W210-L543 HydrophobicContact CD2-CD2 4.03Å; W210-L543 HydrophobicContact CE3-CD2 3.33Å; W210-L543 HydrophobicContact CZ3-CD2 3.6Å; W210-E547 HydrophobicContact CD2-CG 4.4Å; W210-E547 VanDerWaalsContact CE2-OE1 3.27Å; W210-E547 HydrophobicContact CH2-CB 3.83Å; W210-E547 HydrophobicContact CH2-CG 3.8Å; W210-E547 HydrophobicContact CZ2-CB 3.61Å; W210-E547 HydrophobicContact CZ2-CG 3.46Å; W210-E547 VanDerWaalsContact CZ2-CG 3.46Å; W210-E547 HydrophobicContact CZ3-CG 4.42Å; W210-E547 PolarHBondContact NE1-OE1 2.87Å; W210-I584 HydrophobicContact CB-CG2 3.42Å; W210-I584 VanDerWaalsContact CB-CG2 3.42Å; W210-L587 HydrophobicContact CZ3-CB 4.35Å; W210-L587 HydrophobicContact CZ3-CD2 4.11Å; W210-L587 HydrophobicContact CZ3-CG 3.97Å; W210-Q588 HydrophobicContact CB-CB 4.15Å; W210-Q588 HydrophobicContact CB-CG 4.49Å; W210-Q588 HydrophobicContact CD2-CB 3.46Å; W210-Q588 VanDerWaalsContact CD2-CB 3.46Å; W210-Q588 HydrophobicContact CD2-CG 3.75Å; W210-Q588 HydrophobicContact CE3-CB 3.71Å; W210-Q588 HydrophobicContact CE3-CG 4.45Å; W210-Q588 HydrophobicContact CG-CB 3.66Å; W210-Q588 HydrophobicContact CG-CG 3.73Å; W210-Q588 HydrophobicContact CZ2-CG 4.41Å; W210-Q588 HydrophobicContact CZ3-CB 4.37Å; W210-C591 HydrophobicContact CH2-CB 3.64Å; W210-C591 HydrophobicContact CZ2-CB 4.17Å
211	V	88.2	Confident	71	Confident	34 Å²	34	57 Å²	57	21%	0.206	34%	0.337	C	S	.	.	H	α-helix	trans	-57.9	-39.5	173.2	168.2	0	0	0	0	112.5	L209 M215 R581 I584 N585	L209-V211 PolarHBondContact O-N 3.36Å; V211-M215 WeakPolarHBondContact O-CB 3.39Å; V211-M215 PolarHBondContact O-N 2.81Å; V211-R581 HydrophobicContact CG1-CG 4.02Å; V211-R581 HydrophobicContact CG2-CG 3.89Å; V211-I584 HydrophobicContact CG2-CB 3.91Å; V211-I584 HydrophobicContact CG2-CG2 3.79Å; V211-N585 WeakPolarHBondContact CG2-OD1 3.5Å
212	D	87.2	Confident	73.7	Confident	88 Å²	88	52.9 Å²	52.9	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-82.2	-41.5	178.9	-66.1	-48.9	0	0	0	111.3	L209 W210 Y214 M215	L209-D212 PolarHBondContact O-N 3.33Å; W210-D212 VanDerWaalsContact C-N 3.3Å; W210-D212 PolarHBondContact O-N 3.08Å; D212-Y214 VanDerWaalsContact C-N 3.34Å; D212-Y214 PolarHBondContact O-N 3.28Å; D212-M215 WeakPolarHBondContact O-CB 3.34Å; D212-M215 PolarHBondContact O-N 3.05Å
213	K	87.4	Confident	76.1	Confident	40 Å²	40	50.4 Å²	50.4	17%	0.174	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-38.8	178.3	-178.4	175.3	173.5	179.2	0	112.8	L208 L209 W210 E547	L208-K213 HydrophobicContact CB-CB 4.35Å; L209-K213 WeakPolarHBondContact O-CB 3.33Å; L209-K213 PolarHBondContact O-N 2.7Å; W210-K213 PolarHBondContact O-N 2.74Å; K213-E547 WeakPolarHBondContact CE-OE1 3.37Å; K213-E547 IonicContact NZ-OE1 3.57Å; K213-E547 PolarHBondContact NZ-OE1 3.37Å; K213-E547 IonicContact NZ-OE2 3.2Å; K213-E547 PolarHBondContact NZ-OE2 3.16Å
214	Y	89.3	Confident	77.9	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.027	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	12	179.5	-63	-69.7	0	0	0	113.7	F187 W210 D212 L543 N546 E547	F187-Y214 HydrophobicContact CB-CD1 4.5Å; F187-Y214 HydrophobicContact CB-CE1 3.93Å; F187-Y214 AromaticContact CD1-CD1 3.6Å; F187-Y214 HydrophobicContact CD1-CD1 3.6Å; F187-Y214 AromaticContact CD1-CE1 3.9Å; F187-Y214 HydrophobicContact CD1-CE1 3.9Å; F187-Y214 HydrophobicContact CD2-CD1 4.34Å; F187-Y214 HydrophobicContact CD2-CE1 4.08Å; F187-Y214 AromaticContact CE1-CD1 3.76Å; F187-Y214 HydrophobicContact CE1-CD1 3.76Å; F187-Y214 HydrophobicContact CE1-CE1 4.4Å; F187-Y214 HydrophobicContact CE2-CD1 4.47Å; F187-Y214 AromaticContact CG-CD1 3.91Å; F187-Y214 HydrophobicContact CG-CD1 3.91Å; F187-Y214 AromaticContact CG-CE1 3.72Å; F187-Y214 HydrophobicContact CG-CE1 3.72Å; F187-Y214 HydrophobicContact CZ-CD1 4.19Å; W210-Y214 HydrophobicContact CB-CD2 4.06Å; W210-Y214 HydrophobicContact CB-CE2 4.38Å; W210-Y214 HydrophobicContact CG-CD2 4.45Å; W210-Y214 HydrophobicContact CG-CE2 4.28Å; W210-Y214 WeakPolarHBondContact O-CB 3.45Å; W210-Y214 VanDerWaalsContact O-CD2 3.3Å; W210-Y214 WeakPolarHBondContact O-CD2 3.44Å; W210-Y214 PolarHBondContact O-N 3.05Å; D212-Y214 VanDerWaalsContact C-N 3.34Å; D212-Y214 PolarHBondContact O-N 3.28Å; Y214-L543 HydrophobicContact CD1-CG 4.32Å; Y214-L543 HydrophobicContact CD2-CD1 3.83Å; Y214-L543 HydrophobicContact CD2-CD2 3.72Å; Y214-L543 HydrophobicContact CD2-CG 3.74Å; Y214-L543 HydrophobicContact CE1-CG 4.39Å; Y214-L543 HydrophobicContact CE2-CD1 4.43Å; Y214-L543 HydrophobicContact CE2-CD2 3.52Å; Y214-L543 HydrophobicContact CE2-CG 3.83Å; Y214-L543 HydrophobicContact CG-CD1 3.94Å; Y214-L543 HydrophobicContact CG-CD2 4.49Å; Y214-L543 HydrophobicContact CG-CG 4.01Å; Y214-N546 PolarHBondContact OH-ND2 3.33Å; Y214-E547 HydrophobicContact CE2-CG 4.22Å; Y214-E547 WeakPolarHBondContact OH-CG 3.34Å; Y214-E547 PolarHBondContact OH-OE1 2.9Å; Y214-E547 PolarHBondContact OH-OE2 2.91Å
215	M	87.6	Confident	78.9	Confident	91 Å²	91	46.1 Å²	46.1	45%	0.448	25%	0.254	S	S	.	.			trans	-57.1	126.9	178.1	-178.4	172.9	53.3	0	0	111	V211 D212 S217	V211-M215 WeakPolarHBondContact O-CB 3.39Å; V211-M215 PolarHBondContact O-N 2.81Å; D212-M215 WeakPolarHBondContact O-CB 3.34Å; D212-M215 PolarHBondContact O-N 3.05Å; M215-S217 PolarHBondContact O-N 2.98Å
216	P	87	Confident	80.1	Confident	29 Å²	29	43.7 Å²	43.7	19%	0.188	24%	0.243	C	C	.	.			trans	-56.4	108.8	-178.7	-29.2	36.6	0	0	0	112.7	F222	P216-F222 HydrophobicContact CB-CD2 4.02Å; P216-F222 HydrophobicContact CG-CD2 3.98Å
217	S	83.7	Confident	81	Confident	36 Å²	36	38 Å²	38	25%	0.252	22%	0.22	S	C	.	.			trans	-95.4	6.3	-176.5	94.3	0	0	0	0	113.9	M215 K376	M215-S217 PolarHBondContact O-N 2.98Å; S217-K376 VanDerWaalsContact CB-NZ 3.3Å; S217-K376 VanDerWaalsContact O-CD 3.32Å; S217-K376 WeakPolarHBondContact O-CD 3.48Å; S217-K376 WeakPolarHBondContact O-CE 3.48Å; S217-K376 PolarHBondContact O-NZ 2.93Å; S217-K376 PolarHBondContact OG-NZ 2.82Å
218	S	86.5	Confident	81.6	Confident	19 Å²	19	34.5 Å²	34.5	13%	0.133	20%	0.195	C	C	.	.	S	Bend	trans	-157	150.5	171.4	178.4	0	0	0	0	108.9	S220 S221 D377	S218-S220 PolarHBondContact O-N 3.33Å; S218-S220 PolarHBondContact OG-N 2.92Å; S218-S220 PolarHBondContact OG-OG 2.95Å; S218-S221 PolarHBondContact O-N 3.38Å; S218-D377 WeakPolarHBondContact CA-OD1 3.4Å; S218-D377 WeakPolarHBondContact CB-OD1 3.49Å; S218-D377 PolarHBondContact OG-OD1 2.98Å; S218-D377 PolarHBondContact OG-OD2 2.89Å
219	C	83.4	Confident	81.8	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.014	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-57.5	-30.2	175.6	-172.6	0	0	0	0	112	S221 F222 P311 L374 D377	C219-S221 PolarHBondContact O-N 2.89Å; C219-S221 VanDerWaalsContact O-N 3.14Å; C219-F222 WeakPolarHBondContact O-CB 3.28Å; C219-F222 PolarHBondContact O-N 3.4Å; C219-P311 WeakPolarHBondContact O-CA 3.42Å; C219-P311 WeakPolarHBondContact O-CB 3.45Å; C219-L374 HydrophobicContact CB-CD2 3.79Å; C219-L374 HydrophobicContact CB-CG 4.42Å; C219-D377 WeakPolarHBondContact CB-OD2 3.46Å; C219-D377 PolarHBondContact N-OD2 3.19Å
220	S	78.6	Confident	81.9	Confident	23 Å²	23	27.4 Å²	27.4	16%	0.161	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-66.5	-5.1	173.4	66.3	0	0	0	0	114.9	K186 S218 L310	K186-S220 PolarHBondContact NZ-O 2.67Å; S218-S220 PolarHBondContact O-N 3.33Å; S218-S220 PolarHBondContact OG-N 2.92Å; S218-S220 PolarHBondContact OG-OG 2.95Å; S220-L310 WeakPolarHBondContact CA-O 3.29Å
221	S	80.3	Confident	81.8	Confident	22 Å²	22	32.8 Å²	32.8	15%	0.154	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-116.8	8.9	177.4	-51.2	0	0	0	0	112.5	S218 C219	S218-S221 PolarHBondContact O-N 3.38Å; C219-S221 PolarHBondContact O-N 2.89Å; C219-S221 VanDerWaalsContact O-N 3.14Å
222	F	83.2	Confident	81.9	Confident	9 Å²	9	31.2 Å²	31.2	4%	0.039	17%	0.172	C	C	.	.			trans	-89.1	133.9	179.3	-160.3	-101.7	0	0	0	110	P216 C219 N224 I229 P311 I312 G366 L370 F528	P216-F222 HydrophobicContact CB-CD2 4.02Å; P216-F222 HydrophobicContact CG-CD2 3.98Å; C219-F222 WeakPolarHBondContact O-CB 3.28Å; C219-F222 PolarHBondContact O-N 3.4Å; F222-N224 HydrophobicContact CD1-CB 4.31Å; F222-N224 HydrophobicContact CE1-CB 3.93Å; F222-I229 HydrophobicContact CD1-CD1 4.12Å; F222-I229 HydrophobicContact CE1-CD1 4Å; F222-P311 HydrophobicContact CB-CB 4.21Å; F222-P311 WeakPolarHBondContact O-CB 3.23Å; F222-I312 PolarHBondContact O-N 2.94Å; F222-G366 WeakPolarHBondContact CE2-O 3.43Å; F222-L370 HydrophobicContact CB-CD1 4.39Å; F222-L370 HydrophobicContact CD1-CD1 4.05Å; F222-L370 HydrophobicContact CD2-CB 4.25Å; F222-L370 HydrophobicContact CD2-CD1 4.25Å; F222-L370 HydrophobicContact CE1-CB 4.36Å; F222-L370 HydrophobicContact CE1-CD1 4.38Å; F222-L370 HydrophobicContact CE2-CB 3.85Å; F222-L370 HydrophobicContact CG-CD1 3.99Å; F222-L370 HydrophobicContact CZ-CB 3.92Å; F222-F528 AromaticContact CE1-CE1 3.99Å; F222-F528 HydrophobicContact CE1-CE1 3.99Å; F222-F528 AromaticContact CZ-CE1 3.95Å; F222-F528 HydrophobicContact CZ-CE1 3.95Å
223	L	79.7	Confident	82.1	Confident	11 Å²	11	27.9 Å²	27.9	6%	0.058	15%	0.154	C	C	.	.	S	Bend	trans	-78.5	-27.9	-171.9	-80.6	168	0	0	0	115.3	F178 L535 Y539 L580	F178-L223 HydrophobicContact CE2-CD2 3.95Å; F178-L223 HydrophobicContact CZ-CD2 3.95Å; L223-L535 WeakPolarHBondContact O-CD1 3.45Å; L223-Y539 HydrophobicContact CD1-CD1 3.73Å; L223-Y539 HydrophobicContact CD1-CD2 3.71Å; L223-Y539 HydrophobicContact CD1-CE1 3.89Å; L223-Y539 HydrophobicContact CD1-CE2 3.84Å; L223-Y539 HydrophobicContact CD1-CG 3.63Å; L223-Y539 HydrophobicContact CD2-CD2 3.65Å; L223-Y539 HydrophobicContact CD2-CE2 4.32Å; L223-Y539 HydrophobicContact CD2-CG 3.9Å; L223-Y539 HydrophobicContact CG-CD2 3.91Å; L223-Y539 HydrophobicContact CG-CE2 4.1Å; L223-Y539 HydrophobicContact CG-CG 4.23Å; L223-L580 HydrophobicContact CD1-CD1 4.05Å
224	N	72.3	Confident	82.3	Confident	12 Å²	12	31.9 Å²	31.9	6%	0.064	18%	0.175	C	C	.	.			trans	-97	121.3	-171.8	-173.8	-24.7	0	0	0	109.6	F222 C226 I229 T529 A531	F222-N224 HydrophobicContact CD1-CB 4.31Å; F222-N224 HydrophobicContact CE1-CB 3.93Å; N224-C226 PolarHBondContact OD1-N 3Å; N224-I229 WeakPolarHBondContact O-CD1 3.18Å; N224-T529 PolarHBondContact ND2-O 3.08Å; N224-A531 HydrophobicContact CB-CB 4.45Å
225	T	67.2	Low	82.4	Confident	30 Å²	30	32.3 Å²	32.3	18%	0.184	18%	0.177	C	C	.	.			trans	-106.6	43.5	-172.1	40.8	0	0	0	0	114	P311 I312 G313	T225-P311 HydrophobicContact CG2-CB 3.61Å; T225-P311 HydrophobicContact CG2-CG 4Å; T225-P311 WeakPolarHBondContact CG2-O 3.08Å; T225-I312 WeakPolarHBondContact CG2-O 3.4Å; T225-G313 PolarHBondContact OG1-O 2.57Å; T225-G313 VanDerWaalsContact OG1-O 3.09Å
226	C	69.2	Low	82.7	Confident	27 Å²	27	28 Å²	28	18%	0.182	16%	0.155	C	C	.	.			trans	-60.7	130.3	171.3	-174.7	0	0	0	0	112.1	N224 S228 I229	N224-C226 PolarHBondContact OD1-N 3Å; C226-S228 PolarHBondContact O-N 2.84Å; C226-I229 HydrophobicContact CB-CD1 4.26Å; C226-I229 HydrophobicContact CB-CG1 4.34Å; C226-I229 WeakPolarHBondContact O-CB 3.47Å; C226-I229 PolarHBondContact O-N 3.31Å
227	P	74.8	Confident	82.8	Confident	37 Å²	37	30.3 Å²	30.3	24%	0.24	16%	0.162	C	C	.	.	H	α-helix	trans	-54.4	-22.1	174.4	-29.3	36.3	0	0	0	114.7	I229 I230 K231 I319	P227-I229 VanDerWaalsContact C-N 3.28Å; P227-I229 PolarHBondContact O-N 3.44Å; P227-I230 PolarHBondContact O-N 3.15Å; P227-K231 PolarHBondContact O-N 3.42Å; P227-I319 HydrophobicContact CB-CD1 4.07Å; P227-I319 HydrophobicContact CB-CG1 4.32Å
228	S	76.9	Confident	83.1	Confident	22 Å²	22	33.5 Å²	33.5	15%	0.154	17%	0.172	C	C	.	.	H	α-helix	trans	-69.5	-21.9	175.8	-58.1	0	0	0	0	113.7	C226 K231 L232 C526	C226-S228 PolarHBondContact O-N 2.84Å; S228-K231 WeakPolarHBondContact O-CB 3.41Å; S228-K231 PolarHBondContact O-N 2.92Å; S228-L232 PolarHBondContact O-N 2.88Å; S228-L232 VanDerWaalsContact O-N 3.08Å; S228-C526 WeakPolarHBondContact CB-SG 3.37Å
229	I	82.9	Confident	83.2	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-67.8	-38.9	171.1	-65.8	171.8	0	0	0	110.4	F222 N224 C226 P227 K231 L232 L233 P311 L370 F528	F222-I229 HydrophobicContact CD1-CD1 4.12Å; F222-I229 HydrophobicContact CE1-CD1 4Å; N224-I229 WeakPolarHBondContact O-CD1 3.18Å; C226-I229 HydrophobicContact CB-CD1 4.26Å; C226-I229 HydrophobicContact CB-CG1 4.34Å; C226-I229 WeakPolarHBondContact O-CB 3.47Å; C226-I229 PolarHBondContact O-N 3.31Å; P227-I229 VanDerWaalsContact C-N 3.28Å; P227-I229 PolarHBondContact O-N 3.44Å; I229-K231 VanDerWaalsContact C-N 3.33Å; I229-K231 PolarHBondContact O-N 3.47Å; I229-L232 WeakPolarHBondContact O-CB 3.27Å; I229-L232 PolarHBondContact O-N 3.35Å; I229-L232 VanDerWaalsContact O-N 3.17Å; I229-L233 PolarHBondContact O-N 2.88Å; I229-P311 HydrophobicContact CG2-CG 4.25Å; I229-L370 HydrophobicContact CB-CD2 4.29Å; I229-L370 HydrophobicContact CD1-CD2 4.03Å; I229-L370 HydrophobicContact CG1-CD2 3.7Å; I229-L370 HydrophobicContact CG2-CD1 4Å; I229-L370 HydrophobicContact CG2-CD2 3.87Å; I229-F528 HydrophobicContact CD1-CZ 4.44Å; I229-F528 HydrophobicContact CG1-CZ 4.36Å
230	I	84.5	Confident	83.3	Confident	17 Å²	17	37.7 Å²	37.7	9%	0.087	19%	0.187	C	C	.	.	H	α-helix	trans	-67	-37.4	175.3	-64.8	172.4	0	0	0	110.4	P227 L232 L233 M234 L310 Y314 I319	P227-I230 PolarHBondContact O-N 3.15Å; I230-L232 VanDerWaalsContact C-N 3.31Å; I230-L232 PolarHBondContact O-N 3.48Å; I230-L233 PolarHBondContact O-N 3.43Å; I230-M234 HydrophobicContact CG2-CE 3.99Å; I230-M234 HydrophobicContact CG2-CG 4.34Å; I230-M234 HydrophobicContact CG2-SD 4.32Å; I230-M234 WeakPolarHBondContact O-CB 3.38Å; I230-M234 WeakPolarHBondContact O-CG 3.48Å; I230-M234 PolarHBondContact O-N 2.9Å; I230-L310 HydrophobicContact CD1-CD2 4.02Å; I230-L310 HydrophobicContact CG1-CD2 4.04Å; I230-Y314 HydrophobicContact CD1-CD2 3.73Å; I230-Y314 HydrophobicContact CD1-CE2 3.2Å; I230-I319 HydrophobicContact CD1-CD1 4.03Å
231	K	87.8	Confident	83.6	Confident	131 Å²	131	42.8 Å²	42.8	57%	0.57	20%	0.203	S	C	*	.	H	α-helix	trans	-59.8	-40	171.7	-62	174.3	-171.1	168.2	0	111.6	P227 S228 I229 W235 F357	P227-K231 PolarHBondContact O-N 3.42Å; S228-K231 WeakPolarHBondContact O-CB 3.41Å; S228-K231 PolarHBondContact O-N 2.92Å; I229-K231 VanDerWaalsContact C-N 3.33Å; I229-K231 PolarHBondContact O-N 3.47Å; K231-W235 VanDerWaalsContact O-CB 3.26Å; K231-W235 WeakPolarHBondContact O-CB 3.1Å; K231-W235 PolarHBondContact O-N 2.89Å; K231-F357 HydrophobicContact CB-CZ 4.44Å
232	L	91.5	Very high	83.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-47.8	174.7	178.9	59.8	0	0	0	112.4	S228 I229 I230 M234 W235 L236 F357 L359 L370 L374 I507	S228-L232 PolarHBondContact O-N 2.88Å; S228-L232 VanDerWaalsContact O-N 3.08Å; I229-L232 WeakPolarHBondContact O-CB 3.27Å; I229-L232 PolarHBondContact O-N 3.35Å; I229-L232 VanDerWaalsContact O-N 3.17Å; I230-L232 VanDerWaalsContact C-N 3.31Å; I230-L232 PolarHBondContact O-N 3.48Å; L232-M234 PolarHBondContact O-N 2.74Å; L232-W235 HydrophobicContact CD1-CE3 4.05Å; L232-W235 HydrophobicContact CD1-CZ3 4.4Å; L232-W235 PolarHBondContact O-N 2.97Å; L232-L236 HydrophobicContact CD1-CD1 4.29Å; L232-L236 HydrophobicContact CD1-CG 4.31Å; L232-L236 HydrophobicContact CG-CD1 4.39Å; L232-L236 PolarHBondContact O-N 3.28Å; L232-F357 HydrophobicContact CB-CE1 3.99Å; L232-F357 HydrophobicContact CB-CE2 4Å; L232-F357 HydrophobicContact CB-CZ 3.66Å; L232-F357 HydrophobicContact CD1-CB 4.22Å; L232-F357 HydrophobicContact CD1-CD1 3.85Å; L232-F357 HydrophobicContact CD1-CD2 3.71Å; L232-F357 HydrophobicContact CD1-CE1 4.08Å; L232-F357 HydrophobicContact CD1-CE2 3.98Å; L232-F357 HydrophobicContact CD1-CG 3.66Å; L232-F357 HydrophobicContact CD1-CZ 4.16Å; L232-F357 HydrophobicContact CG-CE1 4.48Å; L232-F357 HydrophobicContact CG-CZ 4.47Å; L232-L359 HydrophobicContact CD2-CD1 4.2Å; L232-L359 HydrophobicContact CD2-CD2 4.37Å; L232-L370 HydrophobicContact CD2-CD2 4.26Å; L232-L374 HydrophobicContact CD2-CD1 3.6Å; L232-L374 HydrophobicContact CG-CD1 3.81Å; L232-I507 HydrophobicContact CD1-CD1 4.09Å
233	L	91.5	Very high	82.9	Confident	18 Å²	18	46.8 Å²	46.8	9%	0.094	22%	0.22	C	C	.	.	H	α-helix	trans	-57.3	-47.3	176	172	60.9	0	0	0	111.7	I229 I230 L236 K237 L310 L374 L378	I229-L233 PolarHBondContact O-N 2.88Å; I230-L233 PolarHBondContact O-N 3.43Å; L233-L236 PolarHBondContact O-N 3.16Å; L233-K237 HydrophobicContact CD1-CG 4.43Å; L233-K237 PolarHBondContact O-N 2.84Å; L233-L310 HydrophobicContact CD2-CD2 4.42Å; L233-L374 HydrophobicContact CB-CD2 4.05Å; L233-L374 HydrophobicContact CD1-CD2 3.77Å; L233-L374 HydrophobicContact CG-CD2 4.4Å; L233-L378 HydrophobicContact CD1-CD1 4.16Å; L233-L378 HydrophobicContact CD1-CD2 4.29Å; L233-L378 HydrophobicContact CD1-CG 4.44Å
234	M	90.4	Very high	82.4	Confident	124 Å²	124	48.6 Å²	48.6	61%	0.611	23%	0.233	S	C	*	.	H	α-helix	trans	-63.6	-40.6	176.1	-74.1	-172.9	173.8	0	0	112.3	I230 L232 K237 K238	I230-M234 HydrophobicContact CG2-CE 3.99Å; I230-M234 HydrophobicContact CG2-CG 4.34Å; I230-M234 HydrophobicContact CG2-SD 4.32Å; I230-M234 WeakPolarHBondContact O-CB 3.38Å; I230-M234 WeakPolarHBondContact O-CG 3.48Å; I230-M234 PolarHBondContact O-N 2.9Å; L232-M234 PolarHBondContact O-N 2.74Å; M234-K237 PolarHBondContact O-N 2.88Å; M234-K238 VanDerWaalsContact O-CB 3.26Å; M234-K238 WeakPolarHBondContact O-CB 3.31Å; M234-K238 PolarHBondContact O-N 3.27Å
235	W	91.9	Very high	82.1	Confident	17 Å²	17	53.9 Å²	53.9	6%	0.064	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-41.4	176.3	-179	86.9	0	0	0	111.8	K231 L232 K238 W239 S354 K355 F357 P505 I507 Y524	K231-W235 VanDerWaalsContact O-CB 3.26Å; K231-W235 WeakPolarHBondContact O-CB 3.1Å; K231-W235 PolarHBondContact O-N 2.89Å; L232-W235 HydrophobicContact CD1-CE3 4.05Å; L232-W235 HydrophobicContact CD1-CZ3 4.4Å; L232-W235 PolarHBondContact O-N 2.97Å; W235-K238 WeakPolarHBondContact O-CB 3.44Å; W235-K238 PolarHBondContact O-N 3.31Å; W235-W239 AromaticContact CD2-CD1 3.76Å; W235-W239 AromaticContact CD2-NE1 3.86Å; W235-W239 AromaticContact CE2-CD1 3.7Å; W235-W239 AromaticContact CE2-NE1 3.28Å; W235-W239 VanDerWaalsContact CE2-NE1 3.28Å; W235-W239 AromaticContact CH2-NE1 3.78Å; W235-W239 AromaticContact CZ2-CD1 3.95Å; W235-W239 AromaticContact CZ2-NE1 3.24Å; W235-W239 AromaticContact NE1-NE1 3.68Å; W235-W239 VanDerWaalsContact O-CD1 3.3Å; W235-W239 PolarHBondContact O-N 3.38Å; W235-S354 PolarHBondContact NE1-O 3.25Å; W235-K355 WeakPolarHBondContact CZ2-O 3.38Å; W235-F357 HydrophobicContact CB-CD2 4.26Å; W235-F357 HydrophobicContact CB-CE2 4.19Å; W235-F357 AromaticContact CD2-CD2 3.77Å; W235-F357 HydrophobicContact CD2-CD2 3.77Å; W235-F357 HydrophobicContact CE3-CB 4.24Å; W235-F357 AromaticContact CE3-CD2 3.85Å; W235-F357 HydrophobicContact CE3-CD2 3.85Å; W235-F357 HydrophobicContact CE3-CG 4.42Å; W235-F357 AromaticContact CG-CD2 3.99Å; W235-F357 HydrophobicContact CG-CD2 3.99Å; W235-F357 HydrophobicContact CG-CE2 4.36Å; W235-F357 HydrophobicContact CH2-CB 3.91Å; W235-F357 HydrophobicContact CZ2-CB 4.31Å; W235-F357 HydrophobicContact CZ3-CB 3.88Å; W235-F357 HydrophobicContact CZ3-CD2 4.37Å; W235-P505 HydrophobicContact CE3-CB 4.48Å; W235-P505 HydrophobicContact CH2-CB 3.46Å; W235-P505 VanDerWaalsContact CH2-CB 3.46Å; W235-P505 HydrophobicContact CZ2-CB 4.31Å; W235-P505 HydrophobicContact CZ3-CB 3.56Å; W235-I507 HydrophobicContact CZ3-CD1 4.44Å; W235-I507 HydrophobicContact CZ3-CG1 4.03Å; W235-Y524 AromaticContact CD1-CD2 3.69Å; W235-Y524 AromaticContact CD1-CE2 3.48Å; W235-Y524 VanDerWaalsContact CD1-CE2 3.48Å; W235-Y524 HydrophobicContact CG-CD2 4.47Å; W235-Y524 AromaticContact NE1-CD2 3.62Å; W235-Y524 AromaticContact NE1-CE2 3.54Å
236	L	92.4	Very high	81.8	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-69.7	-42.3	175.2	-71.1	176.9	0	0	0	113.1	L232 L233 K238 W239 K240 L374 L378 F380 I475 P505 I507	L232-L236 HydrophobicContact CD1-CD1 4.29Å; L232-L236 HydrophobicContact CD1-CG 4.31Å; L232-L236 HydrophobicContact CG-CD1 4.39Å; L232-L236 PolarHBondContact O-N 3.28Å; L233-L236 PolarHBondContact O-N 3.16Å; L236-K238 VanDerWaalsContact C-N 3.26Å; L236-K238 PolarHBondContact O-N 3.38Å; L236-W239 WeakPolarHBondContact O-CB 3.46Å; L236-W239 PolarHBondContact O-N 3.45Å; L236-W239 VanDerWaalsContact O-N 3.13Å; L236-K240 PolarHBondContact O-N 3.27Å; L236-L374 HydrophobicContact CD1-CB 4.12Å; L236-L374 HydrophobicContact CD1-CD1 4.42Å; L236-L378 HydrophobicContact CB-CD1 3.41Å; L236-L378 VanDerWaalsContact CB-CD1 3.41Å; L236-L378 HydrophobicContact CD1-CD1 4.25Å; L236-L378 HydrophobicContact CG-CD1 4.48Å; L236-F380 HydrophobicContact CB-CE2 4.41Å; L236-I475 HydrophobicContact CD1-CD1 4.09Å; L236-I475 HydrophobicContact CD2-CD1 3.84Å; L236-I475 HydrophobicContact CD2-CG1 3.98Å; L236-P505 HydrophobicContact CD2-CB 4.03Å; L236-P505 HydrophobicContact CD2-CG 4.15Å; L236-I507 HydrophobicContact CD1-CD1 4.4Å; L236-I507 HydrophobicContact CD2-CD1 4.37Å
237	K	91	Very high	80.8	Confident	76 Å²	76	57.8 Å²	57.8	33%	0.33	27%	0.274	S	S	.	.	H	α-helix	trans	-55.6	-43	171	-80.3	-166.5	175.2	-170.4	0	111.2	L233 M234 W239 K240 Y241 E304 L378	L233-K237 HydrophobicContact CD1-CG 4.43Å; L233-K237 PolarHBondContact O-N 2.84Å; M234-K237 PolarHBondContact O-N 2.88Å; K237-W239 PolarHBondContact O-N 2.77Å; K237-K240 PolarHBondContact O-N 3.26Å; K237-Y241 PolarHBondContact O-N 3.14Å; K237-E304 IonicContact NZ-OE2 3.89Å; K237-E304 PolarHBondContact NZ-OE2 3.05Å; K237-L378 HydrophobicContact CG-CD1 4.49Å; K237-L378 HydrophobicContact CG-CD2 3.78Å
238	K	89.5	Confident	79.5	Confident	104 Å²	104	62.6 Å²	62.6	45%	0.452	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-33.2	177.1	-170.3	173.9	-172.6	168.6	0	113.2	M234 W235 L236 K242	M234-K238 VanDerWaalsContact O-CB 3.26Å; M234-K238 WeakPolarHBondContact O-CB 3.31Å; M234-K238 PolarHBondContact O-N 3.27Å; W235-K238 WeakPolarHBondContact O-CB 3.44Å; W235-K238 PolarHBondContact O-N 3.31Å; L236-K238 VanDerWaalsContact C-N 3.26Å; L236-K238 PolarHBondContact O-N 3.38Å; K238-K242 WeakPolarHBondContact O-CG 3.34Å; K238-K242 PolarHBondContact O-N 3.08Å
239	W	87.7	Confident	77.9	Confident	25 Å²	25	65.8 Å²	65.8	10%	0.095	32%	0.32	C	S	.	.	H	α-helix	trans	-68.3	-46.1	170	-88.8	106	0	0	0	112.4	W235 L236 K237 Y241 K242 N243 K355 F380 R503 P505	W235-W239 AromaticContact CD2-CD1 3.76Å; W235-W239 AromaticContact CD2-NE1 3.86Å; W235-W239 AromaticContact CE2-CD1 3.7Å; W235-W239 AromaticContact CE2-NE1 3.28Å; W235-W239 VanDerWaalsContact CE2-NE1 3.28Å; W235-W239 AromaticContact CH2-NE1 3.78Å; W235-W239 AromaticContact CZ2-CD1 3.95Å; W235-W239 AromaticContact CZ2-NE1 3.24Å; W235-W239 AromaticContact NE1-NE1 3.68Å; W235-W239 VanDerWaalsContact O-CD1 3.3Å; W235-W239 PolarHBondContact O-N 3.38Å; L236-W239 WeakPolarHBondContact O-CB 3.46Å; L236-W239 PolarHBondContact O-N 3.45Å; L236-W239 VanDerWaalsContact O-N 3.13Å; K237-W239 PolarHBondContact O-N 2.77Å; W239-Y241 VanDerWaalsContact C-N 3.33Å; W239-Y241 PolarHBondContact O-N 3.46Å; W239-K242 PolarHBondContact O-N 2.93Å; W239-N243 PolarHBondContact O-N 3.42Å; W239-K355 HydrophobicContact CH2-CG 4.46Å; W239-K355 HydrophobicContact CZ2-CB 4.26Å; W239-K355 HydrophobicContact CZ2-CG 4.18Å; W239-F380 HydrophobicContact CB-CZ 4.25Å; W239-R503 WeakPolarHBondContact CZ3-O 3.43Å; W239-P505 HydrophobicContact CB-CG 4.33Å; W239-P505 HydrophobicContact CD2-CB 4.15Å; W239-P505 HydrophobicContact CD2-CG 4.27Å; W239-P505 HydrophobicContact CG-CB 4Å; W239-P505 HydrophobicContact CG-CG 4.09Å
240	K	86	Confident	75.9	Confident	84 Å²	84	72.8 Å²	72.8	37%	0.365	35%	0.354	S	S	.	.	H	α-helix	trans	-56.9	-46	177.7	-172.7	174	178.3	173.5	0	111.6	L236 K237 K242 N243 S244 L378 F380	L236-K240 PolarHBondContact O-N 3.27Å; K237-K240 PolarHBondContact O-N 3.26Å; K240-K242 PolarHBondContact O-N 3.4Å; K240-N243 PolarHBondContact O-N 3.48Å; K240-S244 PolarHBondContact O-N 2.95Å; K240-L378 WeakPolarHBondContact CD-O 3.41Å; K240-L378 WeakPolarHBondContact CE-O 3.39Å; K240-L378 PolarHBondContact NZ-O 2.75Å; K240-F380 HydrophobicContact CB-CE2 3.99Å; K240-F380 HydrophobicContact CB-CZ 3.87Å
241	Y	84.9	Confident	73.2	Confident	129 Å²	129	80.1 Å²	80.1	51%	0.506	39%	0.388	S	S	.	.	H	α-helix	trans	-67.2	-30.2	178.5	-176.5	-97.9	0	0	0	114.4	K237 W239 S244 K245	K237-Y241 PolarHBondContact O-N 3.14Å; W239-Y241 VanDerWaalsContact C-N 3.33Å; W239-Y241 PolarHBondContact O-N 3.46Å; Y241-S244 PolarHBondContact O-OG 2.93Å; Y241-K245 HydrophobicContact CD1-CD 4.43Å; Y241-K245 HydrophobicContact CE1-CD 3.72Å; Y241-K245 PolarHBondContact O-N 2.79Å; Y241-K245 VanDerWaalsContact OH-CE 3.26Å; Y241-K245 WeakPolarHBondContact OH-CE 3.49Å; Y241-K245 PolarHBondContact OH-NZ 2.7Å
242	K	78.3	Confident	70.5	Confident	79 Å²	79	79.1 Å²	79.1	34%	0.343	40%	0.395	S	S	.	.	H	α-helix	trans	-65.9	-44.9	173	-82.5	178.3	179.8	178.3	0	111.6	K238 W239 K240 K245 V246 Q353	K238-K242 WeakPolarHBondContact O-CG 3.34Å; K238-K242 PolarHBondContact O-N 3.08Å; W239-K242 PolarHBondContact O-N 2.93Å; K240-K242 PolarHBondContact O-N 3.4Å; K242-K245 PolarHBondContact O-N 2.73Å; K242-V246 PolarHBondContact O-N 2.91Å; K242-V246 VanDerWaalsContact O-N 3.11Å; K242-Q353 VanDerWaalsContact CE-OE1 3.26Å
243	N	71.2	Confident	67.4	Low	37 Å²	37	84.9 Å²	84.9	20%	0.198	44%	0.435	C	S	.	.	H	α-helix	trans	-67.3	-42.6	-173.5	-68.8	-6.6	0	0	0	111.4	W239 K240 K245 V246 E247 N473	W239-N243 PolarHBondContact O-N 3.42Å; K240-N243 PolarHBondContact O-N 3.48Å; N243-K245 VanDerWaalsContact C-N 3.32Å; N243-K245 PolarHBondContact O-N 3.04Å; N243-V246 PolarHBondContact O-N 3.29Å; N243-V246 VanDerWaalsContact O-N 3.12Å; N243-E247 PolarHBondContact O-N 2.8Å; N243-E247 VanDerWaalsContact O-N 3.14Å; N243-N473 WeakPolarHBondContact CB-OD1 3.5Å; N243-N473 PolarHBondContact ND2-OD1 3.3Å
244	S	69.2	Low	64.4	Low	49 Å²	49	91.3 Å²	91.3	34%	0.343	47%	0.469	S	S	.	.	H	α-helix	trans	-62.6	-35.5	173.5	57.1	0	0	0	0	113	K240 Y241 V246 E247 N248	K240-S244 PolarHBondContact O-N 2.95Å; Y241-S244 PolarHBondContact O-OG 2.93Å; S244-V246 VanDerWaalsContact C-N 3.32Å; S244-V246 PolarHBondContact O-N 3.45Å; S244-E247 PolarHBondContact O-N 3Å; S244-N248 PolarHBondContact O-N 3.1Å; S244-N248 PolarHBondContact O-OD1 3.17Å
245	K	64.7	Low	61.4	Low	122 Å²	122	89.6 Å²	89.6	53%	0.53	47%	0.469	S	S	.	.	H	α-helix	trans	-67.4	-27.8	173.5	-96	-173.3	165.2	171.3	0	114.3	Y241 K242 N243	Y241-K245 HydrophobicContact CD1-CD 4.43Å; Y241-K245 HydrophobicContact CE1-CD 3.72Å; Y241-K245 PolarHBondContact O-N 2.79Å; Y241-K245 VanDerWaalsContact OH-CE 3.26Å; Y241-K245 WeakPolarHBondContact OH-CE 3.49Å; Y241-K245 PolarHBondContact OH-NZ 2.7Å; K242-K245 PolarHBondContact O-N 2.73Å; N243-K245 VanDerWaalsContact C-N 3.32Å; N243-K245 PolarHBondContact O-N 3.04Å
246	V	60.4	Low	58.6	Low	67 Å²	67	99.1 Å²	99.1	41%	0.406	51%	0.511	S	S	.	.	H	α-helix	trans	-73	-44.5	173.5	173.6	0	0	0	0	110.2	K242 N243 S244 N248 S249	K242-V246 PolarHBondContact O-N 2.91Å; K242-V246 VanDerWaalsContact O-N 3.11Å; N243-V246 PolarHBondContact O-N 3.29Å; N243-V246 VanDerWaalsContact O-N 3.12Å; S244-V246 VanDerWaalsContact C-N 3.32Å; S244-V246 PolarHBondContact O-N 3.45Å; V246-N248 PolarHBondContact O-N 2.73Å; V246-S249 PolarHBondContact O-N 2.82Å; V246-S249 VanDerWaalsContact O-N 3.1Å; V246-S249 PolarHBondContact O-OG 2.68Å
247	E	49.7	Very low	55.5	Low	73 Å²	73	105.2 Å²	105.2	34%	0.341	54%	0.544	S	S	.	.	H	α-helix	trans	-61.6	-45.5	177.9	-67	-177.7	176.5	0	0	111.8	N243 S244 S249 M250 N471	N243-E247 PolarHBondContact O-N 2.8Å; N243-E247 VanDerWaalsContact O-N 3.14Å; S244-E247 PolarHBondContact O-N 3Å; E247-S249 PolarHBondContact O-N 3.27Å; E247-M250 PolarHBondContact O-N 2.92Å; E247-N471 VanDerWaalsContact CD-ND2 3.27Å; E247-N471 WeakPolarHBondContact OE1-CB 3.35Å; E247-N471 PolarHBondContact OE1-ND2 2.84Å; E247-N471 PolarHBondContact OE2-ND2 3.33Å
248	N	47.4	Very low	52.5	Low	137 Å²	137	110.7 Å²	110.7	73%	0.733	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-6.7	176.1	-70.1	7.8	0	0	0	114.5	S244 V246	S244-N248 PolarHBondContact O-N 3.1Å; S244-N248 PolarHBondContact O-OD1 3.17Å; V246-N248 PolarHBondContact O-N 2.73Å
249	S	43.7	Very low	49.6	Very low	90 Å²	90	111.7 Å²	111.7	63%	0.629	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	1.2	174	72.6	0	0	0	0	114	V246 E247	V246-S249 PolarHBondContact O-N 2.82Å; V246-S249 VanDerWaalsContact O-N 3.1Å; V246-S249 PolarHBondContact O-OG 2.68Å; E247-S249 PolarHBondContact O-N 3.27Å
250	M	39.3	Very low	47	Very low	147 Å²	147	116.3 Å²	116.3	72%	0.724	61%	0.614	S	S	*	*			trans	-124.1	29.3	-173.2	-63.7	-169.2	69.7	0	0	114.3	E247	E247-M250 PolarHBondContact O-N 2.92Å
251	E	28.7	Very low	44.3	Very low	171 Å²	171	121.4 Å²	121.4	80%	0.799	64%	0.636	S	S	*	*			trans	-73.6	132	166.3	-91.3	-104.8	112.5	0	0	111.4	S253	E251-S253 PolarHBondContact O-N 3.35Å
252	P	32.1	Very low	41.6	Very low	110 Å²	110	120 Å²	120	71%	0.714	65%	0.645	S	S	*	*			trans	-81.9	107	-179.3	31.8	-33.4	0	0	0	111.9	L254	P252-L254 PolarHBondContact O-N 2.96Å
253	S	24.5	Very low	39.5	Very low	123 Å²	123	122 Å²	122	86%	0.86	66%	0.664	S	S	*	*			trans	-71.9	80.1	179.5	48	0	0	0	0	113.7	E251	E251-S253 PolarHBondContact O-N 3.35Å
254	L	28.8	Very low	37.8	Very low	152 Å²	152	129.4 Å²	129.4	80%	0.796	69%	0.694	S	S	*	*			trans	-148.7	120.4	171.1	-114	169.1	0	0	0	116.3	P252	P252-L254 PolarHBondContact O-N 2.96Å
255	S	28.7	Very low	35.8	Very low	89 Å²	89	136.3 Å²	136.3	62%	0.622	72%	0.718	S	S	*	*			trans	74	97.3	154.3	70.7	0	0	0	0	120.9
256	K	32.2	Very low	34.3	Very low	216 Å²	216	141.8 Å²	141.8	94%	0.939	74%	0.735	S	S	*	*				-111.9	154.5	119.9	-80.4	-176.6	178.1	173.9	0	108.9
257	N	27.4	Very low	32.8	Very low	129 Å²	129	145.5 Å²	145.5	69%	0.69	75%	0.752	S	S	*	*			trans	-127.9	141.2	-152.6	-115.3	-56.2	0	0	0	112.9
258	K	27.3	Very low	31.9	Very low	191 Å²	191	152.9 Å²	152.9	83%	0.83	78%	0.777	S	S	*	*			trans	68.4	155.1	164.3	-59.4	165.1	-176.9	172.8	0	115.1
259	T	30	Very low	31.1	Very low	125 Å²	125	151.3 Å²	151.3	77%	0.767	78%	0.777	S	S	*	*			cis	-84.2	-156.6	4	48.9	0	0	0	0	111.8
260	T	33.1	Very low	30.2	Very low	122 Å²	122	152.5 Å²	152.5	75%	0.748	79%	0.785	S	S	*	*			cis	-152.2	170.9	13	-36	0	0	0	0	112.9
261	K	29.3	Very low	30.1	Very low	192 Å²	192	151 Å²	151	84%	0.835	79%	0.786	S	S	*	*			trans	-59.6	156.3	167.5	-57.7	164.3	-176.4	173.9	0	110.7
262	S	28.4	Very low	30.1	Very low	99 Å²	99	153.7 Å²	153.7	69%	0.692	79%	0.789	S	S	*	*			cis	-170.8	151.7	-7.1	42.6	0	0	0	0	109
263	T	34.1	Very low	30	Very low	120 Å²	120	159 Å²	159	74%	0.736	80%	0.796	S	S	*	*				175.5	162.4	83.5	38.6	0	0	0	0	112.3
264	K	34.3	Very low	30.2	Very low	194 Å²	194	158.4 Å²	158.4	84%	0.843	79%	0.793	S	S	*	*			trans	42.9	102.2	159	-65	173	-178.6	175.2	0	118.5
265	K	28.7	Very low	30.3	Very low	193 Å²	193	155.9 Å²	155.9	84%	0.839	79%	0.788	S	S	*	*				64.2	97.4	73.6	-76.2	-168.5	170.8	-178.7	0	117.7
266	R	32.9	Very low	30.5	Very low	238 Å²	238	158.4 Å²	158.4	90%	0.898	79%	0.794	S	S	*	*				-175	120.2	123.9	-103.4	169	139.8	158.2	-6.2	107.1
267	L	28.3	Very low	30.4	Very low	145 Å²	145	156 Å²	156	76%	0.759	79%	0.786	S	S	*	*				58.5	116.3	59.3	-63.7	169.4	0	0	0	111.1
268	R	31.7	Very low	30.7	Very low	227 Å²	227	156.9 Å²	156.9	86%	0.857	79%	0.791	S	S	*	*			cis	-150.4	138.3	30.3	-107	171.3	-176.9	164.8	-1.9	115.1
269	S	29.6	Very low	30.7	Very low	105 Å²	105	156.8 Å²	156.8	73%	0.734	79%	0.791	S	S	*	*			trans	28.6	120.6	137.6	59.8	0	0	0	0	123.6
270	S	25.9	Very low	30.8	Very low	114 Å²	114	155.5 Å²	155.5	80%	0.797	78%	0.783	S	S	*	*			trans	-74.5	-165.4	146.1	-32.5	0	0	0	0	111.1
271	P	37	Very low	30.5	Very low	116 Å²	116	155.8 Å²	155.8	75%	0.753	78%	0.784	S	S	*	*			cis	-138.3	172.7	-4.9	42.3	-24.8	0	0	0	117.1
272	R	27.4	Very low	30.5	Very low	228 Å²	228	156.2 Å²	156.2	86%	0.86	79%	0.786	S	S	*	*			trans	167.8	146.7	152.4	-93.8	165.7	-151.8	-161.7	5.1	106.3
273	Y	30.7	Very low	30.4	Very low	220 Å²	220	156.9 Å²	156.9	86%	0.863	79%	0.79	S	S	*	*			cis	-131.7	179.9	2.8	-118.5	-81.1	0	0	0	109.5
274	S	27.5	Very low	30.4	Very low	112 Å²	112	157.2 Å²	157.2	78%	0.783	79%	0.794	S	S	*	*			trans	-146.8	129.6	173.8	-173.6	0	0	0	0	111.4
275	S	32	Very low	30.1	Very low	99 Å²	99	151.6 Å²	151.6	69%	0.692	78%	0.784	S	S	*	*			trans	152.2	136.9	175.8	166.7	0	0	0	0	106.4
276	D	32.7	Very low	30.1	Very low	141 Å²	141	150.7 Å²	150.7	75%	0.754	78%	0.783	S	S	*	*			cis	-163.5	166.2	-20.5	-78.1	-46.5	0	0	0	104.8
277	E	30.6	Very low	30.1	Very low	166 Å²	166	149.7 Å²	149.7	78%	0.776	79%	0.785	S	S	*	*			cis	-155.7	-142.2	-1.5	-127.4	-77.1	-149.5	0	0	106.9
278	D	32.9	Very low	30	Very low	147 Å²	147	153.8 Å²	153.8	79%	0.786	79%	0.79	S	S	*	*			trans	79.8	89.2	159.6	-79.2	-22.9	0	0	0	119.8
279	F	27.4	Very low	30.1	Very low	189 Å²	189	152 Å²	152	83%	0.829	79%	0.791	S	S	*	*				64.9	130.8	115.1	-149.9	-125	0	0	0	122.9
280	V	32.4	Very low	29.9	Very low	99 Å²	99	155.4 Å²	155.4	60%	0.6	79%	0.793	S	S	*	*			trans	75.2	101.8	161.1	171.2	0	0	0	0	120.6
281	V	27.2	Very low	30.2	Very low	128 Å²	128	160.8 Å²	160.8	78%	0.776	80%	0.797	S	S	*	*			trans	19.6	106.2	134.4	-167.6	0	0	0	0	118.1
282	K	28.9	Very low	29.6	Very low	201 Å²	201	162.4 Å²	162.4	87%	0.874	80%	0.8	S	S	*	*			trans	-131.5	125.5	142.3	-71.5	-176.9	-178.9	171.8	0	109.5	P284	K282-P284 WeakPolarHBondContact O-CD 3.2Å
283	S	26.6	Very low	29.7	Very low	112 Å²	112	158 Å²	158	78%	0.783	80%	0.798	S	S	*	*			trans	-99.1	114.6	175.4	55.3	0	0	0	0	111.1
284	P	34.1	Very low	29.6	Very low	127 Å²	127	155.5 Å²	155.5	83%	0.825	79%	0.793	S	S	*	*			trans	-89.5	139.2	167.3	-3.9	24.3	0	0	0	110.4	K282	K282-P284 WeakPolarHBondContact O-CD 3.2Å
285	A	27.3	Very low	29.6	Very low	76 Å²	76	156.6 Å²	156.6	63%	0.628	80%	0.795	S	S	*	*			trans	-94.6	161	177.6	0	0	0	0	0	112.6
286	H	29.4	Very low	29.4	Very low	174 Å²	174	156.6 Å²	156.6	81%	0.806	79%	0.793	S	S	*	*			trans	58.7	110.7	159.8	-51.1	-52.9	0	0	0	119.3
287	K	32.9	Very low	29.1	Very low	217 Å²	217	153.9 Å²	153.9	94%	0.943	80%	0.798	S	S	*	*				-133.3	127.6	118.7	-103.5	173.4	-175.6	176.2	0	109.5
288	R	26.4	Very low	29	Very low	231 Å²	231	150.9 Å²	150.9	87%	0.872	80%	0.796	S	S	*	*			trans	-83.6	144.1	171.8	-74.1	170.7	162.6	162.1	-7.6	108.7
289	H	32.3	Very low	28.8	Very low	189 Å²	189	149.9 Å²	149.9	88%	0.875	79%	0.794	S	S	*	*			trans	-143.9	138.5	140.5	-107.2	-83.3	0	0	0	109.5
290	K	26.3	Very low	28.7	Very low	178 Å²	178	148.8 Å²	148.8	77%	0.774	79%	0.792	S	S	*	*			trans	-85.4	147.5	174.7	-59.5	175.1	178	179	0	109.3
291	Y	31.4	Very low	28.4	Very low	227 Å²	227	150.4 Å²	150.4	89%	0.89	80%	0.797	S	S	*	*			trans	-147.9	138.2	132	-87.6	-66.9	0	0	0	109.6
292	N	25.6	Very low	28.6	Very low	150 Å²	150	150.3 Å²	150.3	80%	0.802	79%	0.791	S	S	*	*			trans	-93.4	128.5	174.7	-64.8	-7.1	0	0	0	108.9
293	V	29.9	Very low	28.6	Very low	136 Å²	136	147.5 Å²	147.5	82%	0.824	79%	0.786	S	S	*	*			trans	-141	115.7	153.6	-178.9	0	0	0	0	109
294	H	27	Very low	28.8	Very low	166 Å²	166	148 Å²	148	77%	0.769	78%	0.776	S	S	*	*			trans	33.3	112.5	150.8	-124.5	63.1	0	0	0	119.8
295	V	27.4	Very low	28.8	Very low	136 Å²	136	147 Å²	147	82%	0.824	76%	0.763	S	S	*	*			trans	-101.9	115.3	153.4	174.8	0	0	0	0	107.5
296	P	28.2	Very low	29.6	Very low	98 Å²	98	147.6 Å²	147.6	64%	0.636	76%	0.761	S	S	*	*			trans	-66	135.1	167.8	-17.6	31.7	0	0	0	110.1	S298	P296-S298 PolarHBondContact O-N 3.28Å
297	G	27.6	Very low	30.3	Very low	84 Å²	84	142.5 Å²	142.5	87%	0.866	74%	0.742	S	S	*	*			trans	-70	118.6	-176.5	0	0	0	0	0	113
298	S	28.4	Very low	30.7	Very low	104 Å²	104	138.5 Å²	138.5	73%	0.727	73%	0.73	S	S	*	*			trans	-140.4	82.2	156.4	45.2	0	0	0	0	108.5	P296 E300	P296-S298 PolarHBondContact O-N 3.28Å; S298-E300 PolarHBondContact O-N 3.12Å
299	V	27.5	Very low	31.8	Very low	125 Å²	125	131.3 Å²	131.3	76%	0.758	71%	0.709	S	S	*	*			trans	-72.1	91.9	159.5	178.8	0	0	0	0	105.5	N301	V299-N301 VanDerWaalsContact C-N 3.29Å; V299-N301 PolarHBondContact O-N 3.4Å
300	E	26.3	Very low	33.1	Very low	166 Å²	166	123.6 Å²	123.6	78%	0.776	67%	0.674	S	S	*	*			trans	-62.9	98.6	165.5	-72.4	-170.9	151.4	0	0	107.5	S298 I302	S298-E300 PolarHBondContact O-N 3.12Å; E300-I302 VanDerWaalsContact C-N 3.34Å; E300-I302 PolarHBondContact O-N 3.37Å
301	N	25.6	Very low	34.6	Very low	133 Å²	133	115.5 Å²	115.5	71%	0.711	64%	0.64	S	S	*	*			trans	-61.3	99.2	169.4	-75.3	-36.2	0	0	0	107.6	V299 N303	V299-N301 VanDerWaalsContact C-N 3.29Å; V299-N301 PolarHBondContact O-N 3.4Å; N301-N303 PolarHBondContact O-N 2.97Å
302	I	32.4	Very low	35.5	Very low	127 Å²	127	105.2 Å²	105.2	65%	0.651	60%	0.6	S	S	*	*			trans	-71	71.4	167.8	-53.3	-179.8	0	0	0	107.1	E300 E304	E300-I302 VanDerWaalsContact C-N 3.34Å; E300-I302 PolarHBondContact O-N 3.37Å; I302-E304 HydrophobicContact CG2-CB 4.23Å; I302-E304 HydrophobicContact CG2-CG 3.87Å; I302-E304 PolarHBondContact O-N 2.88Å
303	N	27.9	Very low	36.7	Very low	142 Å²	142	99.5 Å²	99.5	76%	0.759	58%	0.577	S	S	*	*			trans	-80.3	47.4	176.3	-136.7	15.5	0	0	0	109.1	N301 N305	N301-N303 PolarHBondContact O-N 2.97Å; N303-N305 VanDerWaalsContact C-N 3.31Å; N303-N305 PolarHBondContact O-N 2.97Å
304	E	31.7	Very low	37.5	Very low	122 Å²	122	95.8 Å²	95.8	57%	0.57	55%	0.548	S	S	*	.			trans	-66	94	166.4	-82.7	-171.5	-153.9	0	0	107.3	K237 I302 P306	K237-E304 IonicContact NZ-OE2 3.89Å; K237-E304 PolarHBondContact NZ-OE2 3.05Å; I302-E304 HydrophobicContact CG2-CB 4.23Å; I302-E304 HydrophobicContact CG2-CG 3.87Å; I302-E304 PolarHBondContact O-N 2.88Å; E304-P306 VanDerWaalsContact O-CD 3.24Å; E304-P306 WeakPolarHBondContact O-CD 3.12Å
305	N	34	Very low	38.6	Very low	105 Å²	105	92.9 Å²	92.9	56%	0.561	54%	0.537	S	S	*	.			trans	-51	112.2	166.9	-91.7	-34.7	0	0	0	108.3	N303 T307	N303-N305 VanDerWaalsContact C-N 3.31Å; N303-N305 PolarHBondContact O-N 2.97Å; N305-T307 PolarHBondContact O-N 3.5Å
306	P	44	Very low	39.1	Very low	90 Å²	90	94.1 Å²	94.1	58%	0.584	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-8.1	-168.4	28.2	-35.4	0	0	0	112.9	E304 L310	E304-P306 VanDerWaalsContact O-CD 3.24Å; E304-P306 WeakPolarHBondContact O-CD 3.12Å; P306-L310 WeakPolarHBondContact O-CD1 3.35Å; P306-L310 VanDerWaalsContact O-CG 3.28Å; P306-L310 WeakPolarHBondContact O-CG 3.46Å
307	T	43.6	Very low	39.4	Very low	66 Å²	66	96 Å²	96	41%	0.405	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-32.3	-173.8	47.9	0	0	0	0	114.6	N305 N309 L310	N305-T307 PolarHBondContact O-N 3.5Å; T307-N309 PolarHBondContact O-N 2.73Å; T307-L310 PolarHBondContact O-N 2.82Å
308	L	41	Very low	39.8	Very low	134 Å²	134	98.2 Å²	98.2	70%	0.702	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-1.1	-168	-70	174.1	0	0	0	115.7
309	N	49.7	Very low	40	Very low	80 Å²	80	97.1 Å²	97.1	43%	0.428	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.5	21.4	179.2	-67.7	-84.7	0	0	0	112.7	T307	T307-N309 PolarHBondContact O-N 2.73Å
310	L	60.8	Low	40	Very low	26 Å²	26	97.6 Å²	97.6	14%	0.136	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-88.4	155.3	177.8	-58.4	-179.9	0	0	0	110.8	S220 I230 L233 P306 T307 Y314	S220-L310 WeakPolarHBondContact CA-O 3.29Å; I230-L310 HydrophobicContact CD1-CD2 4.02Å; I230-L310 HydrophobicContact CG1-CD2 4.04Å; L233-L310 HydrophobicContact CD2-CD2 4.42Å; P306-L310 WeakPolarHBondContact O-CD1 3.35Å; P306-L310 VanDerWaalsContact O-CG 3.28Å; P306-L310 WeakPolarHBondContact O-CG 3.46Å; T307-L310 PolarHBondContact O-N 2.82Å; L310-Y314 HydrophobicContact CB-CD1 4.15Å; L310-Y314 HydrophobicContact CB-CG 4.1Å; L310-Y314 HydrophobicContact CD1-CD1 3.29Å; L310-Y314 HydrophobicContact CD1-CE1 3.35Å; L310-Y314 HydrophobicContact CD1-CG 3.95Å; L310-Y314 HydrophobicContact CG-CD1 4.32Å
311	P	56.2	Low	40.1	Very low	8 Å²	8	96.4 Å²	96.4	5%	0.052	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-73.3	165.4	-175.3	-2.9	18.8	0	0	0	112.8	C219 F222 T225 I229 G313 Y314	C219-P311 WeakPolarHBondContact O-CA 3.42Å; C219-P311 WeakPolarHBondContact O-CB 3.45Å; F222-P311 HydrophobicContact CB-CB 4.21Å; F222-P311 WeakPolarHBondContact O-CB 3.23Å; T225-P311 HydrophobicContact CG2-CB 3.61Å; T225-P311 HydrophobicContact CG2-CG 4Å; T225-P311 WeakPolarHBondContact CG2-O 3.08Å; I229-P311 HydrophobicContact CG2-CG 4.25Å; P311-G313 PolarHBondContact O-N 3.18Å; P311-Y314 WeakPolarHBondContact O-CB 3.28Å; P311-Y314 PolarHBondContact O-N 3.26Å
312	I	51.7	Low	40.1	Very low	12 Å²	12	96 Å²	96	6%	0.062	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	127.5	-175.4	-67.7	174	0	0	0	109.7	F178 P179 F222 T225	F178-I312 HydrophobicContact CD2-CG2 4.33Å; F178-I312 HydrophobicContact CE2-CG2 3.75Å; F178-I312 HydrophobicContact CZ-CG2 3.93Å; P179-I312 HydrophobicContact CG-CG2 3.74Å; F222-I312 PolarHBondContact O-N 2.94Å; T225-I312 WeakPolarHBondContact CG2-O 3.4Å
313	G	49.5	Very low	39.9	Very low	30 Å²	30	95.6 Å²	95.6	31%	0.309	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	25.1	-176	0	0	0	0	0	114.5	T225 P311 I315	T225-G313 PolarHBondContact OG1-O 2.57Å; T225-G313 VanDerWaalsContact OG1-O 3.09Å; P311-G313 PolarHBondContact O-N 3.18Å; G313-I315 PolarHBondContact O-N 3.39Å
314	Y	47.8	Very low	39.8	Very low	58 Å²	58	94.1 Å²	94.1	23%	0.227	52%	0.524	C	S	.	.			trans	-79.4	110.2	176.3	175.7	-100.2	0	0	0	111.5	I230 L310 P311 R316 I319	I230-Y314 HydrophobicContact CD1-CD2 3.73Å; I230-Y314 HydrophobicContact CD1-CE2 3.2Å; L310-Y314 HydrophobicContact CB-CD1 4.15Å; L310-Y314 HydrophobicContact CB-CG 4.1Å; L310-Y314 HydrophobicContact CD1-CD1 3.29Å; L310-Y314 HydrophobicContact CD1-CE1 3.35Å; L310-Y314 HydrophobicContact CD1-CG 3.95Å; L310-Y314 HydrophobicContact CG-CD1 4.32Å; P311-Y314 WeakPolarHBondContact O-CB 3.28Å; P311-Y314 PolarHBondContact O-N 3.26Å; Y314-R316 HydrophobicContact CE1-CB 4.11Å; Y314-I319 HydrophobicContact CE2-CD1 4.38Å
315	I	48.8	Very low	39.5	Very low	105 Å²	105	93.5 Å²	93.5	54%	0.538	53%	0.533	S	S	.	.			trans	-90.8	115.1	173.9	-59.1	177	0	0	0	109.1	G313 N317 Q318	G313-I315 PolarHBondContact O-N 3.39Å; I315-N317 HydrophobicContact CG2-CB 4.41Å; I315-N317 PolarHBondContact O-N 3.09Å; I315-Q318 PolarHBondContact O-N 3.13Å
316	R	38.8	Very low	39.2	Very low	161 Å²	161	94 Å²	94	61%	0.608	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-56.1	-28.2	-174.3	-174	171.9	177.6	162.4	-2.1	114.4	Y314 Q318	Y314-R316 HydrophobicContact CE1-CB 4.11Å; R316-Q318 VanDerWaalsContact C-N 3.28Å; R316-Q318 PolarHBondContact O-N 3.39Å
317	N	34.2	Very low	38.4	Very low	139 Å²	139	95.1 Å²	95.1	74%	0.743	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-79.8	-0.5	-170	-57.2	9.3	0	0	0	114.2	I315 I319	I315-N317 HydrophobicContact CG2-CB 4.41Å; I315-N317 PolarHBondContact O-N 3.09Å; N317-I319 VanDerWaalsContact C-N 3.33Å; N317-I319 PolarHBondContact O-N 3.48Å
318	Q	36.6	Very low	38	Very low	129 Å²	129	100.2 Å²	100.2	60%	0.603	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-86.7	7.5	-179.9	-64.2	-168.5	7.8	0	0	114.6	I315 R316	I315-Q318 PolarHBondContact O-N 3.13Å; R316-Q318 VanDerWaalsContact C-N 3.28Å; R316-Q318 PolarHBondContact O-N 3.39Å
319	I	32.9	Very low	37.6	Very low	81 Å²	81	102.4 Å²	102.4	42%	0.415	59%	0.586	S	S	.	*	S	Bend	trans	-137.6	63.4	179.1	-44.1	-179.3	0	0	0	110.9	P227 I230 Y314 N317	P227-I319 HydrophobicContact CB-CD1 4.07Å; P227-I319 HydrophobicContact CB-CG1 4.32Å; I230-I319 HydrophobicContact CD1-CD1 4.03Å; Y314-I319 HydrophobicContact CE2-CD1 4.38Å; N317-I319 VanDerWaalsContact C-N 3.33Å; N317-I319 PolarHBondContact O-N 3.48Å
320	D	25.9	Very low	36.5	Very low	136 Å²	136	105.2 Å²	105.2	73%	0.727	60%	0.601	S	S	*	*			trans	-145.1	16.4	173.8	-96.6	-42.5	0	0	0	115.5
321	V	30.1	Very low	35	Very low	140 Å²	140	111.6 Å²	111.6	85%	0.848	64%	0.635	S	S	*	*	S	Bend	trans	-134.7	85	172.9	-167.8	0	0	0	0	111.8
322	S	25.7	Very low	33.7	Very low	125 Å²	125	115.6 Å²	115.6	87%	0.874	66%	0.663	S	S	*	*	S	Bend	trans	-178.7	13.7	158.5	31.7	0	0	0	0	115.9
323	S	26.4	Very low	32.8	Very low	118 Å²	118	121 Å²	121	83%	0.825	70%	0.697	S	S	*	*	S	Bend	trans	-157	60.7	176.1	65.2	0	0	0	0	115.4
324	S	25.9	Very low	31.7	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	72%	0.721	S	S	*	*			trans	-151.2	48.8	178.5	46.6	0	0	0	0	113.3
325	S	26.4	Very low	30.8	Very low	109 Å²	109	129.4 Å²	129.4	76%	0.762	74%	0.741	S	S	*	*			trans	-78.8	125.8	171.1	57.7	0	0	0	0	111.9
326	S	27.2	Very low	30	Very low	116 Å²	116	131.6 Å²	131.6	81%	0.811	75%	0.754	S	S	*	*			trans	57.7	109.1	161.5	66	0	0	0	0	119.5
327	S	27.8	Very low	29.7	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	76%	0.764	S	S	*	*			trans	-162.1	105.4	135.8	56.6	0	0	0	0	110.3
328	D	34.6	Very low	29.4	Very low	174 Å²	174	132.8 Å²	132.8	93%	0.93	76%	0.762	S	S	*	*			trans	-109.9	152.7	158.1	-77.6	-55.6	0	0	0	107.8
329	E	33.1	Very low	29.1	Very low	179 Å²	179	134.3 Å²	134.3	84%	0.836	77%	0.768	S	S	*	*			trans	-99.8	149.4	-153.4	-60.8	-170.4	148.1	0	0	117
330	D	26.6	Very low	29.1	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	79%	0.792	S	S	*	*			trans	22.9	123.8	141.1	-63.1	0.8	0	0	0	121.1
331	N	29.6	Very low	29.3	Very low	160 Å²	160	135.7 Å²	135.7	86%	0.856	79%	0.794	S	S	*	*				163.2	144.9	125.5	-90.3	-70.5	0	0	0	109
332	S	28	Very low	29.3	Very low	92 Å²	92	135 Å²	135	64%	0.643	79%	0.786	S	S	*	*			cis	-166.9	-177.5	-4	53.5	0	0	0	0	110.5
333	T	33.2	Very low	29.6	Very low	126 Å²	126	134.6 Å²	134.6	77%	0.773	78%	0.781	S	S	*	*			trans	86.4	153.7	163.4	-8.6	0	0	0	0	118.9
334	E	25.3	Very low	29.7	Very low	171 Å²	171	134.1 Å²	134.1	80%	0.799	77%	0.769	S	S	*	*			trans	-89.3	178	-171.6	-57.1	136.6	135.5	0	0	111.6
335	S	30.9	Very low	30.1	Very low	94 Å²	94	138.9 Å²	138.9	66%	0.657	78%	0.775	S	S	*	*			cis	-156.1	159.3	17.5	-33.8	0	0	0	0	114.2
336	D	30.4	Very low	30.3	Very low	150 Å²	150	143.8 Å²	143.8	80%	0.802	78%	0.777	S	S	*	*			trans	63.1	161.9	140.4	-57.8	-28.1	0	0	0	124.7
337	E	33.6	Very low	30.5	Very low	176 Å²	176	149.4 Å²	149.4	82%	0.822	78%	0.781	S	S	*	*			trans	78	155.5	170.1	-68.4	-57.8	149.3	0	0	121.1
338	E	27.5	Very low	30.7	Very low	150 Å²	150	151.8 Å²	151.8	70%	0.701	78%	0.783	S	S	*	*			trans	-97.6	177.9	-147.7	-57.4	-161.8	133.2	0	0	118
339	H	29.9	Very low	30.4	Very low	160 Å²	160	153.4 Å²	153.4	74%	0.741	78%	0.777	S	S	*	*			trans	68.1	86.3	151.3	-83.9	71.6	0	0	0	117.6
340	N	32.7	Very low	30.6	Very low	171 Å²	171	149.6 Å²	149.6	91%	0.914	78%	0.776	S	S	*	*				-155	145.4	124.9	-113.6	-61.7	0	0	0	114.2
341	G	29.9	Very low	31.1	Very low	75 Å²	75	148.6 Å²	148.6	77%	0.773	77%	0.77	S	S	*	*			trans	-87.1	114.7	-175.3	0	0	0	0	0	113.1
342	N	31.1	Very low	31.7	Very low	126 Å²	126	150.8 Å²	150.8	67%	0.674	77%	0.767	S	S	*	*			trans	-106.3	116.2	178.4	-164.4	-37.9	0	0	0	111.8	N344	N342-N344 PolarHBondContact O-N 2.84Å; N342-N344 PolarHBondContact OD1-ND2 3.06Å
343	P	31.5	Very low	33.2	Very low	117 Å²	117	149 Å²	149	76%	0.76	75%	0.748	S	S	*	*			trans	-80.7	43.3	-167.3	34.2	-38.4	0	0	0	114.8
344	N	28.4	Very low	34.9	Very low	108 Å²	108	143.6 Å²	143.6	58%	0.578	72%	0.716	S	S	*	*			trans	-108.6	14.5	-169.9	-86	-59.7	0	0	0	117.1	N342 R346	N342-N344 PolarHBondContact O-N 2.84Å; N342-N344 PolarHBondContact OD1-ND2 3.06Å; N344-R346 PolarHBondContact O-N 3.23Å
345	K	34.1	Very low	37.7	Very low	210 Å²	210	138.3 Å²	138.3	91%	0.913	69%	0.69	S	S	*	*			trans	-77.1	53.9	156.2	-78.6	-178.3	179.5	168.4	0	111.6	R347	K345-R347 PolarHBondContact O-N 3.45Å
346	R	30.6	Very low	40.5	Very low	213 Å²	213	133.9 Å²	133.9	80%	0.804	66%	0.659	S	S	*	*			trans	-58.9	105.4	161	-78.9	-177.6	171.4	-179.5	-1.2	107.1	N344 L348	N344-R346 PolarHBondContact O-N 3.23Å; R346-L348 PolarHBondContact O-N 2.65Å
347	R	31.7	Very low	43.5	Very low	234 Å²	234	126.9 Å²	126.9	88%	0.883	62%	0.622	S	S	*	*			trans	-51.6	111.1	168.3	-75.8	175.9	167.4	171.6	-4.7	107.6	K345 R349	K345-R347 PolarHBondContact O-N 3.45Å; R347-R349 PolarHBondContact O-N 2.86Å
348	L	31.3	Very low	46.4	Very low	162 Å²	162	118.5 Å²	118.5	85%	0.848	58%	0.583	S	S	*	*			trans	-52.5	112.4	171.3	-75	166.9	0	0	0	107.2	R346 A350	R346-L348 PolarHBondContact O-N 2.65Å; L348-A350 PolarHBondContact O-N 3.23Å
349	R	29.6	Very low	49.6	Very low	209 Å²	209	111.4 Å²	111.4	79%	0.789	55%	0.549	S	S	*	.			trans	-57.7	126.4	-175.9	-74.7	-177.3	172.9	-177.2	-2.3	107.5	R347 N351	R347-R349 PolarHBondContact O-N 2.86Å; R349-N351 WeakPolarHBondContact O-CA 3.41Å; R349-N351 PolarHBondContact O-N 3.37Å
350	A	36.3	Very low	52.6	Low	99 Å²	99	103.9 Å²	103.9	82%	0.818	52%	0.515	S	S	*	.	S	Bend	trans	-44	111.4	-171.4	0	0	0	0	0	111	L348 W352	L348-A350 PolarHBondContact O-N 3.23Å; A350-W352 PolarHBondContact O-N 2.82Å
351	N	37.3	Very low	55.3	Low	118 Å²	118	96.1 Å²	96.1	63%	0.631	48%	0.475	S	S	*	.			trans	-40.5	109.9	-155.9	-67.2	-1.5	0	0	0	112.8	R349 Q353	R349-N351 WeakPolarHBondContact O-CA 3.41Å; R349-N351 PolarHBondContact O-N 3.37Å; N351-Q353 WeakPolarHBondContact O-CG 3.46Å; N351-Q353 PolarHBondContact O-N 3.42Å
352	W	43.4	Very low	58	Low	205 Å²	205	94.7 Å²	94.7	78%	0.777	45%	0.452	S	S	*	.			trans	-68.2	78.7	-173.2	-159.4	-45.6	0	0	0	110.6	A350	A350-W352 PolarHBondContact O-N 2.82Å
353	Q	58.5	Low	60.7	Low	54 Å²	54	91.9 Å²	91.9	25%	0.252	44%	0.435	S	S	.	.			trans	-85.7	119.1	-177.8	-74.6	162.9	43.5	0	0	108.8	K242 N351 K355	K242-Q353 VanDerWaalsContact CE-OE1 3.26Å; N351-Q353 WeakPolarHBondContact O-CG 3.46Å; N351-Q353 PolarHBondContact O-N 3.42Å; Q353-K355 PolarHBondContact O-N 3.48Å
354	S	69.1	Low	63.4	Low	13 Å²	13	86.9 Å²	86.9	9%	0.091	41%	0.405	C	S	.	.			trans	-60.6	140.1	174.4	-169.6	0	0	0	0	110.9	W235 A356 P522 A523	W235-S354 PolarHBondContact NE1-O 3.25Å; S354-A356 PolarHBondContact OG-N 2.89Å; S354-A356 PolarHBondContact OG-O 2.91Å; S354-A356 VanDerWaalsContact OG-O 3.14Å; S354-P522 WeakPolarHBondContact CB-O 3.33Å; S354-P522 PolarHBondContact OG-O 2.89Å; S354-A523 WeakPolarHBondContact OG-CA 3.43Å
355	K	83.5	Confident	66.3	Low	61 Å²	61	82.1 Å²	82.1	27%	0.265	38%	0.379	S	S	.	.	S	Bend	trans	-89.8	-10.8	170.7	-55.2	170.4	-179.2	-171.6	0	112.2	W235 W239 Q353 L499 Q500 A502 V506	W235-K355 WeakPolarHBondContact CZ2-O 3.38Å; W239-K355 HydrophobicContact CH2-CG 4.46Å; W239-K355 HydrophobicContact CZ2-CB 4.26Å; W239-K355 HydrophobicContact CZ2-CG 4.18Å; Q353-K355 PolarHBondContact O-N 3.48Å; K355-L499 WeakPolarHBondContact CD-O 3.23Å; K355-L499 WeakPolarHBondContact CE-O 3.45Å; K355-L499 PolarHBondContact NZ-O 2.92Å; K355-Q500 PolarHBondContact NZ-O 2.86Å; K355-A502 HydrophobicContact CD-CB 4.14Å; K355-A502 WeakPolarHBondContact CD-O 3.49Å; K355-A502 WeakPolarHBondContact CE-O 3.23Å; K355-A502 PolarHBondContact NZ-O 2.81Å; K355-V506 PolarHBondContact O-N 3.35Å
356	A	90.2	Very high	68.9	Low	1 Å²	1	73.1 Å²	73.1	1%	0.008	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139.1	178.5	0	0	0	0	0	110.9	S354 L499 V506 L508 A523 Y524	S354-A356 PolarHBondContact OG-N 2.89Å; S354-A356 PolarHBondContact OG-O 2.91Å; S354-A356 VanDerWaalsContact OG-O 3.14Å; A356-L499 HydrophobicContact CB-CD1 4.14Å; A356-L499 HydrophobicContact CB-CD2 3.84Å; A356-V506 CarbonylContact C-O 3.6Å; A356-V506 WeakPolarHBondContact CA-O 3.38Å; A356-L508 HydrophobicContact CB-CD1 4.29Å; A356-A523 HydrophobicContact CB-CB 3.72Å; A356-Y524 PolarHBondContact O-N 3.37Å; A356-Y524 VanDerWaalsContact O-N 3.08Å
357	F	93.5	Very high	71.9	Confident	3 Å²	3	63.7 Å²	63.7	1%	0.013	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	125.6	168	-151.2	-63.7	0	0	0	108.1	K231 L232 W235 L359 V506 I507 L508 Y524 C526	K231-F357 HydrophobicContact CB-CZ 4.44Å; L232-F357 HydrophobicContact CB-CE1 3.99Å; L232-F357 HydrophobicContact CB-CE2 4Å; L232-F357 HydrophobicContact CB-CZ 3.66Å; L232-F357 HydrophobicContact CD1-CB 4.22Å; L232-F357 HydrophobicContact CD1-CD1 3.85Å; L232-F357 HydrophobicContact CD1-CD2 3.71Å; L232-F357 HydrophobicContact CD1-CE1 4.08Å; L232-F357 HydrophobicContact CD1-CE2 3.98Å; L232-F357 HydrophobicContact CD1-CG 3.66Å; L232-F357 HydrophobicContact CD1-CZ 4.16Å; L232-F357 HydrophobicContact CG-CE1 4.48Å; L232-F357 HydrophobicContact CG-CZ 4.47Å; W235-F357 HydrophobicContact CB-CD2 4.26Å; W235-F357 HydrophobicContact CB-CE2 4.19Å; W235-F357 AromaticContact CD2-CD2 3.77Å; W235-F357 HydrophobicContact CD2-CD2 3.77Å; W235-F357 HydrophobicContact CE3-CB 4.24Å; W235-F357 AromaticContact CE3-CD2 3.85Å; W235-F357 HydrophobicContact CE3-CD2 3.85Å; W235-F357 HydrophobicContact CE3-CG 4.42Å; W235-F357 AromaticContact CG-CD2 3.99Å; W235-F357 HydrophobicContact CG-CD2 3.99Å; W235-F357 HydrophobicContact CG-CE2 4.36Å; W235-F357 HydrophobicContact CH2-CB 3.91Å; W235-F357 HydrophobicContact CZ2-CB 4.31Å; W235-F357 HydrophobicContact CZ3-CB 3.88Å; W235-F357 HydrophobicContact CZ3-CD2 4.37Å; F357-L359 HydrophobicContact CD1-CD1 4.06Å; F357-V506 PolarHBondContact N-O 2.92Å; F357-I507 HydrophobicContact CB-CG1 4.48Å; F357-I507 CarbonylContact O-C 3.59Å; F357-I507 VanDerWaalsContact O-CA 3.29Å; F357-I507 WeakPolarHBondContact O-CA 3.26Å; F357-L508 PolarHBondContact O-N 2.87Å; F357-Y524 CarbonylContact C-O 3.59Å; F357-Y524 WeakPolarHBondContact CA-O 3.38Å; F357-Y524 VanDerWaalsContact CD2-CB 3.47Å; F357-Y524 HydrophobicContact CD2-CD2 4.12Å; F357-Y524 HydrophobicContact CD2-CG 4.09Å; F357-Y524 HydrophobicContact CE2-CD2 4.42Å; F357-Y524 HydrophobicContact CE2-CG 4.08Å; F357-C526 HydrophobicContact CE1-CB 3.73Å
358	L	94.4	Very high	74.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.5	-178.5	174.8	66.4	0	0	0	110.2	V360 L508 A510 V515 V516 L519 Y524 I525 C526	L358-V360 HydrophobicContact CD1-CG2 4.36Å; L358-V360 HydrophobicContact CD2-CG2 3.68Å; L358-V360 HydrophobicContact CG-CG2 3.74Å; L358-L508 WeakPolarHBondContact CA-O 3.18Å; L358-L508 HydrophobicContact CB-CB 4.27Å; L358-L508 HydrophobicContact CD1-CB 3.51Å; L358-L508 HydrophobicContact CG-CB 4.49Å; L358-A510 HydrophobicContact CD1-CB 4.23Å; L358-V515 HydrophobicContact CD1-CG1 4.38Å; L358-V515 HydrophobicContact CD2-CG1 4.24Å; L358-V516 HydrophobicContact CD2-CG2 3.97Å; L358-L519 HydrophobicContact CD2-CD1 3.96Å; L358-L519 HydrophobicContact CD2-CD2 4.34Å; L358-L519 HydrophobicContact CD2-CG 4.43Å; L358-Y524 PolarHBondContact N-O 3.17Å; L358-I525 CarbonylContact O-C 3.59Å; L358-I525 WeakPolarHBondContact O-CA 3.39Å; L358-C526 PolarHBondContact O-N 3.29Å
359	L	94.4	Very high	77.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	114.5	170.1	-69.8	71.2	0	0	0	108.1	L232 F357 K367 I371 I507 L508 T509 A510 C526 F528	L232-L359 HydrophobicContact CD2-CD1 4.2Å; L232-L359 HydrophobicContact CD2-CD2 4.37Å; F357-L359 HydrophobicContact CD1-CD1 4.06Å; L359-K367 HydrophobicContact CD2-CB 4.42Å; L359-K367 WeakPolarHBondContact CD2-O 3.36Å; L359-I371 HydrophobicContact CD1-CD1 4.27Å; L359-I371 HydrophobicContact CD2-CD1 3.99Å; L359-I371 HydrophobicContact CD2-CG1 4.05Å; L359-I507 HydrophobicContact CD1-CG2 3.51Å; L359-L508 PolarHBondContact N-O 2.86Å; L359-T509 HydrophobicContact CB-CG2 4.45Å; L359-T509 CarbonylContact O-C 3.5Å; L359-T509 WeakPolarHBondContact O-CA 3.36Å; L359-A510 PolarHBondContact O-N 2.81Å; L359-C526 WeakPolarHBondContact CA-O 3.49Å; L359-F528 HydrophobicContact CB-CD2 4.37Å; L359-F528 HydrophobicContact CB-CE2 4.03Å; L359-F528 HydrophobicContact CD2-CE2 3.52Å; L359-F528 HydrophobicContact CD2-CZ 3.73Å; L359-F528 HydrophobicContact CG-CE2 3.77Å; L359-F528 HydrophobicContact CG-CZ 4.47Å
360	V	92.5	Very high	80.7	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149	175.9	178.8	0	0	0	0	108.7	L358 A510 V516 I525 C526 H527 F528	L358-V360 HydrophobicContact CD1-CG2 4.36Å; L358-V360 HydrophobicContact CD2-CG2 3.68Å; L358-V360 HydrophobicContact CG-CG2 3.74Å; V360-A510 WeakPolarHBondContact CA-O 3.37Å; V360-V516 HydrophobicContact CG2-CG2 4.3Å; V360-I525 HydrophobicContact CG2-CG2 4.25Å; V360-C526 PolarHBondContact N-O 2.64Å; V360-H527 CarbonylContact O-C 3.6Å; V360-H527 WeakPolarHBondContact O-CA 3.29Å; V360-F528 PolarHBondContact O-N 3.46Å
361	G	89.9	Confident	83.5	Confident	8 Å²	8	32.5 Å²	32.5	8%	0.082	17%	0.17	C	C	.	.			trans	145.4	176.7	167.2	0	0	0	0	0	112.5	K367 A510 S511	G361-K367 PolarHBondContact O-NZ 2.97Å; G361-A510 PolarHBondContact N-O 2.97Å; G361-S511 VanDerWaalsContact O-CA 3.24Å; G361-S511 WeakPolarHBondContact O-CA 3.48Å
362	P	87.6	Confident	86.2	Confident	45 Å²	45	30.8 Å²	30.8	29%	0.292	16%	0.155	S	C	.	.			trans	-59	169.6	-170	-27.9	36.5	0	0	0	116.2	T365 K367 F528 H577	P362-T365 HydrophobicContact CB-CG2 4Å; P362-T365 HydrophobicContact CG-CG2 4.46Å; P362-T365 PolarHBondContact O-OG1 3.48Å; P362-K367 PolarHBondContact O-NZ 3.5Å; P362-F528 WeakPolarHBondContact CD-O 3.49Å; P362-H577 WeakPolarHBondContact CB-CE1 3.41Å; P362-H577 WeakPolarHBondContact CB-NE2 3.47Å
363	H	87.9	Confident	88.5	Confident	67 Å²	67	21 Å²	21	31%	0.31	12%	0.118	S	C	.	.	S	Bend	trans	-64	166.5	169.7	-54.6	-84.4	0	0	0	110.4	T365 S511 H577 F916	H363-T365 PolarHBondContact O-N 2.83Å; H363-S511 PolarHBondContact CE1-OG 2.92Å; H363-H577 PolarHBondContact O-CE1 3.23Å; H363-H577 PolarHBondContact O-NE2 2.92Å; H363-F916 HydrophobicContact CB-CZ 4.16Å; H363-F916 AromaticContact CD2-CZ 3.83Å; H363-F916 AromaticContact CG-CZ 3.91Å
364	G	88	Confident	90.2	Very high	12 Å²	12	18.5 Å²	18.5	12%	0.124	11%	0.106	C	C	.	.	S	Bend	trans	68.1	-27.2	-178.7	0	0	0	0	0	118	G366 D579	G364-G366 PolarHBondContact O-N 3.37Å; G364-D579 VanDerWaalsContact CA-CG 3.42Å; G364-D579 WeakPolarHBondContact CA-OD1 3.44Å; G364-D579 PolarHBondContact N-OD2 2.65Å
365	T	88.5	Confident	91.3	Very high	7 Å²	7	18 Å²	18	4%	0.043	10%	0.103	C	C	.	.	S	Bend	trans	-64.7	2.8	-171.7	59.1	0	0	0	0	116	P362 H363 K367 F528 T529	P362-T365 HydrophobicContact CB-CG2 4Å; P362-T365 HydrophobicContact CG-CG2 4.46Å; P362-T365 PolarHBondContact O-OG1 3.48Å; H363-T365 PolarHBondContact O-N 2.83Å; T365-K367 PolarHBondContact O-N 2.89Å; T365-K367 WeakPolarHBondContact OG1-CG 3.31Å; T365-F528 WeakPolarHBondContact O-CD1 3.45Å; T365-T529 WeakPolarHBondContact CG2-O 3.33Å
366	G	89.8	Confident	91.7	Very high	22 Å²	22	21.2 Å²	21.2	23%	0.227	12%	0.117	C	C	.	.			trans	79.8	10.7	173.2	0	0	0	0	0	116.1	F222 G364 S368 A369 L370	F222-G366 WeakPolarHBondContact CE2-O 3.43Å; G364-G366 PolarHBondContact O-N 3.37Å; G366-S368 VanDerWaalsContact C-N 3.35Å; G366-S368 PolarHBondContact O-N 2.99Å; G366-A369 PolarHBondContact O-N 3.16Å; G366-L370 PolarHBondContact O-N 3.02Å
367	K	92.1	Very high	91.7	Very high	15 Å²	15	23.9 Å²	23.9	7%	0.065	13%	0.131	C	C	.	.	H	α-helix	trans	-39.1	-57.6	-179.8	-56.8	-171.7	-65	-98.3	0	113.5	L359 G361 P362 T365 T509 A510 S511 F528	L359-K367 HydrophobicContact CD2-CB 4.42Å; L359-K367 WeakPolarHBondContact CD2-O 3.36Å; G361-K367 PolarHBondContact O-NZ 2.97Å; P362-K367 PolarHBondContact O-NZ 3.5Å; T365-K367 PolarHBondContact O-N 2.89Å; T365-K367 WeakPolarHBondContact OG1-CG 3.31Å; K367-T509 HydrophobicContact CB-CG2 4.46Å; K367-A510 WeakPolarHBondContact CD-O 3.44Å; K367-A510 WeakPolarHBondContact CE-O 3.3Å; K367-A510 PolarHBondContact NZ-O 3.48Å; K367-S511 PolarHBondContact NZ-OG 3.46Å; K367-F528 HydrophobicContact CG-CB 4.48Å; K367-F528 HydrophobicContact CG-CD1 4.16Å; K367-F528 HydrophobicContact CG-CD2 4.33Å; K367-F528 HydrophobicContact CG-CE1 4.49Å; K367-F528 HydrophobicContact CG-CG 4.07Å
368	S	92.9	Very high	91.6	Very high	26 Å²	26	24.4 Å²	24.4	18%	0.182	13%	0.134	C	C	.	.	H	α-helix	trans	-73.2	-38.6	-177.5	-39	0	0	0	0	111.9	G366 L370 I371 Y372 D479	G366-S368 VanDerWaalsContact C-N 3.35Å; G366-S368 PolarHBondContact O-N 2.99Å; S368-L370 VanDerWaalsContact C-N 3.35Å; S368-L370 PolarHBondContact O-N 3.11Å; S368-I371 WeakPolarHBondContact O-CB 3.42Å; S368-I371 PolarHBondContact O-N 3.42Å; S368-Y372 WeakPolarHBondContact O-CD2 3.43Å; S368-Y372 PolarHBondContact O-N 2.96Å; S368-D479 WeakPolarHBondContact CB-OD1 3.38Å; S368-D479 PolarHBondContact OG-OD1 2.93Å
369	A	92.5	Very high	91.3	Very high	21 Å²	21	27 Å²	27	17%	0.174	16%	0.161	C	C	.	.	H	α-helix	trans	-60.3	-40.9	178.2	0	0	0	0	0	112.4	G366 I371 Y372 A373	G366-A369 PolarHBondContact O-N 3.16Å; A369-I371 PolarHBondContact O-N 2.64Å; A369-Y372 PolarHBondContact O-N 3.15Å; A369-A373 WeakPolarHBondContact O-CB 3.34Å; A369-A373 PolarHBondContact O-N 3.45Å
370	L	93.1	Very high	91.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-37	173.2	-179.9	70	0	0	0	112	F222 I229 L232 G366 S368 A373 L374 F528	F222-L370 HydrophobicContact CB-CD1 4.39Å; F222-L370 HydrophobicContact CD1-CD1 4.05Å; F222-L370 HydrophobicContact CD2-CB 4.25Å; F222-L370 HydrophobicContact CD2-CD1 4.25Å; F222-L370 HydrophobicContact CE1-CB 4.36Å; F222-L370 HydrophobicContact CE1-CD1 4.38Å; F222-L370 HydrophobicContact CE2-CB 3.85Å; F222-L370 HydrophobicContact CG-CD1 3.99Å; F222-L370 HydrophobicContact CZ-CB 3.92Å; I229-L370 HydrophobicContact CB-CD2 4.29Å; I229-L370 HydrophobicContact CD1-CD2 4.03Å; I229-L370 HydrophobicContact CG1-CD2 3.7Å; I229-L370 HydrophobicContact CG2-CD1 4Å; I229-L370 HydrophobicContact CG2-CD2 3.87Å; L232-L370 HydrophobicContact CD2-CD2 4.26Å; G366-L370 PolarHBondContact O-N 3.02Å; S368-L370 VanDerWaalsContact C-N 3.35Å; S368-L370 PolarHBondContact O-N 3.11Å; L370-A373 PolarHBondContact O-N 3.47Å; L370-L374 HydrophobicContact CD1-CD1 4.03Å; L370-L374 HydrophobicContact CD1-CG 4.03Å; L370-L374 HydrophobicContact CD2-CD1 4.14Å; L370-L374 HydrophobicContact CG-CD1 3.76Å; L370-L374 HydrophobicContact CG-CG 4.17Å; L370-L374 WeakPolarHBondContact O-CB 3.49Å; L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 3.26Å; L370-F528 HydrophobicContact CD2-CE1 4.45Å; L370-F528 HydrophobicContact CD2-CZ 3.7Å
371	I	94.1	Very high	91	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-68.4	-41.5	-179.5	-60.9	165.5	0	0	0	110.4	L359 S368 A369 A375 I382 L477 I507 T509	L359-I371 HydrophobicContact CD1-CD1 4.27Å; L359-I371 HydrophobicContact CD2-CD1 3.99Å; L359-I371 HydrophobicContact CD2-CG1 4.05Å; S368-I371 WeakPolarHBondContact O-CB 3.42Å; S368-I371 PolarHBondContact O-N 3.42Å; A369-I371 PolarHBondContact O-N 2.64Å; I371-A375 WeakPolarHBondContact O-CB 3.23Å; I371-A375 PolarHBondContact O-N 3.5Å; I371-I382 HydrophobicContact CG2-CD1 4.09Å; I371-L477 HydrophobicContact CD1-CD1 3.66Å; I371-L477 HydrophobicContact CG2-CD1 4.46Å; I371-L477 HydrophobicContact CG2-CD2 4.15Å; I371-I507 HydrophobicContact CD1-CB 4.48Å; I371-I507 HydrophobicContact CD1-CG2 3.51Å; I371-I507 HydrophobicContact CG1-CD1 4.5Å; I371-I507 HydrophobicContact CG1-CG2 4.15Å; I371-I507 HydrophobicContact CG2-CD1 4.01Å; I371-T509 HydrophobicContact CD1-CG2 3.5Å
372	Y	94.1	Very high	91	Very high	81 Å²	81	33.9 Å²	33.9	32%	0.318	19%	0.189	S	C	.	.	H	α-helix	trans	-63.7	-42.6	172.4	-67.9	-76.7	0	0	0	112	S368 A369 A375 K376 I382 E384 L477	S368-Y372 WeakPolarHBondContact O-CD2 3.43Å; S368-Y372 PolarHBondContact O-N 2.96Å; A369-Y372 PolarHBondContact O-N 3.15Å; Y372-A375 PolarHBondContact O-N 2.8Å; Y372-K376 WeakPolarHBondContact O-CB 3.31Å; Y372-K376 PolarHBondContact O-N 3.38Å; Y372-I382 HydrophobicContact CD1-CD1 3.38Å; Y372-I382 HydrophobicContact CE1-CB 4.44Å; Y372-I382 HydrophobicContact CE1-CD1 3.62Å; Y372-I382 HydrophobicContact CE1-CG2 4.24Å; Y372-I382 HydrophobicContact CG-CD1 4Å; Y372-E384 VanDerWaalsContact OH-CD 3.29Å; Y372-E384 PolarHBondContact OH-OE2 2.79Å; Y372-L477 HydrophobicContact CE2-CD2 4.33Å
373	A	92.7	Very high	90.9	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-55.7	176.6	0	0	0	0	0	112.1	A369 L370 A375 K376 D377	A369-A373 WeakPolarHBondContact O-CB 3.34Å; A369-A373 PolarHBondContact O-N 3.45Å; L370-A373 PolarHBondContact O-N 3.47Å; A373-A375 VanDerWaalsContact C-N 3.32Å; A373-A375 PolarHBondContact O-N 2.73Å; A373-K376 PolarHBondContact O-N 2.87Å; A373-K376 VanDerWaalsContact O-N 3.17Å; A373-D377 VanDerWaalsContact O-CG 3.28Å; A373-D377 PolarHBondContact O-N 2.78Å
374	L	93.3	Very high	91	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-37.2	178.1	-74.7	173.2	0	0	0	112.7	C219 L232 L233 L236 L370 L378	C219-L374 HydrophobicContact CB-CD2 3.79Å; C219-L374 HydrophobicContact CB-CG 4.42Å; L232-L374 HydrophobicContact CD2-CD1 3.6Å; L232-L374 HydrophobicContact CG-CD1 3.81Å; L233-L374 HydrophobicContact CB-CD2 4.05Å; L233-L374 HydrophobicContact CD1-CD2 3.77Å; L233-L374 HydrophobicContact CG-CD2 4.4Å; L236-L374 HydrophobicContact CD1-CB 4.12Å; L236-L374 HydrophobicContact CD1-CD1 4.42Å; L370-L374 HydrophobicContact CD1-CD1 4.03Å; L370-L374 HydrophobicContact CD1-CG 4.03Å; L370-L374 HydrophobicContact CD2-CD1 4.14Å; L370-L374 HydrophobicContact CG-CD1 3.76Å; L370-L374 HydrophobicContact CG-CG 4.17Å; L370-L374 WeakPolarHBondContact O-CB 3.49Å; L370-L374 WeakPolarHBondContact O-CG 3.48Å; L370-L374 PolarHBondContact O-N 3.26Å; L374-L378 VanDerWaalsContact O-CB 3.29Å; L374-L378 WeakPolarHBondContact O-CB 3.45Å; L374-L378 WeakPolarHBondContact O-CG 3.31Å; L374-L378 PolarHBondContact O-N 3.03Å; L374-L378 VanDerWaalsContact O-N 3.07Å
375	A	92.5	Very high	91.1	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	17%	0.173	C	C	.	.	H	α-helix	trans	-65.6	-43.7	175.7	0	0	0	0	0	111.3	I371 Y372 A373 G379 F380 I382 I475	I371-A375 WeakPolarHBondContact O-CB 3.23Å; I371-A375 PolarHBondContact O-N 3.5Å; Y372-A375 PolarHBondContact O-N 2.8Å; A373-A375 VanDerWaalsContact C-N 3.32Å; A373-A375 PolarHBondContact O-N 2.73Å; A375-G379 CarbonylContact O-C 3.44Å; A375-G379 PolarHBondContact O-N 3.06Å; A375-F380 HydrophobicContact CB-CB 4.19Å; A375-F380 PolarHBondContact O-N 3.36Å; A375-I382 HydrophobicContact CB-CD1 3.53Å; A375-I382 HydrophobicContact CB-CG1 3.71Å; A375-I475 HydrophobicContact CB-CD1 3.88Å
376	K	90.8	Very high	91.1	Very high	130 Å²	130	32.8 Å²	32.8	57%	0.565	18%	0.177	S	C	*	.	H	α-helix	trans	-63.3	-51.3	176.3	-179.9	179.9	158.2	-150.7	0	111.5	S217 Y372 A373 L378 G379	S217-K376 VanDerWaalsContact CB-NZ 3.3Å; S217-K376 VanDerWaalsContact O-CD 3.32Å; S217-K376 WeakPolarHBondContact O-CD 3.48Å; S217-K376 WeakPolarHBondContact O-CE 3.48Å; S217-K376 PolarHBondContact O-NZ 2.93Å; S217-K376 PolarHBondContact OG-NZ 2.82Å; Y372-K376 WeakPolarHBondContact O-CB 3.31Å; Y372-K376 PolarHBondContact O-N 3.38Å; A373-K376 PolarHBondContact O-N 2.87Å; A373-K376 VanDerWaalsContact O-N 3.17Å; K376-L378 VanDerWaalsContact C-N 3.27Å; K376-L378 PolarHBondContact O-N 2.79Å; K376-G379 PolarHBondContact O-N 3.41Å; K376-G379 VanDerWaalsContact O-N 3.12Å
377	D	90.4	Very high	90.9	Very high	56 Å²	56	32.3 Å²	32.3	30%	0.299	17%	0.171	S	C	.	.	H	α-helix	trans	-55.2	-42.1	178.2	-67.7	-32.9	0	0	0	112.1	S218 C219 A373	S218-D377 WeakPolarHBondContact CA-OD1 3.4Å; S218-D377 WeakPolarHBondContact CB-OD1 3.49Å; S218-D377 PolarHBondContact OG-OD1 2.98Å; S218-D377 PolarHBondContact OG-OD2 2.89Å; C219-D377 WeakPolarHBondContact CB-OD2 3.46Å; C219-D377 PolarHBondContact N-OD2 3.19Å; A373-D377 VanDerWaalsContact O-CG 3.28Å; A373-D377 PolarHBondContact O-N 2.78Å
378	L	91.1	Very high	90.5	Very high	14 Å²	14	34.8 Å²	34.8	7%	0.073	19%	0.19	C	C	.	.	H	α-helix	trans	-89.6	-3.5	-177.7	-64.6	178	0	0	0	113.8	L233 L236 K237 K240 L374 K376 F380	L233-L378 HydrophobicContact CD1-CD1 4.16Å; L233-L378 HydrophobicContact CD1-CD2 4.29Å; L233-L378 HydrophobicContact CD1-CG 4.44Å; L236-L378 HydrophobicContact CB-CD1 3.41Å; L236-L378 VanDerWaalsContact CB-CD1 3.41Å; L236-L378 HydrophobicContact CD1-CD1 4.25Å; L236-L378 HydrophobicContact CG-CD1 4.48Å; K237-L378 HydrophobicContact CG-CD1 4.49Å; K237-L378 HydrophobicContact CG-CD2 3.78Å; K240-L378 WeakPolarHBondContact CD-O 3.41Å; K240-L378 WeakPolarHBondContact CE-O 3.39Å; K240-L378 PolarHBondContact NZ-O 2.75Å; L374-L378 VanDerWaalsContact O-CB 3.29Å; L374-L378 WeakPolarHBondContact O-CB 3.45Å; L374-L378 WeakPolarHBondContact O-CG 3.31Å; L374-L378 PolarHBondContact O-N 3.03Å; L374-L378 VanDerWaalsContact O-N 3.07Å; K376-L378 VanDerWaalsContact C-N 3.27Å; K376-L378 PolarHBondContact O-N 2.79Å; L378-F380 HydrophobicContact CB-CD2 3.59Å; L378-F380 HydrophobicContact CB-CE2 3.8Å; L378-F380 HydrophobicContact CD1-CD2 4.47Å; L378-F380 HydrophobicContact CD1-CE2 4.14Å
379	G	89.5	Confident	90	Very high	56 Å²	56	35 Å²	35	58%	0.577	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.8	33.2	-178.8	0	0	0	0	0	114.4	A375 K376	A375-G379 CarbonylContact O-C 3.44Å; A375-G379 PolarHBondContact O-N 3.06Å; K376-G379 PolarHBondContact O-N 3.41Å; K376-G379 VanDerWaalsContact O-N 3.12Å
380	F	90	Very high	89.5	Confident	13 Å²	13	42.4 Å²	42.4	6%	0.057	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-90.5	139.1	169.4	-74.5	-97.9	0	0	0	111.1	L236 W239 K240 A375 L378 N473 I475 P505	L236-F380 HydrophobicContact CB-CE2 4.41Å; W239-F380 HydrophobicContact CB-CZ 4.25Å; K240-F380 HydrophobicContact CB-CE2 3.99Å; K240-F380 HydrophobicContact CB-CZ 3.87Å; A375-F380 HydrophobicContact CB-CB 4.19Å; A375-F380 PolarHBondContact O-N 3.36Å; L378-F380 HydrophobicContact CB-CD2 3.59Å; L378-F380 HydrophobicContact CB-CE2 3.8Å; L378-F380 HydrophobicContact CD1-CD2 4.47Å; L378-F380 HydrophobicContact CD1-CE2 4.14Å; F380-N473 WeakPolarHBondContact CA-O 3.44Å; F380-N473 HydrophobicContact CD1-CB 3.79Å; F380-N473 HydrophobicContact CE1-CB 3.94Å; F380-N473 HydrophobicContact CG-CB 4.3Å; F380-I475 HydrophobicContact CB-CD1 3.69Å; F380-I475 HydrophobicContact CB-CG1 3.99Å; F380-I475 HydrophobicContact CD1-CD1 4.18Å; F380-I475 HydrophobicContact CD1-CG1 3.76Å; F380-I475 HydrophobicContact CD2-CD1 4.31Å; F380-I475 HydrophobicContact CE1-CG1 4.4Å; F380-I475 HydrophobicContact CG-CD1 3.84Å; F380-I475 HydrophobicContact CG-CG1 3.95Å; F380-P505 HydrophobicContact CD1-CG 4.5Å; F380-P505 HydrophobicContact CE1-CG 4Å
381	K	89.3	Confident	89.4	Confident	109 Å²	109	42.4 Å²	42.4	47%	0.474	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	139.9	163.5	-174.2	168.9	-177.3	171.2	0	110.4	F383 N473 S474 I475	K381-F383 HydrophobicContact CD-CE1 4.43Å; K381-F383 HydrophobicContact CD-CZ 4.33Å; K381-N473 PolarHBondContact N-O 3.48Å; K381-S474 CarbonylContact O-C 3.55Å; K381-S474 WeakPolarHBondContact O-CA 3.46Å; K381-S474 WeakPolarHBondContact O-CB 3.37Å; K381-I475 PolarHBondContact O-N 3.34Å
382	I	90	Very high	89.2	Confident	32 Å²	32	43.1 Å²	43.1	16%	0.164	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	142.3	172.9	-70	165.8	0	0	0	110.5	I371 Y372 A375 E384 I475 L477	I371-I382 HydrophobicContact CG2-CD1 4.09Å; Y372-I382 HydrophobicContact CD1-CD1 3.38Å; Y372-I382 HydrophobicContact CE1-CB 4.44Å; Y372-I382 HydrophobicContact CE1-CD1 3.62Å; Y372-I382 HydrophobicContact CE1-CG2 4.24Å; Y372-I382 HydrophobicContact CG-CD1 4Å; A375-I382 HydrophobicContact CB-CD1 3.53Å; A375-I382 HydrophobicContact CB-CG1 3.71Å; I382-E384 HydrophobicContact CG2-CB 4.19Å; I382-I475 HydrophobicContact CG1-CB 4.4Å; I382-L477 HydrophobicContact CG2-CB 3.88Å; I382-L477 HydrophobicContact CG2-CD2 4.21Å
383	F	87	Confident	89	Confident	23 Å²	23	39.5 Å²	39.5	10%	0.101	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	107.9	162.6	-65.6	-60.1	0	0	0	108.7	K381 L414 S474 I475 V476 L477	K381-F383 HydrophobicContact CD-CE1 4.43Å; K381-F383 HydrophobicContact CD-CZ 4.33Å; F383-L414 HydrophobicContact CD1-CD2 4.28Å; F383-L414 HydrophobicContact CE1-CD1 3.78Å; F383-L414 HydrophobicContact CE1-CD2 3.58Å; F383-L414 HydrophobicContact CE1-CG 4.29Å; F383-L414 HydrophobicContact CZ-CD1 3.92Å; F383-L414 HydrophobicContact CZ-CD2 4.15Å; F383-S474 WeakPolarHBondContact CD2-OG 3.24Å; F383-S474 VanDerWaalsContact CE2-OG 3.27Å; F383-S474 WeakPolarHBondContact CE2-OG 3.32Å; F383-I475 PolarHBondContact N-O 3.44Å; F383-V476 WeakPolarHBondContact O-CA 3.41Å; F383-L477 PolarHBondContact O-N 3.25Å
384	E	90.3	Very high	88.9	Confident	58 Å²	58	48 Å²	48	27%	0.271	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	138	-168.9	-174.1	-157.4	150.2	0	0	112.6	Y372 I382 N386 F418 L477	Y372-E384 VanDerWaalsContact OH-CD 3.29Å; Y372-E384 PolarHBondContact OH-OE2 2.79Å; I382-E384 HydrophobicContact CG2-CB 4.19Å; E384-N386 WeakPolarHBondContact OE1-CB 3.31Å; E384-N386 PolarHBondContact OE1-ND2 2.78Å; E384-F418 WeakPolarHBondContact O-CE1 3.43Å; E384-L477 CarbonylContact C-O 3.54Å; E384-L477 WeakPolarHBondContact CA-O 3.27Å; E384-L477 HydrophobicContact CG-CD2 4.31Å; E384-L477 HydrophobicContact CG-CG 4.47Å
385	L	89.8	Confident	88.7	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	94.7	164.1	-78.6	-175	0	0	0	111	S389 R391 I396 F400 L477 F478 D479	L385-S389 WeakPolarHBondContact CD2-OG 3.31Å; L385-R391 HydrophobicContact CD1-CB 4.33Å; L385-I396 HydrophobicContact CD1-CG1 4.19Å; L385-F400 HydrophobicContact CD1-CE2 3.6Å; L385-F400 HydrophobicContact CD1-CZ 4.26Å; L385-F400 HydrophobicContact CG-CE2 4.16Å; L385-F400 HydrophobicContact CG-CZ 4.43Å; L385-L477 PolarHBondContact N-O 3.48Å; L385-F478 HydrophobicContact CB-CD1 4.03Å; L385-F478 HydrophobicContact CB-CE1 4.23Å; L385-F478 HydrophobicContact CD1-CD1 4.13Å; L385-F478 HydrophobicContact CD1-CE1 3.47Å; L385-F478 VanDerWaalsContact CD1-CE1 3.47Å; L385-F478 HydrophobicContact CD1-CZ 3.91Å; L385-F478 HydrophobicContact CG-CE1 4.44Å; L385-D479 PolarHBondContact O-N 3.42Å
386	N	88.8	Confident	88.4	Confident	26 Å²	26	49.2 Å²	49.2	14%	0.139	25%	0.25	C	S	.	.			trans	-87.3	172.2	171.7	66.7	50.8	0	0	0	112.6	E384 S388 S389 D479	E384-N386 WeakPolarHBondContact OE1-CB 3.31Å; E384-N386 PolarHBondContact OE1-ND2 2.78Å; N386-S388 PolarHBondContact O-N 3.38Å; N386-S388 VanDerWaalsContact O-N 3.16Å; N386-S388 WeakPolarHBondContact OD1-CB 3.36Å; N386-S388 PolarHBondContact OD1-N 2.83Å; N386-S388 PolarHBondContact OD1-OG 3.46Å; N386-S389 WeakPolarHBondContact O-CB 3.33Å; N386-S389 PolarHBondContact O-N 3.49Å; N386-S389 VanDerWaalsContact O-N 3.15Å; N386-S389 PolarHBondContact O-OG 3.1Å; N386-S389 PolarHBondContact OD1-N 3.33Å; N386-D479 HydrophobicContact CB-CB 4.22Å
387	P	85.4	Confident	88.1	Confident	13 Å²	13	46.7 Å²	46.7	8%	0.084	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-8.7	-177.3	-19.9	32.5	0	0	0	116.2	E480 V483 F485 R905	P387-E480 WeakPolarHBondContact CD-OE2 3.47Å; P387-E480 HydrophobicContact CG-CB 3.47Å; P387-E480 VanDerWaalsContact CG-CB 3.47Å; P387-E480 HydrophobicContact CG-CG 4.42Å; P387-E480 WeakPolarHBondContact CG-OE2 3.46Å; P387-V483 HydrophobicContact CG-CB 4.22Å; P387-F485 HydrophobicContact CB-CE2 4.33Å; P387-R905 VanDerWaalsContact O-CZ 3.23Å; P387-R905 PolarHBondContact O-NE 3.13Å; P387-R905 PolarHBondContact O-NH1 3.47Å
388	S	82.5	Confident	87.7	Confident	66 Å²	66	47.4 Å²	47.4	46%	0.462	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-20.6	173.2	79.1	0	0	0	0	113	N386	N386-S388 PolarHBondContact O-N 3.38Å; N386-S388 VanDerWaalsContact O-N 3.16Å; N386-S388 WeakPolarHBondContact OD1-CB 3.36Å; N386-S388 PolarHBondContact OD1-N 2.83Å; N386-S388 PolarHBondContact OD1-OG 3.46Å
389	S	82.3	Confident	86.8	Confident	31 Å²	31	49.7 Å²	49.7	22%	0.217	26%	0.262	C	S	.	.	S	Bend	trans	-77.3	161.4	179.3	75.4	0	0	0	0	112.5	L385 N386 R391	L385-S389 WeakPolarHBondContact CD2-OG 3.31Å; N386-S389 WeakPolarHBondContact O-CB 3.33Å; N386-S389 PolarHBondContact O-N 3.49Å; N386-S389 VanDerWaalsContact O-N 3.15Å; N386-S389 PolarHBondContact O-OG 3.1Å; N386-S389 PolarHBondContact OD1-N 3.33Å; S389-R391 PolarHBondContact O-N 2.66Å
390	R	83	Confident	85.8	Confident	176 Å²	176	47.3 Å²	47.3	66%	0.664	24%	0.235	S	C	*	.			trans	-81.9	105.3	173.2	-69.1	-174	62.3	155.2	0.8	109.6	D395 Q399	R390-D395 HydrophobicContact CB-CB 4.49Å; R390-D395 IonicContact NE-OD1 3.75Å; R390-D395 IonicContact NH2-OD1 3.78Å; R390-D395 VanDerWaalsContact O-CB 3.29Å; R390-D395 WeakPolarHBondContact O-CB 3.38Å; R390-Q399 PolarHBondContact O-NE2 3.41Å; R390-Q399 VanDerWaalsContact O-NE2 3.14Å
391	R	89.8	Confident	84.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.			trans	-126.1	33.2	-174.4	70	-174.1	-167.1	174.8	1.2	114.3	L385 S389 I396 D479 E480 V483 D488 F491	L385-R391 HydrophobicContact CD1-CB 4.33Å; S389-R391 PolarHBondContact O-N 2.66Å; R391-I396 HydrophobicContact CB-CD1 4.46Å; R391-I396 HydrophobicContact CB-CG1 4.38Å; R391-I396 WeakPolarHBondContact O-CD1 3.27Å; R391-D479 PolarHBondContact NH1-O 3.19Å; R391-E480 PolarHBondContact NH1-O 3.25Å; R391-E480 PolarHBondContact NH2-O 2.78Å; R391-V483 PolarHBondContact NH2-O 2.78Å; R391-D488 HydrophobicContact CG-CB 4.35Å; R391-D488 WeakPolarHBondContact CG-OD2 3.34Å; R391-D488 IonicContact CZ-OD2 3.11Å; R391-D488 IonicContact NE-OD2 2.65Å; R391-D488 PolarHBondContact NE-OD2 3.26Å; R391-F491 HydrophobicContact CB-CD2 4.41Å; R391-F491 HydrophobicContact CG-CD2 4.1Å; R391-F491 HydrophobicContact CG-CE2 4.26Å; R391-F491 WeakPolarHBondContact O-CD2 3.35Å
392	S	91	Very high	82.9	Confident	17 Å²	17	52.4 Å²	52.4	12%	0.119	27%	0.267	C	S	.	.	S	Bend	trans	-61.9	161.9	168	77.4	0	0	0	0	111.2	K394 D395 I396 S487	S392-K394 PolarHBondContact O-N 2.58Å; S392-K394 VanDerWaalsContact O-N 3.11Å; S392-D395 WeakPolarHBondContact CB-OD2 3.3Å; S392-D395 PolarHBondContact N-OD2 3.12Å; S392-D395 VanDerWaalsContact N-OD2 3.11Å; S392-D395 PolarHBondContact O-N 2.7Å; S392-D395 PolarHBondContact OG-N 2.88Å; S392-D395 PolarHBondContact OG-OD2 3.18Å; S392-I396 WeakPolarHBondContact O-CG1 3.38Å; S392-I396 PolarHBondContact O-N 3.02Å; S392-S487 WeakPolarHBondContact CB-O 3.37Å
393	G	90.2	Very high	81.1	Confident	5 Å²	5	51.6 Å²	51.6	5%	0.052	27%	0.265	C	S	.	.	H	α-helix	trans	-55.8	-33	179	0	0	0	0	0	113.2	I397 R489 G490	G393-I397 WeakPolarHBondContact O-CD1 3.42Å; G393-I397 VanDerWaalsContact O-CG1 3.26Å; G393-I397 WeakPolarHBondContact O-CG1 3.3Å; G393-I397 PolarHBondContact O-N 2.92Å; G393-R489 PolarHBondContact N-O 2.96Å; G393-G490 VanDerWaalsContact CA-O 3.22Å; G393-G490 WeakPolarHBondContact CA-O 3.34Å
394	K	89.5	Confident	79.6	Confident	179 Å²	179	51.5 Å²	51.5	78%	0.778	27%	0.266	S	S	*	.	H	α-helix	trans	-72.7	-42.8	174.7	-65.4	-177	179.6	-179.1	0	112.2	S392 I397 S398	S392-K394 PolarHBondContact O-N 2.58Å; S392-K394 VanDerWaalsContact O-N 3.11Å; K394-I397 PolarHBondContact O-N 2.84Å; K394-S398 WeakPolarHBondContact O-CB 3.28Å; K394-S398 PolarHBondContact O-N 3.16Å; K394-S398 PolarHBondContact O-OG 3.27Å; K394-S398 VanDerWaalsContact O-OG 3.09Å
395	D	88.7	Confident	77.5	Confident	28 Å²	28	51.1 Å²	51.1	15%	0.15	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-49	177.5	-58.6	-55.8	0	0	0	110.2	R390 S392 I397 S398 Q399	R390-D395 HydrophobicContact CB-CB 4.49Å; R390-D395 IonicContact NE-OD1 3.75Å; R390-D395 IonicContact NH2-OD1 3.78Å; R390-D395 VanDerWaalsContact O-CB 3.29Å; R390-D395 WeakPolarHBondContact O-CB 3.38Å; S392-D395 WeakPolarHBondContact CB-OD2 3.3Å; S392-D395 PolarHBondContact N-OD2 3.12Å; S392-D395 VanDerWaalsContact N-OD2 3.11Å; S392-D395 PolarHBondContact O-N 2.7Å; S392-D395 PolarHBondContact OG-N 2.88Å; S392-D395 PolarHBondContact OG-OD2 3.18Å; D395-I397 PolarHBondContact O-N 2.87Å; D395-S398 PolarHBondContact O-N 2.54Å; D395-S398 PolarHBondContact O-OG 3.04Å; D395-Q399 VanDerWaalsContact O-CG 3.31Å; D395-Q399 WeakPolarHBondContact O-CG 3.36Å; D395-Q399 PolarHBondContact O-N 3.12Å
396	I	87.9	Confident	75.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.1	-51.8	177.3	-66.3	168.4	0	0	0	111.3	L385 R391 S392 S398 Q399 F400 F478 F491 L498	L385-I396 HydrophobicContact CD1-CG1 4.19Å; R391-I396 HydrophobicContact CB-CD1 4.46Å; R391-I396 HydrophobicContact CB-CG1 4.38Å; R391-I396 WeakPolarHBondContact O-CD1 3.27Å; S392-I396 WeakPolarHBondContact O-CG1 3.38Å; S392-I396 PolarHBondContact O-N 3.02Å; I396-S398 PolarHBondContact O-N 2.58Å; I396-Q399 PolarHBondContact O-N 3.03Å; I396-F400 HydrophobicContact CG2-CD2 4.37Å; I396-F400 WeakPolarHBondContact O-CB 3.37Å; I396-F400 WeakPolarHBondContact O-CD2 3.49Å; I396-F400 PolarHBondContact O-N 3.01Å; I396-F478 HydrophobicContact CD1-CE1 3.9Å; I396-F478 HydrophobicContact CG1-CE1 4.13Å; I396-F478 HydrophobicContact CG2-CZ 4.19Å; I396-F491 HydrophobicContact CD1-CD2 3.57Å; I396-F491 HydrophobicContact CD1-CE2 3.84Å; I396-F491 HydrophobicContact CD1-CG 4.36Å; I396-L498 HydrophobicContact CG2-CB 4.46Å; I396-L498 HydrophobicContact CG2-CD2 4.28Å
397	I	84.2	Confident	73.3	Confident	78 Å²	78	58.2 Å²	58.2	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-60.8	-46	-179.7	-69.5	168.2	0	0	0	110.3	G393 K394 D395 H401	G393-I397 WeakPolarHBondContact O-CD1 3.42Å; G393-I397 VanDerWaalsContact O-CG1 3.26Å; G393-I397 WeakPolarHBondContact O-CG1 3.3Å; G393-I397 PolarHBondContact O-N 2.92Å; K394-I397 PolarHBondContact O-N 2.84Å; D395-I397 PolarHBondContact O-N 2.87Å; I397-H401 WeakPolarHBondContact O-CB 3.38Å; I397-H401 PolarHBondContact O-N 3.23Å
398	S	80.7	Confident	71.1	Confident	70 Å²	70	63.5 Å²	63.5	49%	0.49	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-43.2	-178.8	64.1	0	0	0	0	114	K394 D395 I396 T402	K394-S398 WeakPolarHBondContact O-CB 3.28Å; K394-S398 PolarHBondContact O-N 3.16Å; K394-S398 PolarHBondContact O-OG 3.27Å; K394-S398 VanDerWaalsContact O-OG 3.09Å; D395-S398 PolarHBondContact O-N 2.54Å; D395-S398 PolarHBondContact O-OG 3.04Å; I396-S398 PolarHBondContact O-N 2.58Å; S398-T402 PolarHBondContact O-OG1 2.85Å
399	Q	73.2	Confident	69.2	Low	62 Å²	62	61.9 Å²	61.9	29%	0.29	33%	0.327	S	S	.	.	H	α-helix	trans	-67.5	-48.5	179.2	-68.1	169.8	32.7	0	0	111.1	R390 D395 I396 T402 A403	R390-Q399 PolarHBondContact O-NE2 3.41Å; R390-Q399 VanDerWaalsContact O-NE2 3.14Å; D395-Q399 VanDerWaalsContact O-CG 3.31Å; D395-Q399 WeakPolarHBondContact O-CG 3.36Å; D395-Q399 PolarHBondContact O-N 3.12Å; I396-Q399 PolarHBondContact O-N 3.03Å; Q399-T402 PolarHBondContact O-N 2.99Å; Q399-A403 PolarHBondContact O-N 3.2Å
400	F	67.9	Low	67.2	Low	6 Å²	6	63 Å²	63	3%	0.026	34%	0.339	C	S	.	.	H	α-helix	trans	-87.1	-21.9	-170.5	-74.2	-88.5	0	0	0	114.7	L385 I396 T402 A403 L404 V476 F478 L498	L385-F400 HydrophobicContact CD1-CE2 3.6Å; L385-F400 HydrophobicContact CD1-CZ 4.26Å; L385-F400 HydrophobicContact CG-CE2 4.16Å; L385-F400 HydrophobicContact CG-CZ 4.43Å; I396-F400 HydrophobicContact CG2-CD2 4.37Å; I396-F400 WeakPolarHBondContact O-CB 3.37Å; I396-F400 WeakPolarHBondContact O-CD2 3.49Å; I396-F400 PolarHBondContact O-N 3.01Å; F400-T402 PolarHBondContact O-N 3.07Å; F400-A403 HydrophobicContact CD1-CB 4.42Å; F400-A403 PolarHBondContact O-N 3.38Å; F400-L404 HydrophobicContact CB-CD1 4.16Å; F400-L404 HydrophobicContact CB-CG 4.32Å; F400-L404 HydrophobicContact CD1-CG 4.35Å; F400-L404 VanDerWaalsContact O-CB 3.25Å; F400-L404 WeakPolarHBondContact O-CB 3.25Å; F400-L404 WeakPolarHBondContact O-CG 3.39Å; F400-L404 PolarHBondContact O-N 2.97Å; F400-V476 HydrophobicContact CD1-CG1 4.25Å; F400-V476 HydrophobicContact CD1-CG2 4.21Å; F400-V476 HydrophobicContact CE1-CB 4.19Å; F400-V476 HydrophobicContact CE1-CG1 3.38Å; F400-V476 HydrophobicContact CE1-CG2 3.71Å; F400-V476 HydrophobicContact CZ-CG1 3.66Å; F400-F478 HydrophobicContact CE2-CZ 4.49Å; F400-L498 HydrophobicContact CB-CD1 3.21Å; F400-L498 HydrophobicContact CD1-CD1 4.07Å; F400-L498 HydrophobicContact CD2-CD1 4.38Å; F400-L498 HydrophobicContact CG-CD1 3.62Å
401	H	63.5	Low	65.2	Low	139 Å²	139	61.9 Å²	61.9	64%	0.644	34%	0.339	S	S	*	.	H	α-helix	trans	-61.8	-28.5	168.8	-166.6	-47.7	0	0	0	111.1	I397	I397-H401 WeakPolarHBondContact O-CB 3.38Å; I397-H401 PolarHBondContact O-N 3.23Å
402	T	55.8	Low	62.8	Low	90 Å²	90	67.3 Å²	67.3	55%	0.552	37%	0.367	S	S	*	.	H	α-helix	trans	-78.3	-46.9	170.1	-50.6	0	0	0	0	111.8	S398 Q399 F400 L404	S398-T402 PolarHBondContact O-OG1 2.85Å; Q399-T402 PolarHBondContact O-N 2.99Å; F400-T402 PolarHBondContact O-N 3.07Å; T402-L404 PolarHBondContact O-N 3.14Å
403	A	51.8	Low	60.3	Low	16 Å²	16	74.2 Å²	74.2	13%	0.132	39%	0.392	C	S	.	.	H	α-helix	trans	-75.4	-20.1	-175	0	0	0	0	0	115.8	Q399 F400	Q399-A403 PolarHBondContact O-N 3.2Å; F400-A403 HydrophobicContact CD1-CB 4.42Å; F400-A403 PolarHBondContact O-N 3.38Å
404	L	56	Low	57.8	Low	20 Å²	20	75.6 Å²	75.6	11%	0.105	40%	0.398	C	S	.	.	H	α-helix	trans	-102.1	-19.1	-180	-63.3	178.2	0	0	0	114.1	F400 T402 S406 L498 A502 R504	F400-L404 HydrophobicContact CB-CD1 4.16Å; F400-L404 HydrophobicContact CB-CG 4.32Å; F400-L404 HydrophobicContact CD1-CG 4.35Å; F400-L404 VanDerWaalsContact O-CB 3.25Å; F400-L404 WeakPolarHBondContact O-CB 3.25Å; F400-L404 WeakPolarHBondContact O-CG 3.39Å; F400-L404 PolarHBondContact O-N 2.97Å; T402-L404 PolarHBondContact O-N 3.14Å; L404-S406 VanDerWaalsContact C-N 3.33Å; L404-L498 HydrophobicContact CD1-CD1 3.42Å; L404-L498 VanDerWaalsContact CD1-CD1 3.42Å; L404-L498 HydrophobicContact CD1-CG 4.29Å; L404-A502 HydrophobicContact CD1-CB 4.41Å; L404-R504 HydrophobicContact CD2-CB 4.32Å; L404-R504 HydrophobicContact CD2-CG 4.15Å
405	G	45.4	Very low	55.4	Low	51 Å²	51	69.9 Å²	69.9	53%	0.526	38%	0.381	S	S	.	.	H	α-helix	trans	-70.8	-27.7	179.8	0	0	0	0	0	113.7
406	S	47.5	Very low	53	Low	63 Å²	63	73.8 Å²	73.8	44%	0.441	41%	0.406	S	S	.	.			trans	-118.7	137.5	-173.9	-57.4	0	0	0	0	112.4	L404 H408	L404-S406 VanDerWaalsContact C-N 3.33Å; S406-H408 VanDerWaalsContact CB-O 3.23Å; S406-H408 WeakPolarHBondContact CB-O 3.4Å
407	H	44	Very low	50.4	Low	112 Å²	112	77.3 Å²	77.3	52%	0.519	43%	0.43	S	S	.	.	S	Bend	trans	-66.5	-45.1	165	-76.6	-107.5	0	0	0	109.9
408	H	38.3	Very low	48	Very low	125 Å²	125	77.7 Å²	77.7	58%	0.579	43%	0.429	S	S	*	.	S	Bend	trans	-85.7	112	175	-70.3	-160.4	0	0	0	110.9	S406 L470	S406-H408 VanDerWaalsContact CB-O 3.23Å; S406-H408 WeakPolarHBondContact CB-O 3.4Å; H408-L470 HydrophobicContact CB-CB 4.27Å; H408-L470 HydrophobicContact CB-CD1 3.93Å; H408-L470 VanDerWaalsContact CD2-CB 3.42Å; H408-L470 WeakPolarHBondContact CD2-CB 3Å; H408-L470 WeakPolarHBondContact ND1-CD1 3.5Å
409	V	43	Very low	45.6	Very low	31 Å²	31	78 Å²	78	19%	0.188	43%	0.431	C	S	.	.			trans	-102.3	116.8	167.7	-177.9	0	0	0	0	108.7	L414 L470	V409-L414 HydrophobicContact CB-CD1 4.36Å; V409-L414 HydrophobicContact CG1-CD1 3.69Å; V409-L414 HydrophobicContact CG1-CD2 4.11Å; V409-L414 HydrophobicContact CG1-CG 3.73Å; V409-L470 WeakPolarHBondContact O-CD2 3.41Å
410	A	39.4	Very low	43.5	Very low	56 Å²	56	80.3 Å²	80.3	46%	0.463	45%	0.45	S	S	.	.			trans	-63.5	143.8	177.4	0	0	0	0	0	111.5	D412	A410-D412 PolarHBondContact O-N 3.46Å
411	K	41.2	Very low	41.4	Very low	152 Å²	152	88.8 Å²	88.8	66%	0.661	49%	0.487	S	S	*	.	H	α-helix	trans	-56	-29.8	-169.7	-159.4	169	-176.6	173.1	0	113.6
412	D	39.5	Very low	39.6	Very low	113 Å²	113	89.8 Å²	89.8	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-84.1	-25	-162.5	-42.1	-52.1	0	0	0	114.6	A410 S415 T416	A410-D412 PolarHBondContact O-N 3.46Å; D412-S415 PolarHBondContact O-OG 2.82Å; D412-T416 PolarHBondContact O-OG1 2.92Å
413	Y	38.1	Very low	38.1	Very low	163 Å²	163	94 Å²	94	64%	0.639	51%	0.508	S	S	*	.	H	α-helix	trans	-80.8	-23.8	178.1	-78	-86.5	0	0	0	113	S417	Y413-S417 WeakPolarHBondContact O-CB 3.39Å; Y413-S417 PolarHBondContact O-OG 3.35Å
414	L	38.1	Very low	36.8	Very low	34 Å²	34	100.9 Å²	100.9	18%	0.178	54%	0.541	C	S	.	.	H	α-helix	trans	-83.5	-34.3	-177.8	-68.3	176.9	0	0	0	112.9	F383 V409	F383-L414 HydrophobicContact CD1-CD2 4.28Å; F383-L414 HydrophobicContact CE1-CD1 3.78Å; F383-L414 HydrophobicContact CE1-CD2 3.58Å; F383-L414 HydrophobicContact CE1-CG 4.29Å; F383-L414 HydrophobicContact CZ-CD1 3.92Å; F383-L414 HydrophobicContact CZ-CD2 4.15Å; V409-L414 HydrophobicContact CB-CD1 4.36Å; V409-L414 HydrophobicContact CG1-CD1 3.69Å; V409-L414 HydrophobicContact CG1-CD2 4.11Å; V409-L414 HydrophobicContact CG1-CG 3.73Å
415	S	40.2	Very low	35.4	Very low	59 Å²	59	104.9 Å²	104.9	41%	0.413	57%	0.566	S	S	.	*	H	α-helix	trans	-66.2	-55.5	176.5	51.1	0	0	0	0	111	D412 S417 F418 S419	D412-S415 PolarHBondContact O-OG 2.82Å; S415-S417 VanDerWaalsContact C-N 3.26Å; S415-S417 PolarHBondContact O-N 3.48Å; S415-F418 PolarHBondContact O-N 2.87Å; S415-S419 VanDerWaalsContact O-CB 3.28Å; S415-S419 WeakPolarHBondContact O-CB 3.37Å; S415-S419 PolarHBondContact O-N 3.3Å; S415-S419 PolarHBondContact O-OG 3.06Å; S415-S419 VanDerWaalsContact O-OG 3.06Å
416	T	36.4	Very low	34.4	Very low	109 Å²	109	107.2 Å²	107.2	67%	0.669	57%	0.574	S	S	*	*	H	α-helix	trans	-62.5	-27.5	-176.9	46.5	0	0	0	0	114.4	D412	D412-T416 PolarHBondContact O-OG1 2.92Å
417	S	33.3	Very low	33.3	Very low	74 Å²	74	109.7 Å²	109.7	52%	0.517	59%	0.592	S	S	.	*	H	α-helix	trans	-82.1	-22.3	179	-55.8	0	0	0	0	114.2	Y413 S415	Y413-S417 WeakPolarHBondContact O-CB 3.39Å; Y413-S417 PolarHBondContact O-OG 3.35Å; S415-S417 VanDerWaalsContact C-N 3.26Å; S415-S417 PolarHBondContact O-N 3.48Å
418	F	34.6	Very low	32.5	Very low	87 Å²	87	109.7 Å²	109.7	38%	0.382	60%	0.604	S	S	.	*	H	α-helix	trans	-126.3	-13.6	-170	-71.3	-81	0	0	0	115.5	E384 S415 T420	E384-F418 WeakPolarHBondContact O-CE1 3.43Å; S415-F418 PolarHBondContact O-N 2.87Å; F418-T420 PolarHBondContact O-N 2.93Å
419	S	29.5	Very low	31.9	Very low	76 Å²	76	111.3 Å²	111.3	53%	0.531	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74	52.1	179.2	-66.4	0	0	0	0	114.3	S415	S415-S419 VanDerWaalsContact O-CB 3.28Å; S415-S419 WeakPolarHBondContact O-CB 3.37Å; S415-S419 PolarHBondContact O-N 3.3Å; S415-S419 PolarHBondContact O-OG 3.06Å; S415-S419 VanDerWaalsContact O-OG 3.06Å
420	T	29.4	Very low	31.1	Very low	111 Å²	111	116 Å²	116	68%	0.681	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-16.8	171.2	-55.4	0	0	0	0	112.6	F418	F418-T420 PolarHBondContact O-N 2.93Å
421	F	25.3	Very low	30.6	Very low	184 Å²	184	122.1 Å²	122.1	81%	0.807	66%	0.661	S	S	*	*	S	Bend	trans	-130.6	-0.5	-173.5	-91.1	-80.8	0	0	0	117.1	M423	F421-M423 PolarHBondContact O-N 3.2Å
422	Q	24.8	Very low	29.8	Very low	160 Å²	160	121.8 Å²	121.8	75%	0.748	67%	0.667	S	S	*	*			trans	-93.8	89.9	170.2	-82.7	-171.4	-30.7	0	0	111
423	M	24.3	Very low	29.2	Very low	178 Å²	178	123.5 Å²	123.5	88%	0.877	68%	0.676	S	S	*	*			trans	-140.4	11.2	172.3	-131.6	177.5	-159.7	0	0	114.8	F421	F421-M423 PolarHBondContact O-N 3.2Å
424	I	25.3	Very low	28.6	Very low	161 Å²	161	121.8 Å²	121.8	83%	0.826	69%	0.688	S	S	*	*			trans	-132.8	64	176	-45	179.3	0	0	0	110.3
425	T	25.1	Very low	28.1	Very low	104 Å²	104	128.5 Å²	128.5	64%	0.638	72%	0.718	S	S	*	*			trans	-141.1	59.8	165.7	43	0	0	0	0	109.9	S427	T425-S427 PolarHBondContact O-N 3.21Å
426	S	24.9	Very low	27.4	Very low	100 Å²	100	131.4 Å²	131.4	70%	0.699	73%	0.733	S	S	*	*			trans	-76.7	50	-174	-56.4	0	0	0	0	114
427	S	25.5	Very low	27	Very low	115 Å²	115	132.1 Å²	132.1	80%	0.804	73%	0.732	S	S	*	*			trans	-105.1	39.2	-178	53.1	0	0	0	0	113.6	T425	T425-S427 PolarHBondContact O-N 3.21Å
428	S	25.6	Very low	26.7	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	75%	0.753	S	S	*	*			trans	-139.7	33.6	-179.5	55.8	0	0	0	0	114.1
429	L	25.9	Very low	26.5	Very low	160 Å²	160	145 Å²	145	84%	0.838	77%	0.771	S	S	*	*			trans	-98.7	89.3	177.6	-80.8	167.7	0	0	0	112.9
430	T	26.3	Very low	26.6	Very low	128 Å²	128	145.7 Å²	145.7	79%	0.785	78%	0.776	S	S	*	*			trans	-140.1	142.1	149.3	57.9	0	0	0	0	111.1
431	K	29.8	Very low	26.7	Very low	185 Å²	185	144.7 Å²	144.7	80%	0.804	78%	0.779	S	S	*	*			trans	73.4	66.7	166.5	-60.7	-179.7	-179.3	177.7	0	118.3
432	N	24.6	Very low	27.1	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	77%	0.772	S	S	*	*				59.5	143.4	112.6	-56.4	17.2	0	0	0	122.1
433	N	26.6	Very low	27.4	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	77%	0.765	S	S	*	*			trans	68.8	88.4	154.3	-63.3	10.2	0	0	0	119.3
434	S	25.8	Very low	27.9	Very low	127 Å²	127	137.4 Å²	137.4	89%	0.888	76%	0.76	S	S	*	*				-174.7	172.3	107.1	35.1	0	0	0	0	111.2
435	E	26.5	Very low	28.1	Very low	175 Å²	175	138.7 Å²	138.7	82%	0.818	76%	0.76	S	S	*	*			trans	-74.5	156.5	-169.6	-56.6	163.9	119.6	0	0	114
436	T	25.8	Very low	28.4	Very low	120 Å²	120	141.8 Å²	141.8	74%	0.736	77%	0.765	S	S	*	*				138.2	137.8	128.5	60.3	0	0	0	0	117.4
437	I	28.8	Very low	28.4	Very low	124 Å²	124	142.8 Å²	142.8	64%	0.636	77%	0.769	S	S	*	*			trans	58.5	99.4	156.2	-51	146.7	0	0	0	117.9	K439	I437-K439 HydrophobicContact CG2-CD 4.48Å; I437-K439 HydrophobicContact CG2-CG 3.55Å; I437-K439 PolarHBondContact O-N 3.07Å; I437-K439 VanDerWaalsContact O-N 3.14Å
438	R	26.4	Very low	28.8	Very low	256 Å²	256	143.8 Å²	143.8	97%	0.966	77%	0.77	S	S	*	*			trans	-63.1	103.9	154.1	-63.3	176.4	-179.4	170.6	-1	109.6	S440	R438-S440 PolarHBondContact O-N 2.73Å
439	K	31.5	Very low	29	Very low	175 Å²	175	143.7 Å²	143.7	76%	0.761	77%	0.766	S	S	*	*			trans	-84.2	108.7	-179.8	-70.4	-173.4	-179.6	171.7	0	111.7	I437	I437-K439 HydrophobicContact CG2-CD 4.48Å; I437-K439 HydrophobicContact CG2-CG 3.55Å; I437-K439 PolarHBondContact O-N 3.07Å; I437-K439 VanDerWaalsContact O-N 3.14Å
440	S	30.2	Very low	29	Very low	90 Å²	90	146 Å²	146	63%	0.629	77%	0.77	S	S	*	*			trans	-58.4	147.6	175.3	176	0	0	0	0	113.1	R438 A442	R438-S440 PolarHBondContact O-N 2.73Å; S440-A442 PolarHBondContact O-N 2.98Å
441	A	31.9	Very low	29.2	Very low	90 Å²	90	149.4 Å²	149.4	74%	0.744	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-65.4	-5.9	-176.6	0	0	0	0	0	115.2	N443 F444	A441-N443 PolarHBondContact O-N 3.04Å; A441-F444 PolarHBondContact O-N 3.11Å
442	A	33.7	Very low	28.9	Very low	80 Å²	80	147.8 Å²	147.8	66%	0.661	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-61.3	-13.8	-176.3	0	0	0	0	0	115.6	S440 F444	S440-A442 PolarHBondContact O-N 2.98Å; A442-F444 VanDerWaalsContact C-N 3.32Å; A442-F444 PolarHBondContact O-N 2.94Å
443	N	30.1	Very low	29.1	Very low	114 Å²	114	147.1 Å²	147.1	61%	0.61	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-80.9	-2.3	-178.3	-75.6	-53.4	0	0	0	115	A441 F445	A441-N443 PolarHBondContact O-N 3.04Å; N443-F445 PolarHBondContact O-N 2.86Å
444	F	34.9	Very low	29	Very low	176 Å²	176	144.6 Å²	144.6	77%	0.772	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-70.3	-9.8	-174.9	-147.6	-94.1	0	0	0	115.1	A441 A442	A441-F444 PolarHBondContact O-N 3.11Å; A442-F444 VanDerWaalsContact C-N 3.32Å; A442-F444 PolarHBondContact O-N 2.94Å
445	F	30.6	Very low	29	Very low	188 Å²	188	143.4 Å²	143.4	83%	0.825	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-111.4	10.1	-170.4	-74.4	-73.9	0	0	0	116.1	N443	N443-F445 PolarHBondContact O-N 2.86Å
446	K	30.3	Very low	29.1	Very low	169 Å²	169	145.1 Å²	145.1	74%	0.735	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-92.9	117.4	176.7	-71.6	-173.9	178.1	177.6	0	111.6
447	P	26.6	Very low	29	Very low	120 Å²	120	148.6 Å²	148.6	78%	0.779	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-68.8	133.5	174.3	28.8	-33.7	0	0	0	110.5
448	V	33.5	Very low	28.8	Very low	136 Å²	136	149.4 Å²	149.4	82%	0.824	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-74.8	125.6	-179.6	-178.3	0	0	0	0	110
449	P	29.3	Very low	28.8	Very low	109 Å²	109	142.9 Å²	142.9	71%	0.708	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-72.2	132.7	178.6	29	-34.2	0	0	0	111.2	K451	P449-K451 PolarHBondContact O-N 3.44Å
450	K	26.6	Very low	28.4	Very low	209 Å²	209	139.7 Å²	139.7	91%	0.909	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-67.8	117.8	174.1	-66.2	179.9	179.2	178.9	0	110.2
451	K	30	Very low	28.3	Very low	200 Å²	200	141 Å²	141	87%	0.87	77%	0.774	S	S	*	*			trans	-105.4	125.9	162.8	-86.2	-169.3	172.8	-175.7	0	110.4	P449	P449-K451 PolarHBondContact O-N 3.44Å
452	N	22.5	Very low	27.9	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	78%	0.776	S	S	*	*			trans	-86	-172.6	163.2	-70.9	-14.9	0	0	0	110
453	V	29.9	Very low	27.6	Very low	132 Å²	132	148.2 Å²	148.2	80%	0.8	78%	0.784	S	S	*	*			trans	91.6	83.5	166.5	-168.1	0	0	0	0	116.7
454	S	24.5	Very low	27.3	Very low	95 Å²	95	150.4 Å²	150.4	66%	0.664	80%	0.796	S	S	*	*			trans	36.6	123.5	133.4	65	0	0	0	0	123.3
455	S	25.9	Very low	26.9	Very low	103 Å²	103	146.9 Å²	146.9	72%	0.72	79%	0.793	S	S	*	*			trans	61.9	113.3	131.2	68.2	0	0	0	0	121.9
456	K	29.1	Very low	26.8	Very low	211 Å²	211	145.9 Å²	145.9	92%	0.917	79%	0.791	S	S	*	*				-166.2	161.6	102.7	-103.3	169.9	-178.3	175.7	0	111.3
457	K	23.3	Very low	26.5	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.835	79%	0.794	S	S	*	*			trans	-94	150.2	173.5	-61.8	178.3	176.7	-179.3	0	110.3
458	N	23.9	Very low	26.6	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	78%	0.783	S	S	*	*				177.7	163.1	108.8	-96.1	-1.6	0	0	0	115.3
459	T	26.3	Very low	26.5	Very low	119 Å²	119	141.8 Å²	141.8	73%	0.73	77%	0.774	S	S	*	*			trans	58.7	84.2	153.5	47.2	0	0	0	0	120.5
460	S	23.6	Very low	26.8	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	76%	0.757	S	S	*	*				43	113.7	114.7	61.6	0	0	0	0	120.9
461	S	27	Very low	27.8	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	73%	0.73	S	S	*	*			trans	-138.2	123.4	136.3	62.2	0	0	0	0	108.8
462	T	24.2	Very low	28.9	Very low	130 Å²	130	126.5 Å²	126.5	80%	0.798	71%	0.71	S	S	*	*			trans	-82	120.8	-176	42.5	0	0	0	0	111.9
463	K	26.4	Very low	31.6	Very low	192 Å²	192	120.9 Å²	120.9	84%	0.835	68%	0.68	S	S	*	*			trans	-128	131	150.4	-74.5	-171.3	175.9	-175.5	0	106.7	S465	K463-S465 PolarHBondContact O-N 3.47Å
464	D	25.2	Very low	34.2	Very low	160 Å²	160	114.7 Å²	114.7	86%	0.856	64%	0.642	S	S	*	*			trans	-76.6	75.4	-177.1	-58	-63.2	0	0	0	110.9	E466	D464-E466 PolarHBondContact O-N 2.85Å
465	S	25.9	Very low	37.3	Very low	102 Å²	102	110.1 Å²	110.1	71%	0.713	61%	0.611	S	S	*	*			trans	-69.4	119.5	161.8	59.5	0	0	0	0	108.3	K463 S467	K463-S465 PolarHBondContact O-N 3.47Å; S465-S467 PolarHBondContact O-N 2.81Å; S465-S467 VanDerWaalsContact O-N 3.08Å
466	E	29.1	Very low	40.4	Very low	167 Å²	167	105.3 Å²	105.3	78%	0.78	58%	0.577	S	S	*	*			trans	-45	117.7	178.5	-64	177.3	121.4	0	0	111.4	D464 L468	D464-E466 PolarHBondContact O-N 2.85Å; E466-L468 PolarHBondContact O-N 2.96Å
467	S	24.5	Very low	43.5	Very low	113 Å²	113	95.2 Å²	95.2	79%	0.79	53%	0.533	S	S	*	.			trans	-74.6	76.5	176.2	56.8	0	0	0	0	109.3	S465 N469	S465-S467 PolarHBondContact O-N 2.81Å; S465-S467 VanDerWaalsContact O-N 3.08Å; S467-N469 PolarHBondContact O-N 2.79Å
468	L	28.7	Very low	46.8	Very low	107 Å²	107	86.1 Å²	86.1	56%	0.56	49%	0.493	S	S	*	.			trans	-51.2	111.2	176.9	-67.4	176.2	0	0	0	109.3	E466 L470	E466-L468 PolarHBondContact O-N 2.96Å; L468-L470 PolarHBondContact O-N 3.11Å
469	N	30.2	Very low	50.2	Low	118 Å²	118	79.7 Å²	79.7	63%	0.631	46%	0.459	S	S	*	.			trans	-65.4	123.2	-161.9	-147	14.4	0	0	0	110.5	S467 N471 C472	S467-N469 PolarHBondContact O-N 2.79Å; N469-N471 PolarHBondContact ND2-OD1 2.69Å; N469-N471 PolarHBondContact O-N 2.88Å; N469-N471 VanDerWaalsContact O-N 3.13Å; N469-N471 PolarHBondContact OD1-OD1 2.9Å; N469-N471 VanDerWaalsContact OD1-OD1 3.05Å; N469-C472 PolarHBondContact O-SG 3.39Å
470	L	35.4	Very low	53.3	Low	68 Å²	68	75.7 Å²	75.7	36%	0.356	43%	0.432	S	S	.	.	S	Bend	trans	-77.4	-1.5	-166.6	-71.3	165.7	0	0	0	113.6	H408 V409 L468 C472	H408-L470 HydrophobicContact CB-CB 4.27Å; H408-L470 HydrophobicContact CB-CD1 3.93Å; H408-L470 VanDerWaalsContact CD2-CB 3.42Å; H408-L470 WeakPolarHBondContact CD2-CB 3Å; H408-L470 WeakPolarHBondContact ND1-CD1 3.5Å; V409-L470 WeakPolarHBondContact O-CD2 3.41Å; L468-L470 PolarHBondContact O-N 3.11Å; L470-C472 PolarHBondContact O-N 2.85Å
471	N	47.9	Very low	56.6	Low	64 Å²	64	70.5 Å²	70.5	34%	0.342	40%	0.396	S	S	.	.			trans	-60.5	19.3	165.4	-45.7	55.8	0	0	0	113.7	E247 N469 N473	E247-N471 VanDerWaalsContact CD-ND2 3.27Å; E247-N471 WeakPolarHBondContact OE1-CB 3.35Å; E247-N471 PolarHBondContact OE1-ND2 2.84Å; E247-N471 PolarHBondContact OE2-ND2 3.33Å; N469-N471 PolarHBondContact ND2-OD1 2.69Å; N469-N471 PolarHBondContact O-N 2.88Å; N469-N471 VanDerWaalsContact O-N 3.13Å; N469-N471 PolarHBondContact OD1-OD1 2.9Å; N469-N471 VanDerWaalsContact OD1-OD1 3.05Å; N471-N473 PolarHBondContact O-N 2.86Å
472	C	53.8	Low	59.7	Low	65 Å²	65	66.9 Å²	66.9	44%	0.439	37%	0.367	S	S	.	.			trans	-64.3	95.6	-171.7	-79	0	0	0	0	111.1	N469 L470 S474 R504	N469-C472 PolarHBondContact O-SG 3.39Å; L470-C472 PolarHBondContact O-N 2.85Å; C472-S474 PolarHBondContact O-N 3.4Å; C472-R504 PolarHBondContact O-NH1 2.62Å
473	N	78	Confident	62.9	Low	34 Å²	34	62.2 Å²	62.2	18%	0.182	34%	0.339	C	S	.	.			trans	-48.5	124.6	159.6	-79.4	-54.2	0	0	0	108.5	N243 F380 K381 N471	N243-N473 WeakPolarHBondContact CB-OD1 3.5Å; N243-N473 PolarHBondContact ND2-OD1 3.3Å; F380-N473 WeakPolarHBondContact CA-O 3.44Å; F380-N473 HydrophobicContact CD1-CB 3.79Å; F380-N473 HydrophobicContact CE1-CB 3.94Å; F380-N473 HydrophobicContact CG-CB 4.3Å; K381-N473 PolarHBondContact N-O 3.48Å; N471-N473 PolarHBondContact O-N 2.86Å
474	S	85	Confident	65.9	Low	1 Å²	1	56 Å²	56	1%	0.007	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	148.6	-179	84.7	0	0	0	0	112.6	K381 F383 C472 R504 P505	K381-S474 CarbonylContact O-C 3.55Å; K381-S474 WeakPolarHBondContact O-CA 3.46Å; K381-S474 WeakPolarHBondContact O-CB 3.37Å; F383-S474 WeakPolarHBondContact CD2-OG 3.24Å; F383-S474 VanDerWaalsContact CE2-OG 3.27Å; F383-S474 WeakPolarHBondContact CE2-OG 3.32Å; C472-S474 PolarHBondContact O-N 3.4Å; S474-R504 WeakPolarHBondContact OG-CD 3.25Å; S474-R504 PolarHBondContact OG-NH1 2.89Å; S474-P505 WeakPolarHBondContact O-CD 3.12Å
475	I	89.9	Confident	68.7	Low	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	140.9	174.7	-68.8	159.1	0	0	0	107.8	L236 A375 F380 K381 I382 F383 P505 I507	L236-I475 HydrophobicContact CD1-CD1 4.09Å; L236-I475 HydrophobicContact CD2-CD1 3.84Å; L236-I475 HydrophobicContact CD2-CG1 3.98Å; A375-I475 HydrophobicContact CB-CD1 3.88Å; F380-I475 HydrophobicContact CB-CD1 3.69Å; F380-I475 HydrophobicContact CB-CG1 3.99Å; F380-I475 HydrophobicContact CD1-CD1 4.18Å; F380-I475 HydrophobicContact CD1-CG1 3.76Å; F380-I475 HydrophobicContact CD2-CD1 4.31Å; F380-I475 HydrophobicContact CE1-CG1 4.4Å; F380-I475 HydrophobicContact CG-CD1 3.84Å; F380-I475 HydrophobicContact CG-CG1 3.95Å; K381-I475 PolarHBondContact O-N 3.34Å; I382-I475 HydrophobicContact CG1-CB 4.4Å; F383-I475 PolarHBondContact N-O 3.44Å; I475-P505 HydrophobicContact CG1-CB 4.49Å; I475-P505 HydrophobicContact CG1-CG 3.82Å; I475-I507 HydrophobicContact CD1-CD1 4.45Å; I475-I507 HydrophobicContact CG2-CB 4.39Å; I475-I507 HydrophobicContact CG2-CD1 3.75Å; I475-I507 HydrophobicContact CG2-CG1 3.91Å
476	V	90.5	Very high	71.3	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	123.2	163.1	-177.5	0	0	0	0	107.4	F383 F400 F478 P505 V506 I507	F383-V476 WeakPolarHBondContact O-CA 3.41Å; F400-V476 HydrophobicContact CD1-CG1 4.25Å; F400-V476 HydrophobicContact CD1-CG2 4.21Å; F400-V476 HydrophobicContact CE1-CB 4.19Å; F400-V476 HydrophobicContact CE1-CG1 3.38Å; F400-V476 HydrophobicContact CE1-CG2 3.71Å; F400-V476 HydrophobicContact CZ-CG1 3.66Å; V476-F478 HydrophobicContact CG1-CD2 3.97Å; V476-F478 HydrophobicContact CG1-CE2 3.55Å; V476-F478 HydrophobicContact CG1-CZ 4.47Å; V476-P505 PolarHBondContact N-O 2.92Å; V476-V506 HydrophobicContact CB-CG1 4.45Å; V476-V506 HydrophobicContact CB-CG2 4.28Å; V476-V506 CarbonylContact O-C 3.52Å; V476-V506 WeakPolarHBondContact O-CA 3.48Å; V476-I507 PolarHBondContact O-N 2.73Å
477	L	93.8	Very high	74	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.1	177.9	173.4	55.3	0	0	0	109.2	I371 Y372 I382 F383 E384 L385 D479 I507 T509	I371-L477 HydrophobicContact CD1-CD1 3.66Å; I371-L477 HydrophobicContact CG2-CD1 4.46Å; I371-L477 HydrophobicContact CG2-CD2 4.15Å; Y372-L477 HydrophobicContact CE2-CD2 4.33Å; I382-L477 HydrophobicContact CG2-CB 3.88Å; I382-L477 HydrophobicContact CG2-CD2 4.21Å; F383-L477 PolarHBondContact O-N 3.25Å; E384-L477 CarbonylContact C-O 3.54Å; E384-L477 WeakPolarHBondContact CA-O 3.27Å; E384-L477 HydrophobicContact CG-CD2 4.31Å; E384-L477 HydrophobicContact CG-CG 4.47Å; L385-L477 PolarHBondContact N-O 3.48Å; L477-D479 HydrophobicContact CG-CB 4.47Å; L477-I507 WeakPolarHBondContact CA-O 3.43Å; L477-I507 HydrophobicContact CD1-CB 4.36Å; L477-I507 HydrophobicContact CD1-CG2 4.35Å; L477-T509 HydrophobicContact CD1-CG2 4.11Å
478	F	93.7	Very high	77.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	109.6	164.3	-75.8	-95.9	0	0	0	107.8	L385 I396 F400 V476 V481 F491 L495 L498 V506 I507 L508 T509	L385-F478 HydrophobicContact CB-CD1 4.03Å; L385-F478 HydrophobicContact CB-CE1 4.23Å; L385-F478 HydrophobicContact CD1-CD1 4.13Å; L385-F478 HydrophobicContact CD1-CE1 3.47Å; L385-F478 VanDerWaalsContact CD1-CE1 3.47Å; L385-F478 HydrophobicContact CD1-CZ 3.91Å; L385-F478 HydrophobicContact CG-CE1 4.44Å; I396-F478 HydrophobicContact CD1-CE1 3.9Å; I396-F478 HydrophobicContact CG1-CE1 4.13Å; I396-F478 HydrophobicContact CG2-CZ 4.19Å; F400-F478 HydrophobicContact CE2-CZ 4.49Å; V476-F478 HydrophobicContact CG1-CD2 3.97Å; V476-F478 HydrophobicContact CG1-CE2 3.55Å; V476-F478 HydrophobicContact CG1-CZ 4.47Å; F478-V481 HydrophobicContact CB-CG1 3.57Å; F478-F491 AromaticContact CD1-CE2 3.77Å; F478-F491 HydrophobicContact CD1-CE2 3.77Å; F478-F491 AromaticContact CD1-CZ 3.82Å; F478-F491 HydrophobicContact CD1-CZ 3.82Å; F478-F491 HydrophobicContact CE1-CE2 4.02Å; F478-F491 HydrophobicContact CE1-CZ 4.34Å; F478-L495 HydrophobicContact CD2-CD1 4.21Å; F478-L495 HydrophobicContact CE2-CD1 3.93Å; F478-L495 HydrophobicContact CZ-CD1 4.17Å; F478-L498 HydrophobicContact CE2-CD2 3.38Å; F478-L498 HydrophobicContact CZ-CD2 3.48Å; F478-L498 VanDerWaalsContact CZ-CD2 3.48Å; F478-V506 HydrophobicContact CD2-CG1 3.92Å; F478-V506 HydrophobicContact CE2-CG1 4.11Å; F478-I507 PolarHBondContact N-O 3.02Å; F478-L508 HydrophobicContact CB-CD2 3.78Å; F478-L508 HydrophobicContact CG-CD2 4.29Å; F478-L508 CarbonylContact O-C 3.58Å; F478-L508 WeakPolarHBondContact O-CA 3.48Å; F478-T509 PolarHBondContact O-N 3.09Å
479	D	93.9	Very high	80	Confident	7 Å²	7	45.1 Å²	45.1	4%	0.037	23%	0.227	C	C	.	.			trans	-94.8	140	-176.1	-155.5	46.8	0	0	0	109.8	S368 L385 N386 R391 L477 T509 R912	S368-D479 WeakPolarHBondContact CB-OD1 3.38Å; S368-D479 PolarHBondContact OG-OD1 2.93Å; L385-D479 PolarHBondContact O-N 3.42Å; N386-D479 HydrophobicContact CB-CB 4.22Å; R391-D479 PolarHBondContact NH1-O 3.19Å; L477-D479 HydrophobicContact CG-CB 4.47Å; D479-T509 VanDerWaalsContact CA-OG1 3.31Å; D479-T509 WeakPolarHBondContact CA-OG1 3.2Å; D479-T509 PolarHBondContact OD1-OG1 3.31Å; D479-R912 IonicContact OD2-NH2 3.38Å
480	E	92.7	Very high	83	Confident	34 Å²	34	41.2 Å²	41.2	16%	0.159	22%	0.215	C	C	.	.			trans	55.1	58.8	175	-61.1	166.3	149.4	0	0	112	P387 R391 D482 V483 T509 R912	P387-E480 WeakPolarHBondContact CD-OE2 3.47Å; P387-E480 HydrophobicContact CG-CB 3.47Å; P387-E480 VanDerWaalsContact CG-CB 3.47Å; P387-E480 HydrophobicContact CG-CG 4.42Å; P387-E480 WeakPolarHBondContact CG-OE2 3.46Å; R391-E480 PolarHBondContact NH1-O 3.25Å; R391-E480 PolarHBondContact NH2-O 2.78Å; E480-D482 WeakPolarHBondContact CA-OD1 3.47Å; E480-V483 HydrophobicContact CB-CB 4.48Å; E480-V483 HydrophobicContact CB-CG2 3.98Å; E480-V483 PolarHBondContact O-N 3.15Å; E480-T509 WeakPolarHBondContact CA-O 3.29Å; E480-T509 PolarHBondContact N-O 2.85Å; E480-T509 VanDerWaalsContact N-O 3.15Å; E480-T509 PolarHBondContact N-OG1 3.38Å; E480-R912 IonicContact OE1-NE 3.19Å; E480-R912 PolarHBondContact OE1-NE 2.92Å; E480-R912 IonicContact OE2-CZ 3.5Å; E480-R912 IonicContact OE2-NE 2.78Å; E480-R912 PolarHBondContact OE2-NE 3.31Å; E480-R912 IonicContact OE2-NH2 3.72Å; E480-R912 PolarHBondContact OE2-NH2 3.01Å
481	V	93.2	Very high	85.8	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.006	20%	0.199	C	C	.	.	S	Bend	trans	-83.3	-7.3	-176.5	-57	0	0	0	0	115.3	F478 L484 F491 W492 L508 T509 A510 V515	F478-V481 HydrophobicContact CB-CG1 3.57Å; V481-L484 WeakPolarHBondContact O-CG 3.45Å; V481-F491 HydrophobicContact CB-CE1 4.09Å; V481-F491 HydrophobicContact CB-CZ 4.02Å; V481-F491 HydrophobicContact CG1-CE1 4.23Å; V481-F491 HydrophobicContact CG1-CZ 3.68Å; V481-W492 HydrophobicContact CB-CH2 4.08Å; V481-W492 HydrophobicContact CG2-CH2 3.84Å; V481-W492 WeakPolarHBondContact O-CZ2 3.45Å; V481-L508 HydrophobicContact CG1-CD2 3.9Å; V481-L508 HydrophobicContact CG2-CB 4.41Å; V481-L508 HydrophobicContact CG2-CD2 4.21Å; V481-T509 WeakPolarHBondContact CG2-O 3.44Å; V481-T509 PolarHBondContact N-O 3.46Å; V481-A510 HydrophobicContact CG2-CB 4.32Å; V481-V515 HydrophobicContact CG2-CG1 3.86Å
482	D	92.5	Very high	87.9	Confident	40 Å²	40	37.6 Å²	37.6	21%	0.214	19%	0.192	C	C	.	.	S	Bend	trans	-64.8	-40	158.4	43.3	-15.9	0	0	0	111.7	E480 L484 A510 S511 D512 V515	E480-D482 WeakPolarHBondContact CA-OD1 3.47Å; D482-L484 VanDerWaalsContact C-N 3.26Å; D482-L484 PolarHBondContact O-N 2.93Å; D482-A510 HydrophobicContact CB-CB 4.24Å; D482-S511 WeakPolarHBondContact OD2-CA 3.23Å; D482-S511 WeakPolarHBondContact OD2-CB 3.27Å; D482-S511 PolarHBondContact OD2-N 3.06Å; D482-D512 HydrophobicContact CB-CB 4.08Å; D482-D512 PolarHBondContact OD2-N 2.87Å; D482-V515 HydrophobicContact CB-CG2 3.61Å
483	V	90.6	Very high	89.6	Confident	33 Å²	33	37.9 Å²	37.9	20%	0.2	20%	0.195	C	C	.	.			trans	-81.2	68.5	-172	-157.8	0	0	0	0	111.7	P387 R391 E480 F485	P387-V483 HydrophobicContact CG-CB 4.22Å; R391-V483 PolarHBondContact NH2-O 2.78Å; E480-V483 HydrophobicContact CB-CB 4.48Å; E480-V483 HydrophobicContact CB-CG2 3.98Å; E480-V483 PolarHBondContact O-N 3.15Å; V483-F485 HydrophobicContact CB-CE2 4.42Å; V483-F485 HydrophobicContact CG1-CD2 4.37Å; V483-F485 HydrophobicContact CG1-CE2 3.53Å; V483-F485 HydrophobicContact CG1-CZ 3.92Å; V483-F485 WeakPolarHBondContact O-CD2 3.49Å; V483-F485 WeakPolarHBondContact O-CE2 3.26Å
484	L	88.4	Confident	90.2	Very high	61 Å²	61	36.3 Å²	36.3	32%	0.319	19%	0.186	S	C	.	.			trans	-96.4	142.4	177.4	-63.9	174.9	0	0	0	111.8	V481 D482 D488 F491 W492	V481-L484 WeakPolarHBondContact O-CG 3.45Å; D482-L484 VanDerWaalsContact C-N 3.26Å; D482-L484 PolarHBondContact O-N 2.93Å; L484-D488 HydrophobicContact CD2-CB 4.16Å; L484-F491 HydrophobicContact CD1-CB 4.46Å; L484-F491 HydrophobicContact CD1-CD1 3.89Å; L484-F491 HydrophobicContact CD1-CG 4.33Å; L484-F491 HydrophobicContact CD2-CB 3.98Å; L484-F491 HydrophobicContact CD2-CD1 3.75Å; L484-F491 HydrophobicContact CD2-CD2 3.87Å; L484-F491 HydrophobicContact CD2-CE1 4.23Å; L484-F491 HydrophobicContact CD2-CE2 4.34Å; L484-F491 HydrophobicContact CD2-CG 3.58Å; L484-F491 HydrophobicContact CG-CD1 4.47Å; L484-W492 HydrophobicContact CD1-CZ2 3.91Å
485	F	84.1	Confident	90.4	Very high	57 Å²	57	36.2 Å²	36.2	25%	0.25	19%	0.186	C	C	.	.			trans	-139.2	172.9	-179.2	-42.3	-136.7	0	0	0	109.7	P387 V483 S487 D488 R905 H908	P387-F485 HydrophobicContact CB-CE2 4.33Å; V483-F485 HydrophobicContact CB-CE2 4.42Å; V483-F485 HydrophobicContact CG1-CD2 4.37Å; V483-F485 HydrophobicContact CG1-CE2 3.53Å; V483-F485 HydrophobicContact CG1-CZ 3.92Å; V483-F485 WeakPolarHBondContact O-CD2 3.49Å; V483-F485 WeakPolarHBondContact O-CE2 3.26Å; F485-S487 PolarHBondContact O-N 2.91Å; F485-D488 PolarHBondContact O-N 2.8Å; F485-R905 HydrophobicContact CD1-CB 4.16Å; F485-R905 HydrophobicContact CD1-CG 4.29Å; F485-R905 VanDerWaalsContact CD2-CD 3.49Å; F485-R905 HydrophobicContact CE1-CB 3.66Å; F485-R905 HydrophobicContact CE1-CG 4.27Å; F485-R905 HydrophobicContact CE2-CB 4.45Å; F485-R905 VanDerWaalsContact CG-CD 3.4Å; F485-R905 HydrophobicContact CG-CG 4.49Å; F485-R905 HydrophobicContact CZ-CB 3.84Å; F485-R905 HydrophobicContact CZ-CG 4.49Å; F485-H908 AromaticContact CE1-CD2 3.38Å; F485-H908 WeakPolarHBondContact CE1-CD2 3.1Å; F485-H908 HydrophobicContact CZ-CB 4.11Å; F485-H908 AromaticContact CZ-CD2 3.38Å; F485-H908 WeakPolarHBondContact CZ-CD2 3.2Å; F485-H908 AromaticContact CZ-CG 3.96Å
486	E	82	Confident	90.3	Very high	136 Å²	136	37.4 Å²	37.4	64%	0.636	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-52.5	-25.1	-174.1	-70.9	-151	-124.2	0	0	117.6	D488 R489	E486-D488 PolarHBondContact O-N 2.74Å; E486-R489 WeakPolarHBondContact O-CD 3.17Å; E486-R489 WeakPolarHBondContact O-CG 3.2Å; E486-R489 PolarHBondContact O-NE 3.42Å; E486-R489 IonicContact OE2-CZ 3.68Å; E486-R489 IonicContact OE2-NE 3.91Å; E486-R489 IonicContact OE2-NH2 2.67Å; E486-R489 PolarHBondContact OE2-NH2 2.72Å
487	S	84.6	Confident	89.9	Confident	38 Å²	38	39.8 Å²	39.8	27%	0.266	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-65	-29.4	173.6	58.1	0	0	0	0	112.8	S392 F485 R489 R905	S392-S487 WeakPolarHBondContact CB-O 3.37Å; F485-S487 PolarHBondContact O-N 2.91Å; S487-R489 VanDerWaalsContact C-N 3.28Å; S487-R489 PolarHBondContact O-N 2.9Å; S487-R905 PolarHBondContact OG-NH2 3.43Å
488	D	90.6	Very high	89.4	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.032	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-94.4	22.9	-167.2	-60.8	-0.5	0	0	0	112	R391 L484 F485 E486 G490 F491 R905	R391-D488 HydrophobicContact CG-CB 4.35Å; R391-D488 WeakPolarHBondContact CG-OD2 3.34Å; R391-D488 IonicContact CZ-OD2 3.11Å; R391-D488 IonicContact NE-OD2 2.65Å; R391-D488 PolarHBondContact NE-OD2 3.26Å; L484-D488 HydrophobicContact CD2-CB 4.16Å; F485-D488 PolarHBondContact O-N 2.8Å; E486-D488 PolarHBondContact O-N 2.74Å; D488-G490 PolarHBondContact O-N 3.4Å; D488-G490 VanDerWaalsContact O-N 3.14Å; D488-F491 HydrophobicContact CB-CB 4.26Å; D488-F491 VanDerWaalsContact O-CB 3.29Å; D488-F491 WeakPolarHBondContact O-CB 3.47Å; D488-F491 PolarHBondContact O-N 3.28Å; D488-R905 IonicContact OD1-CZ 3.24Å; D488-R905 IonicContact OD1-NH1 2.81Å; D488-R905 IonicContact OD1-NH2 3.42Å; D488-R905 PolarHBondContact OD1-NH2 3.14Å; D488-R905 IonicContact OD2-CZ 2.66Å; D488-R905 VanDerWaalsContact OD2-CZ 3.24Å; D488-R905 IonicContact OD2-NH1 3.62Å; D488-R905 PolarHBondContact OD2-NH1 3.28Å; D488-R905 IonicContact OD2-NH2 3.68Å; D488-R905 PolarHBondContact OD2-NH2 3.39Å
489	R	90.1	Very high	89	Confident	184 Å²	184	40.4 Å²	40.4	69%	0.694	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.3	123.9	177.2	-75.6	167.9	-170.9	-119.3	7.4	110.2	G393 E486 S487	G393-R489 PolarHBondContact N-O 2.96Å; E486-R489 WeakPolarHBondContact O-CD 3.17Å; E486-R489 WeakPolarHBondContact O-CG 3.2Å; E486-R489 PolarHBondContact O-NE 3.42Å; E486-R489 IonicContact OE2-CZ 3.68Å; E486-R489 IonicContact OE2-NE 3.91Å; E486-R489 IonicContact OE2-NH2 2.67Å; E486-R489 PolarHBondContact OE2-NH2 2.72Å; S487-R489 VanDerWaalsContact C-N 3.28Å; S487-R489 PolarHBondContact O-N 2.9Å
490	G	91.9	Very high	88.2	Confident	36 Å²	36	46.1 Å²	46.1	37%	0.371	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	10.5	-175.1	0	0	0	0	0	116.3	G393 D488 W492 S493 G494	G393-G490 VanDerWaalsContact CA-O 3.22Å; G393-G490 WeakPolarHBondContact CA-O 3.34Å; D488-G490 PolarHBondContact O-N 3.4Å; D488-G490 VanDerWaalsContact O-N 3.14Å; G490-W492 PolarHBondContact O-N 2.78Å; G490-S493 WeakPolarHBondContact CA-OG 3.42Å; G490-S493 PolarHBondContact O-N 2.93Å; G490-S493 VanDerWaalsContact O-N 3.15Å; G490-S493 PolarHBondContact O-OG 2.81Å; G490-G494 PolarHBondContact O-N 2.85Å
491	F	93.8	Very high	87.3	Confident	5 Å²	5	50.3 Å²	50.3	2%	0.022	26%	0.263	C	S	.	.	H	α-helix	trans	-45.3	-60.5	177.4	177.1	-94.9	0	0	0	112.6	R391 I396 F478 V481 L484 D488 S493 G494 L495	R391-F491 HydrophobicContact CB-CD2 4.41Å; R391-F491 HydrophobicContact CG-CD2 4.1Å; R391-F491 HydrophobicContact CG-CE2 4.26Å; R391-F491 WeakPolarHBondContact O-CD2 3.35Å; I396-F491 HydrophobicContact CD1-CD2 3.57Å; I396-F491 HydrophobicContact CD1-CE2 3.84Å; I396-F491 HydrophobicContact CD1-CG 4.36Å; F478-F491 AromaticContact CD1-CE2 3.77Å; F478-F491 HydrophobicContact CD1-CE2 3.77Å; F478-F491 AromaticContact CD1-CZ 3.82Å; F478-F491 HydrophobicContact CD1-CZ 3.82Å; F478-F491 HydrophobicContact CE1-CE2 4.02Å; F478-F491 HydrophobicContact CE1-CZ 4.34Å; V481-F491 HydrophobicContact CB-CE1 4.09Å; V481-F491 HydrophobicContact CB-CZ 4.02Å; V481-F491 HydrophobicContact CG1-CE1 4.23Å; V481-F491 HydrophobicContact CG1-CZ 3.68Å; L484-F491 HydrophobicContact CD1-CB 4.46Å; L484-F491 HydrophobicContact CD1-CD1 3.89Å; L484-F491 HydrophobicContact CD1-CG 4.33Å; L484-F491 HydrophobicContact CD2-CB 3.98Å; L484-F491 HydrophobicContact CD2-CD1 3.75Å; L484-F491 HydrophobicContact CD2-CD2 3.87Å; L484-F491 HydrophobicContact CD2-CE1 4.23Å; L484-F491 HydrophobicContact CD2-CE2 4.34Å; L484-F491 HydrophobicContact CD2-CG 3.58Å; L484-F491 HydrophobicContact CG-CD1 4.47Å; D488-F491 HydrophobicContact CB-CB 4.26Å; D488-F491 VanDerWaalsContact O-CB 3.29Å; D488-F491 WeakPolarHBondContact O-CB 3.47Å; D488-F491 PolarHBondContact O-N 3.28Å; F491-S493 VanDerWaalsContact C-N 3.3Å; F491-S493 PolarHBondContact O-N 2.94Å; F491-G494 PolarHBondContact O-N 2.87Å; F491-L495 HydrophobicContact CE1-CD2 4.04Å; F491-L495 HydrophobicContact CZ-CD2 4.35Å; F491-L495 PolarHBondContact O-N 2.76Å
492	W	92.4	Very high	86.4	Confident	51 Å²	51	50.4 Å²	50.4	19%	0.193	26%	0.264	C	S	.	.	H	α-helix	trans	-60.5	-34.9	-178.6	-64.5	117	0	0	0	113.2	V481 L484 G490 L495 S496 V515 N518	V481-W492 HydrophobicContact CB-CH2 4.08Å; V481-W492 HydrophobicContact CG2-CH2 3.84Å; V481-W492 WeakPolarHBondContact O-CZ2 3.45Å; L484-W492 HydrophobicContact CD1-CZ2 3.91Å; G490-W492 PolarHBondContact O-N 2.78Å; W492-L495 HydrophobicContact CE3-CD2 3.77Å; W492-L495 HydrophobicContact CZ3-CD2 3.61Å; W492-S496 WeakPolarHBondContact O-CB 3.5Å; W492-S496 PolarHBondContact O-N 2.84Å; W492-V515 HydrophobicContact CH2-CG1 3.79Å; W492-V515 HydrophobicContact CZ2-CG1 4.3Å; W492-N518 HydrophobicContact CD2-CB 3.94Å; W492-N518 HydrophobicContact CE3-CB 4.34Å; W492-N518 HydrophobicContact CG-CB 4.47Å; W492-N518 HydrophobicContact CH2-CB 4.32Å; W492-N518 HydrophobicContact CZ2-CB 3.86Å
493	S	90	Very high	85.6	Confident	71 Å²	71	56.2 Å²	56.2	50%	0.497	28%	0.283	S	S	.	.	H	α-helix	trans	-69.2	-39.7	174.1	58.3	0	0	0	0	112.7	G490 F491 S496 S497	G490-S493 WeakPolarHBondContact CA-OG 3.42Å; G490-S493 PolarHBondContact O-N 2.93Å; G490-S493 VanDerWaalsContact O-N 3.15Å; G490-S493 PolarHBondContact O-OG 2.81Å; F491-S493 VanDerWaalsContact C-N 3.3Å; F491-S493 PolarHBondContact O-N 2.94Å; S493-S496 WeakPolarHBondContact O-CB 3.28Å; S493-S496 PolarHBondContact O-N 2.81Å; S493-S497 PolarHBondContact O-N 3.28Å; S493-S497 VanDerWaalsContact O-N 3.09Å; S493-S497 PolarHBondContact O-OG 2.93Å
494	G	89.6	Confident	85.1	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-41.9	174.7	0	0	0	0	0	111.7	G490 F491 S496 S497 L498	G490-G494 PolarHBondContact O-N 2.85Å; F491-G494 PolarHBondContact O-N 2.87Å; G494-S496 VanDerWaalsContact C-N 3.34Å; G494-S497 PolarHBondContact O-N 3.09Å; G494-L498 VanDerWaalsContact O-CB 3.29Å; G494-L498 WeakPolarHBondContact O-CB 3.33Å; G494-L498 PolarHBondContact O-N 3.38Å
495	L	89.9	Confident	85.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-34.7	173.7	-177.5	61.1	0	0	0	112.4	F478 F491 W492 L498 L499 L508	F478-L495 HydrophobicContact CD2-CD1 4.21Å; F478-L495 HydrophobicContact CE2-CD1 3.93Å; F478-L495 HydrophobicContact CZ-CD1 4.17Å; F491-L495 HydrophobicContact CE1-CD2 4.04Å; F491-L495 HydrophobicContact CZ-CD2 4.35Å; F491-L495 PolarHBondContact O-N 2.76Å; W492-L495 HydrophobicContact CE3-CD2 3.77Å; W492-L495 HydrophobicContact CZ3-CD2 3.61Å; L495-L498 HydrophobicContact CD1-CD2 4.01Å; L495-L498 WeakPolarHBondContact O-CB 3.34Å; L495-L498 PolarHBondContact O-N 3.41Å; L495-L499 HydrophobicContact CD1-CD1 4.2Å; L495-L499 HydrophobicContact CD1-CG 4.13Å; L495-L499 HydrophobicContact CG-CD1 4.07Å; L495-L499 HydrophobicContact CG-CG 4.42Å; L495-L499 WeakPolarHBondContact O-CB 3.36Å; L495-L499 VanDerWaalsContact O-CG 3.31Å; L495-L499 WeakPolarHBondContact O-CG 3.42Å; L495-L499 PolarHBondContact O-N 3.39Å; L495-L508 HydrophobicContact CD1-CD2 4.38Å; L495-L508 HydrophobicContact CD2-CD2 3.65Å
496	S	86.9	Confident	85.4	Confident	25 Å²	25	50.5 Å²	50.5	18%	0.175	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-53.3	172.8	-174	0	0	0	0	111.6	W492 S493 G494 L498 L499 Q500	W492-S496 WeakPolarHBondContact O-CB 3.5Å; W492-S496 PolarHBondContact O-N 2.84Å; S493-S496 WeakPolarHBondContact O-CB 3.28Å; S493-S496 PolarHBondContact O-N 2.81Å; G494-S496 VanDerWaalsContact C-N 3.34Å; S496-L498 PolarHBondContact O-N 3.24Å; S496-L499 PolarHBondContact O-N 3.04Å; S496-Q500 VanDerWaalsContact O-CG 3.3Å; S496-Q500 WeakPolarHBondContact O-CG 3.42Å; S496-Q500 PolarHBondContact O-N 3.15Å; S496-Q500 PolarHBondContact OG-NE2 2.92Å; S496-Q500 VanDerWaalsContact OG-NE2 3.13Å
497	S	83.2	Confident	86.1	Confident	50 Å²	50	44 Å²	44	35%	0.35	22%	0.222	S	C	.	.	H	α-helix	trans	-58.4	-38.3	175.3	-57.3	0	0	0	0	111.9	S493 G494 L501	S493-S497 PolarHBondContact O-N 3.28Å; S493-S497 VanDerWaalsContact O-N 3.09Å; S493-S497 PolarHBondContact O-OG 2.93Å; G494-S497 PolarHBondContact O-N 3.09Å; S497-L501 WeakPolarHBondContact O-CG 3.28Å; S497-L501 PolarHBondContact O-N 3.34Å
498	L	84.3	Confident	86.6	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-53	176.1	-172.2	75	0	0	0	111.9	I396 F400 L404 F478 G494 L495 S496 Q500 L501 A502	I396-L498 HydrophobicContact CG2-CB 4.46Å; I396-L498 HydrophobicContact CG2-CD2 4.28Å; F400-L498 HydrophobicContact CB-CD1 3.21Å; F400-L498 HydrophobicContact CD1-CD1 4.07Å; F400-L498 HydrophobicContact CD2-CD1 4.38Å; F400-L498 HydrophobicContact CG-CD1 3.62Å; L404-L498 HydrophobicContact CD1-CD1 3.42Å; L404-L498 VanDerWaalsContact CD1-CD1 3.42Å; L404-L498 HydrophobicContact CD1-CG 4.29Å; F478-L498 HydrophobicContact CE2-CD2 3.38Å; F478-L498 HydrophobicContact CZ-CD2 3.48Å; F478-L498 VanDerWaalsContact CZ-CD2 3.48Å; G494-L498 VanDerWaalsContact O-CB 3.29Å; G494-L498 WeakPolarHBondContact O-CB 3.33Å; G494-L498 PolarHBondContact O-N 3.38Å; L495-L498 HydrophobicContact CD1-CD2 4.01Å; L495-L498 WeakPolarHBondContact O-CB 3.34Å; L495-L498 PolarHBondContact O-N 3.41Å; S496-L498 PolarHBondContact O-N 3.24Å; L498-Q500 VanDerWaalsContact C-N 3.33Å; L498-Q500 PolarHBondContact O-N 3.33Å; L498-L501 CarbonylContact O-C 3.57Å; L498-L501 PolarHBondContact O-N 2.79Å; L498-L501 VanDerWaalsContact O-N 3.16Å; L498-A502 WeakPolarHBondContact O-CA 3.48Å; L498-A502 VanDerWaalsContact O-CB 3.27Å; L498-A502 WeakPolarHBondContact O-CB 3.33Å; L498-A502 PolarHBondContact O-N 3.22Å
499	L	83.6	Confident	86.8	Confident	6 Å²	6	42 Å²	42	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-63.9	-38.2	-177.6	-72.7	171.7	0	0	0	111.6	K355 A356 L495 S496 L501 A502 V506 P520 V521	K355-L499 WeakPolarHBondContact CD-O 3.23Å; K355-L499 WeakPolarHBondContact CE-O 3.45Å; K355-L499 PolarHBondContact NZ-O 2.92Å; A356-L499 HydrophobicContact CB-CD1 4.14Å; A356-L499 HydrophobicContact CB-CD2 3.84Å; L495-L499 HydrophobicContact CD1-CD1 4.2Å; L495-L499 HydrophobicContact CD1-CG 4.13Å; L495-L499 HydrophobicContact CG-CD1 4.07Å; L495-L499 HydrophobicContact CG-CG 4.42Å; L495-L499 WeakPolarHBondContact O-CB 3.36Å; L495-L499 VanDerWaalsContact O-CG 3.31Å; L495-L499 WeakPolarHBondContact O-CG 3.42Å; L495-L499 PolarHBondContact O-N 3.39Å; S496-L499 PolarHBondContact O-N 3.04Å; L499-L501 VanDerWaalsContact C-N 3.31Å; L499-L501 PolarHBondContact O-N 3.43Å; L499-A502 PolarHBondContact O-N 2.93Å; L499-V506 HydrophobicContact CD2-CB 3.8Å; L499-V506 HydrophobicContact CD2-CG1 4.08Å; L499-V506 HydrophobicContact CD2-CG2 3.86Å; L499-P520 HydrophobicContact CD1-CG 4.3Å; L499-V521 HydrophobicContact CB-CG2 4Å; L499-V521 HydrophobicContact CD1-CB 4.26Å; L499-V521 HydrophobicContact CD1-CG2 4.24Å
500	Q	77	Confident	87	Confident	127 Å²	127	33.2 Å²	33.2	59%	0.593	18%	0.175	S	C	*	.	H	α-helix	trans	-57	-44.5	173.4	-69.4	172.2	41.7	0	0	111.7	K355 S496 L498	K355-Q500 PolarHBondContact NZ-O 2.86Å; S496-Q500 VanDerWaalsContact O-CG 3.3Å; S496-Q500 WeakPolarHBondContact O-CG 3.42Å; S496-Q500 PolarHBondContact O-N 3.15Å; S496-Q500 PolarHBondContact OG-NE2 2.92Å; S496-Q500 VanDerWaalsContact OG-NE2 3.13Å; L498-Q500 VanDerWaalsContact C-N 3.33Å; L498-Q500 PolarHBondContact O-N 3.33Å
501	L	74.9	Confident	87	Confident	121 Å²	121	32.5 Å²	32.5	63%	0.634	17%	0.165	S	C	*	.	H	α-helix	trans	-87.6	-18.5	-177.7	-62.5	177.2	0	0	0	114.9	S497 L498 L499 R503	S497-L501 WeakPolarHBondContact O-CG 3.28Å; S497-L501 PolarHBondContact O-N 3.34Å; L498-L501 CarbonylContact O-C 3.57Å; L498-L501 PolarHBondContact O-N 2.79Å; L498-L501 VanDerWaalsContact O-N 3.16Å; L499-L501 VanDerWaalsContact C-N 3.31Å; L499-L501 PolarHBondContact O-N 3.43Å; L501-R503 PolarHBondContact O-N 2.99Å
502	A	73.3	Confident	86.7	Confident	4 Å²	4	36.1 Å²	36.1	3%	0.033	18%	0.184	C	C	.	.			trans	-57.7	130.3	-169.2	0	0	0	0	0	113.8	K355 L404 L498 L499 V506	K355-A502 HydrophobicContact CD-CB 4.14Å; K355-A502 WeakPolarHBondContact CD-O 3.49Å; K355-A502 WeakPolarHBondContact CE-O 3.23Å; K355-A502 PolarHBondContact NZ-O 2.81Å; L404-A502 HydrophobicContact CD1-CB 4.41Å; L498-A502 WeakPolarHBondContact O-CA 3.48Å; L498-A502 VanDerWaalsContact O-CB 3.27Å; L498-A502 WeakPolarHBondContact O-CB 3.33Å; L498-A502 PolarHBondContact O-N 3.22Å; L499-A502 PolarHBondContact O-N 2.93Å; A502-V506 HydrophobicContact CB-CG2 4.05Å
503	R	76.9	Confident	86.4	Confident	161 Å²	161	36.2 Å²	36.2	61%	0.608	19%	0.192	S	C	*	.			trans	-108.6	10	173.1	-67.2	-179	173.4	175.6	-1.7	112.8	W239 L501	W239-R503 WeakPolarHBondContact CZ3-O 3.43Å; L501-R503 PolarHBondContact O-N 2.99Å
504	R	79	Confident	86.3	Confident	30 Å²	30	35.4 Å²	35.4	11%	0.113	19%	0.187	C	C	.	.	S	Bend	trans	-134.3	151.3	-175.6	-62.6	-180	-179.4	-89.2	-4.9	108.2	L404 C472 S474 V506	L404-R504 HydrophobicContact CD2-CB 4.32Å; L404-R504 HydrophobicContact CD2-CG 4.15Å; C472-R504 PolarHBondContact O-NH1 2.62Å; S474-R504 WeakPolarHBondContact OG-CD 3.25Å; S474-R504 PolarHBondContact OG-NH1 2.89Å; R504-V506 PolarHBondContact O-N 3.38Å
505	P	89.3	Confident	86.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.			trans	-59.2	131.9	172.9	21.4	-30.3	0	0	0	110.9	W235 L236 W239 F380 S474 I475 V476	W235-P505 HydrophobicContact CE3-CB 4.48Å; W235-P505 HydrophobicContact CH2-CB 3.46Å; W235-P505 VanDerWaalsContact CH2-CB 3.46Å; W235-P505 HydrophobicContact CZ2-CB 4.31Å; W235-P505 HydrophobicContact CZ3-CB 3.56Å; L236-P505 HydrophobicContact CD2-CB 4.03Å; L236-P505 HydrophobicContact CD2-CG 4.15Å; W239-P505 HydrophobicContact CB-CG 4.33Å; W239-P505 HydrophobicContact CD2-CB 4.15Å; W239-P505 HydrophobicContact CD2-CG 4.27Å; W239-P505 HydrophobicContact CG-CB 4Å; W239-P505 HydrophobicContact CG-CG 4.09Å; F380-P505 HydrophobicContact CD1-CG 4.5Å; F380-P505 HydrophobicContact CE1-CG 4Å; S474-P505 WeakPolarHBondContact O-CD 3.12Å; I475-P505 HydrophobicContact CG1-CB 4.49Å; I475-P505 HydrophobicContact CG1-CG 3.82Å; V476-P505 PolarHBondContact N-O 2.92Å
506	V	90.9	Very high	85.9	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.2	172.1	-174.1	0	0	0	0	108.4	K355 A356 F357 V476 F478 L499 A502 R504	K355-V506 PolarHBondContact O-N 3.35Å; A356-V506 CarbonylContact C-O 3.6Å; A356-V506 WeakPolarHBondContact CA-O 3.38Å; F357-V506 PolarHBondContact N-O 2.92Å; V476-V506 HydrophobicContact CB-CG1 4.45Å; V476-V506 HydrophobicContact CB-CG2 4.28Å; V476-V506 CarbonylContact O-C 3.52Å; V476-V506 WeakPolarHBondContact O-CA 3.48Å; F478-V506 HydrophobicContact CD2-CG1 3.92Å; F478-V506 HydrophobicContact CE2-CG1 4.11Å; L499-V506 HydrophobicContact CD2-CB 3.8Å; L499-V506 HydrophobicContact CD2-CG1 4.08Å; L499-V506 HydrophobicContact CD2-CG2 3.86Å; A502-V506 HydrophobicContact CB-CG2 4.05Å; R504-V506 PolarHBondContact O-N 3.38Å
507	I	94.9	Very high	85.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	141.6	175	-54.5	179.3	0	0	0	108.8	L232 W235 L236 F357 L359 I371 I475 V476 L477 F478	L232-I507 HydrophobicContact CD1-CD1 4.09Å; W235-I507 HydrophobicContact CZ3-CD1 4.44Å; W235-I507 HydrophobicContact CZ3-CG1 4.03Å; L236-I507 HydrophobicContact CD1-CD1 4.4Å; L236-I507 HydrophobicContact CD2-CD1 4.37Å; F357-I507 HydrophobicContact CB-CG1 4.48Å; F357-I507 CarbonylContact O-C 3.59Å; F357-I507 VanDerWaalsContact O-CA 3.29Å; F357-I507 WeakPolarHBondContact O-CA 3.26Å; L359-I507 HydrophobicContact CD1-CG2 3.51Å; I371-I507 HydrophobicContact CD1-CB 4.48Å; I371-I507 HydrophobicContact CD1-CG2 3.51Å; I371-I507 HydrophobicContact CG1-CD1 4.5Å; I371-I507 HydrophobicContact CG1-CG2 4.15Å; I371-I507 HydrophobicContact CG2-CD1 4.01Å; I475-I507 HydrophobicContact CD1-CD1 4.45Å; I475-I507 HydrophobicContact CG2-CB 4.39Å; I475-I507 HydrophobicContact CG2-CD1 3.75Å; I475-I507 HydrophobicContact CG2-CG1 3.91Å; V476-I507 PolarHBondContact O-N 2.73Å; L477-I507 WeakPolarHBondContact CA-O 3.43Å; L477-I507 HydrophobicContact CD1-CB 4.36Å; L477-I507 HydrophobicContact CD1-CG2 4.35Å; F478-I507 PolarHBondContact N-O 3.02Å
508	L	95.4	Very high	85.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.4	179.2	-63.3	149.3	0	0	0	107.7	A356 F357 L358 L359 F478 V481 L495 L519	A356-L508 HydrophobicContact CB-CD1 4.29Å; F357-L508 PolarHBondContact O-N 2.87Å; L358-L508 WeakPolarHBondContact CA-O 3.18Å; L358-L508 HydrophobicContact CB-CB 4.27Å; L358-L508 HydrophobicContact CD1-CB 3.51Å; L358-L508 HydrophobicContact CG-CB 4.49Å; L359-L508 PolarHBondContact N-O 2.86Å; F478-L508 HydrophobicContact CB-CD2 3.78Å; F478-L508 HydrophobicContact CG-CD2 4.29Å; F478-L508 CarbonylContact O-C 3.58Å; F478-L508 WeakPolarHBondContact O-CA 3.48Å; V481-L508 HydrophobicContact CG1-CD2 3.9Å; V481-L508 HydrophobicContact CG2-CB 4.41Å; V481-L508 HydrophobicContact CG2-CD2 4.21Å; L495-L508 HydrophobicContact CD1-CD2 4.38Å; L495-L508 HydrophobicContact CD2-CD2 3.65Å; L508-L519 HydrophobicContact CD1-CD2 3.89Å
509	T	95.4	Very high	85.8	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.006	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.5	164.9	73	0	0	0	0	110.2	L359 K367 I371 L477 F478 D479 E480 V481	L359-T509 HydrophobicContact CB-CG2 4.45Å; L359-T509 CarbonylContact O-C 3.5Å; L359-T509 WeakPolarHBondContact O-CA 3.36Å; K367-T509 HydrophobicContact CB-CG2 4.46Å; I371-T509 HydrophobicContact CD1-CG2 3.5Å; L477-T509 HydrophobicContact CD1-CG2 4.11Å; F478-T509 PolarHBondContact O-N 3.09Å; D479-T509 VanDerWaalsContact CA-OG1 3.31Å; D479-T509 WeakPolarHBondContact CA-OG1 3.2Å; D479-T509 PolarHBondContact OD1-OG1 3.31Å; E480-T509 WeakPolarHBondContact CA-O 3.29Å; E480-T509 PolarHBondContact N-O 2.85Å; E480-T509 VanDerWaalsContact N-O 3.15Å; E480-T509 PolarHBondContact N-OG1 3.38Å; V481-T509 WeakPolarHBondContact CG2-O 3.44Å; V481-T509 PolarHBondContact N-O 3.46Å
510	A	94.4	Very high	85.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.25	C	C	.	.			trans	-140.9	156.7	170.1	0	0	0	0	0	109.1	L358 L359 V360 G361 K367 V481 D482 D512 V515	L358-A510 HydrophobicContact CD1-CB 4.23Å; L359-A510 PolarHBondContact O-N 2.81Å; V360-A510 WeakPolarHBondContact CA-O 3.37Å; G361-A510 PolarHBondContact N-O 2.97Å; K367-A510 WeakPolarHBondContact CD-O 3.44Å; K367-A510 WeakPolarHBondContact CE-O 3.3Å; K367-A510 PolarHBondContact NZ-O 3.48Å; V481-A510 HydrophobicContact CG2-CB 4.32Å; D482-A510 HydrophobicContact CB-CB 4.24Å; A510-D512 WeakPolarHBondContact CB-O 3.43Å; A510-V515 HydrophobicContact CB-CB 4.11Å; A510-V515 HydrophobicContact CB-CG1 4.15Å; A510-V515 HydrophobicContact CB-CG2 3.89Å
511	S	91.2	Very high	85.3	Confident	22 Å²	22	44.4 Å²	44.4	15%	0.154	23%	0.233	C	C	.	.	S	Bend	trans	-98.3	-43.8	168.9	-49	0	0	0	0	111	G361 H363 K367 D482	G361-S511 VanDerWaalsContact O-CA 3.24Å; G361-S511 WeakPolarHBondContact O-CA 3.48Å; H363-S511 PolarHBondContact CE1-OG 2.92Å; K367-S511 PolarHBondContact NZ-OG 3.46Å; D482-S511 WeakPolarHBondContact OD2-CA 3.23Å; D482-S511 WeakPolarHBondContact OD2-CB 3.27Å; D482-S511 PolarHBondContact OD2-N 3.06Å
512	D	88	Confident	85.5	Confident	80 Å²	80	43.4 Å²	43.4	43%	0.428	23%	0.233	S	C	.	.	S	Bend	trans	-72.4	139.2	168.8	-179.7	13.9	0	0	0	112.3	D482 A510 S514	D482-D512 HydrophobicContact CB-CB 4.08Å; D482-D512 PolarHBondContact OD2-N 2.87Å; A510-D512 WeakPolarHBondContact CB-O 3.43Å; D512-S514 PolarHBondContact OD1-N 3.37Å; D512-S514 VanDerWaalsContact OD2-CB 3.26Å; D512-S514 WeakPolarHBondContact OD2-CB 3.49Å; D512-S514 PolarHBondContact OD2-OG 2.78Å
513	S	86.6	Confident	86.1	Confident	53 Å²	53	44.2 Å²	44.2	37%	0.371	24%	0.241	S	C	.	.	S	Bend	trans	-83.7	-16.5	175.7	-165.1	0	0	0	0	114	V515 V516	S513-V515 PolarHBondContact O-N 3.14Å; S513-V515 VanDerWaalsContact O-N 3.12Å; S513-V516 WeakPolarHBondContact O-CB 3.36Å; S513-V516 WeakPolarHBondContact O-CG2 3.43Å; S513-V516 PolarHBondContact O-N 3.06Å; S513-V516 VanDerWaalsContact O-N 3.12Å
514	S	86.7	Confident	86.7	Confident	55 Å²	55	41.3 Å²	41.3	39%	0.385	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-58.4	-26.9	178	83.4	0	0	0	0	112.6	D512 V516 H517	D512-S514 PolarHBondContact OD1-N 3.37Å; D512-S514 VanDerWaalsContact OD2-CB 3.26Å; D512-S514 WeakPolarHBondContact OD2-CB 3.49Å; D512-S514 PolarHBondContact OD2-OG 2.78Å; S514-V516 PolarHBondContact O-N 2.97Å; S514-H517 PolarHBondContact O-CD2 3.21Å; S514-H517 VanDerWaalsContact O-CD2 3.27Å; S514-H517 PolarHBondContact O-N 3.08Å
515	V	86.8	Confident	87.2	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.012	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-49.2	-30.9	174.1	170.7	0	0	0	0	113.4	L358 V481 D482 W492 A510 S513 H517 N518	L358-V515 HydrophobicContact CD1-CG1 4.38Å; L358-V515 HydrophobicContact CD2-CG1 4.24Å; V481-V515 HydrophobicContact CG2-CG1 3.86Å; D482-V515 HydrophobicContact CB-CG2 3.61Å; W492-V515 HydrophobicContact CH2-CG1 3.79Å; W492-V515 HydrophobicContact CZ2-CG1 4.3Å; A510-V515 HydrophobicContact CB-CB 4.11Å; A510-V515 HydrophobicContact CB-CG1 4.15Å; A510-V515 HydrophobicContact CB-CG2 3.89Å; S513-V515 PolarHBondContact O-N 3.14Å; S513-V515 VanDerWaalsContact O-N 3.12Å; V515-H517 PolarHBondContact O-N 2.75Å; V515-N518 WeakPolarHBondContact O-CB 3.12Å; V515-N518 PolarHBondContact O-N 2.96Å
516	V	85.4	Confident	87.2	Confident	40 Å²	40	42.9 Å²	42.9	24%	0.242	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-55	-35.7	178.3	173.3	0	0	0	0	111.8	L358 V360 S513 S514 N518 L519 I525	L358-V516 HydrophobicContact CD2-CG2 3.97Å; V360-V516 HydrophobicContact CG2-CG2 4.3Å; S513-V516 WeakPolarHBondContact O-CB 3.36Å; S513-V516 WeakPolarHBondContact O-CG2 3.43Å; S513-V516 PolarHBondContact O-N 3.06Å; S513-V516 VanDerWaalsContact O-N 3.12Å; S514-V516 PolarHBondContact O-N 2.97Å; V516-N518 VanDerWaalsContact C-N 3.29Å; V516-N518 PolarHBondContact O-N 3.45Å; V516-L519 PolarHBondContact O-N 2.95Å; V516-I525 HydrophobicContact CB-CD1 4.47Å; V516-I525 HydrophobicContact CG1-CD1 3.64Å; V516-I525 HydrophobicContact CG2-CD1 4.01Å; V516-I525 HydrophobicContact CG2-CG2 4.39Å
517	H	84.9	Confident	87.1	Confident	167 Å²	167	47.5 Å²	47.5	77%	0.773	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-72.7	-19.8	178.5	-54.8	-64.5	0	0	0	113.6	S514 V515	S514-H517 PolarHBondContact O-CD2 3.21Å; S514-H517 VanDerWaalsContact O-CD2 3.27Å; S514-H517 PolarHBondContact O-N 3.08Å; V515-H517 PolarHBondContact O-N 2.75Å
518	N	83.6	Confident	86.7	Confident	78 Å²	78	47.8 Å²	47.8	42%	0.417	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-89.8	-3.1	179.8	-66.3	-61.1	0	0	0	113.5	W492 V515 V516 P520	W492-N518 HydrophobicContact CD2-CB 3.94Å; W492-N518 HydrophobicContact CE3-CB 4.34Å; W492-N518 HydrophobicContact CG-CB 4.47Å; W492-N518 HydrophobicContact CH2-CB 4.32Å; W492-N518 HydrophobicContact CZ2-CB 3.86Å; V515-N518 WeakPolarHBondContact O-CB 3.12Å; V515-N518 PolarHBondContact O-N 2.96Å; V516-N518 VanDerWaalsContact C-N 3.29Å; V516-N518 PolarHBondContact O-N 3.45Å; N518-P520 WeakPolarHBondContact O-CD 3.36Å
519	L	82.9	Confident	86.2	Confident	30 Å²	30	52 Å²	52	16%	0.157	29%	0.289	C	S	.	.			trans	-67.3	117.3	-178.1	-72.1	174	0	0	0	111.7	L358 L508 V516 V521 A523 I525	L358-L519 HydrophobicContact CD2-CD1 3.96Å; L358-L519 HydrophobicContact CD2-CD2 4.34Å; L358-L519 HydrophobicContact CD2-CG 4.43Å; L508-L519 HydrophobicContact CD1-CD2 3.89Å; V516-L519 PolarHBondContact O-N 2.95Å; L519-V521 PolarHBondContact O-N 2.93Å; L519-A523 HydrophobicContact CD1-CB 3.86Å; L519-A523 HydrophobicContact CD2-CB 4.44Å; L519-I525 HydrophobicContact CD1-CD1 4.37Å
520	P	75.2	Confident	85.6	Confident	49 Å²	49	53.3 Å²	53.3	32%	0.318	30%	0.298	S	S	.	.	S	Bend	trans	-79	-5.4	-175.4	32.4	-36.7	0	0	0	114.2	L499 N518	L499-P520 HydrophobicContact CD1-CG 4.3Å; N518-P520 WeakPolarHBondContact O-CD 3.36Å
521	V	75.8	Confident	85.1	Confident	38 Å²	38	53.9 Å²	53.9	23%	0.23	30%	0.302	C	S	.	.	S	Bend	trans	-148.6	140.6	-178.8	-177.2	0	0	0	0	107.1	L499 L519 A523	L499-V521 HydrophobicContact CB-CG2 4Å; L499-V521 HydrophobicContact CD1-CB 4.26Å; L499-V521 HydrophobicContact CD1-CG2 4.24Å; L519-V521 PolarHBondContact O-N 2.93Å; V521-A523 PolarHBondContact O-N 2.82Å; V521-A523 VanDerWaalsContact O-N 3.16Å
522	P	79.4	Confident	84.9	Confident	100 Å²	100	55.3 Å²	55.3	65%	0.649	31%	0.313	S	S	*	.			trans	-52.1	122.1	175	-28.3	35.5	0	0	0	112.1	S354	S354-P522 WeakPolarHBondContact CB-O 3.33Å; S354-P522 PolarHBondContact OG-O 2.89Å
523	A	85.7	Confident	84.8	Confident	22 Å²	22	54.6 Å²	54.6	18%	0.182	31%	0.308	C	S	.	.			trans	-106.2	158.8	177.2	0	0	0	0	0	110.9	S354 A356 L519 V521	S354-A523 WeakPolarHBondContact OG-CA 3.43Å; A356-A523 HydrophobicContact CB-CB 3.72Å; L519-A523 HydrophobicContact CD1-CB 3.86Å; L519-A523 HydrophobicContact CD2-CB 4.44Å; V521-A523 PolarHBondContact O-N 2.82Å; V521-A523 VanDerWaalsContact O-N 3.16Å
524	Y	89.8	Confident	84.8	Confident	100 Å²	100	59.3 Å²	59.3	39%	0.392	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	136.5	155.6	-68.3	-72.1	0	0	0	108.4	W235 A356 F357 L358	W235-Y524 AromaticContact CD1-CD2 3.69Å; W235-Y524 AromaticContact CD1-CE2 3.48Å; W235-Y524 VanDerWaalsContact CD1-CE2 3.48Å; W235-Y524 HydrophobicContact CG-CD2 4.47Å; W235-Y524 AromaticContact NE1-CD2 3.62Å; W235-Y524 AromaticContact NE1-CE2 3.54Å; A356-Y524 PolarHBondContact O-N 3.37Å; A356-Y524 VanDerWaalsContact O-N 3.08Å; F357-Y524 CarbonylContact C-O 3.59Å; F357-Y524 WeakPolarHBondContact CA-O 3.38Å; F357-Y524 VanDerWaalsContact CD2-CB 3.47Å; F357-Y524 HydrophobicContact CD2-CD2 4.12Å; F357-Y524 HydrophobicContact CD2-CG 4.09Å; F357-Y524 HydrophobicContact CE2-CD2 4.42Å; F357-Y524 HydrophobicContact CE2-CG 4.08Å; L358-Y524 PolarHBondContact N-O 3.17Å
525	I	89.2	Confident	84.9	Confident	61 Å²	61	58 Å²	58	31%	0.313	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.6	-178.4	-53.7	169.4	0	0	0	108.7	L358 V360 V516 L519 H527	L358-I525 CarbonylContact O-C 3.59Å; L358-I525 WeakPolarHBondContact O-CA 3.39Å; V360-I525 HydrophobicContact CG2-CG2 4.25Å; V516-I525 HydrophobicContact CB-CD1 4.47Å; V516-I525 HydrophobicContact CG1-CD1 3.64Å; V516-I525 HydrophobicContact CG2-CD1 4.01Å; V516-I525 HydrophobicContact CG2-CG2 4.39Å; L519-I525 HydrophobicContact CD1-CD1 4.37Å; I525-H527 WeakPolarHBondContact CG2-NE2 3.27Å
526	C	89.1	Confident	85.1	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.007	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	116.7	174.5	170.3	0	0	0	0	108.7	S228 F357 L358 L359 V360 F528	S228-C526 WeakPolarHBondContact CB-SG 3.37Å; F357-C526 HydrophobicContact CE1-CB 3.73Å; L358-C526 PolarHBondContact O-N 3.29Å; L359-C526 WeakPolarHBondContact CA-O 3.49Å; V360-C526 PolarHBondContact N-O 2.64Å; C526-F528 WeakPolarHBondContact SG-CE2 3.35Å
527	H	88	Confident	85.4	Confident	98 Å²	98	56.3 Å²	56.3	45%	0.454	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	128.1	171.6	-62.1	-88.1	0	0	0	109.5	V360 I525	V360-H527 CarbonylContact O-C 3.6Å; V360-H527 WeakPolarHBondContact O-CA 3.29Å; I525-H527 WeakPolarHBondContact CG2-NE2 3.27Å
528	F	88.1	Confident	85.7	Confident	7 Å²	7	48.3 Å²	48.3	3%	0.031	27%	0.266	C	S	.	.			trans	-95	127.5	173.8	-85	-116.8	0	0	0	109.4	F222 I229 L359 V360 P362 T365 K367 L370 C526	F222-F528 AromaticContact CE1-CE1 3.99Å; F222-F528 HydrophobicContact CE1-CE1 3.99Å; F222-F528 AromaticContact CZ-CE1 3.95Å; F222-F528 HydrophobicContact CZ-CE1 3.95Å; I229-F528 HydrophobicContact CD1-CZ 4.44Å; I229-F528 HydrophobicContact CG1-CZ 4.36Å; L359-F528 HydrophobicContact CB-CD2 4.37Å; L359-F528 HydrophobicContact CB-CE2 4.03Å; L359-F528 HydrophobicContact CD2-CE2 3.52Å; L359-F528 HydrophobicContact CD2-CZ 3.73Å; L359-F528 HydrophobicContact CG-CE2 3.77Å; L359-F528 HydrophobicContact CG-CZ 4.47Å; V360-F528 PolarHBondContact O-N 3.46Å; P362-F528 WeakPolarHBondContact CD-O 3.49Å; T365-F528 WeakPolarHBondContact O-CD1 3.45Å; K367-F528 HydrophobicContact CG-CB 4.48Å; K367-F528 HydrophobicContact CG-CD1 4.16Å; K367-F528 HydrophobicContact CG-CD2 4.33Å; K367-F528 HydrophobicContact CG-CE1 4.49Å; K367-F528 HydrophobicContact CG-CG 4.07Å; L370-F528 HydrophobicContact CD2-CE1 4.45Å; L370-F528 HydrophobicContact CD2-CZ 3.7Å; C526-F528 WeakPolarHBondContact SG-CE2 3.35Å
529	T	83.7	Confident	86.2	Confident	89 Å²	89	45.2 Å²	45.2	55%	0.546	25%	0.248	S	C	.	.			trans	-91.8	176.7	164.5	56	0	0	0	0	110.3	N224 T365	N224-T529 PolarHBondContact ND2-O 3.08Å; T365-T529 WeakPolarHBondContact CG2-O 3.33Å
530	S	83.5	Confident	86.6	Confident	28 Å²	28	43.8 Å²	43.8	20%	0.196	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-56.3	160.4	155.1	-56.3	0	0	0	0	111	E576 H577 C578	S530-E576 PolarHBondContact OG-O 3.11Å; S530-E576 VanDerWaalsContact OG-O 3.06Å; S530-H577 WeakPolarHBondContact OG-CA 3.45Å; S530-H577 PolarHBondContact OG-ND1 3.27Å; S530-C578 PolarHBondContact OG-N 2.62Å
531	A	84.8	Confident	87.5	Confident	11 Å²	11	42 Å²	42	9%	0.091	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-77	149.6	161.9	0	0	0	0	0	110.1	N224 V536 L580	N224-A531 HydrophobicContact CB-CB 4.45Å; A531-V536 HydrophobicContact CB-CG2 3.81Å; A531-L580 HydrophobicContact CB-CD1 4.5Å
532	S	85.6	Confident	88.3	Confident	53 Å²	53	40.2 Å²	40.2	37%	0.371	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-60.7	140.8	175.8	175.2	0	0	0	0	110.9	E534 L535 V536	S532-E534 PolarHBondContact O-N 3.24Å; S532-E534 PolarHBondContact OG-N 2.96Å; S532-E534 PolarHBondContact OG-OE2 3.32Å; S532-E534 VanDerWaalsContact OG-OE2 3.11Å; S532-L535 PolarHBondContact O-N 3.24Å; S532-V536 WeakPolarHBondContact O-CG2 3.4Å; S532-V536 PolarHBondContact O-N 3.42Å
533	L	86.6	Confident	88.8	Confident	65 Å²	65	35.4 Å²	35.4	34%	0.34	19%	0.186	S	C	.	.	H	α-helix	trans	-56.3	-31.4	175.2	-61.8	-175.9	0	0	0	112.2	L535 V536 V537 I560	L533-L535 PolarHBondContact O-N 3.49Å; L533-V536 PolarHBondContact O-N 3.01Å; L533-V537 WeakPolarHBondContact O-CG2 3.5Å; L533-V537 PolarHBondContact O-N 3.36Å; L533-I560 HydrophobicContact CD2-CG2 3.74Å
534	E	86.1	Confident	89.1	Confident	151 Å²	151	34.4 Å²	34.4	71%	0.706	18%	0.177	S	C	*	.	H	α-helix	trans	-59.8	-25	174	-57.6	171.7	130.4	0	0	113.4	S532 P538	S532-E534 PolarHBondContact O-N 3.24Å; S532-E534 PolarHBondContact OG-N 2.96Å; S532-E534 PolarHBondContact OG-OE2 3.32Å; S532-E534 VanDerWaalsContact OG-OE2 3.11Å; E534-P538 VanDerWaalsContact O-CD 3.22Å; E534-P538 WeakPolarHBondContact O-CD 3.17Å; E534-P538 WeakPolarHBondContact O-CG 3.45Å
535	L	88.9	Confident	89.1	Confident	28 Å²	28	29.9 Å²	29.9	15%	0.147	16%	0.16	C	C	.	.	H	α-helix	trans	-98.2	-32.6	176	-57	179.8	0	0	0	111.8	F178 L223 S532 L533 Y539	F178-L535 HydrophobicContact CD2-CB 4.49Å; F178-L535 HydrophobicContact CD2-CD2 3.85Å; F178-L535 HydrophobicContact CE2-CB 4.19Å; F178-L535 HydrophobicContact CE2-CD2 4.18Å; F178-L535 VanDerWaalsContact CE2-O 3.3Å; F178-L535 WeakPolarHBondContact CE2-O 3.33Å; L223-L535 WeakPolarHBondContact O-CD1 3.45Å; S532-L535 PolarHBondContact O-N 3.24Å; L533-L535 PolarHBondContact O-N 3.49Å; L535-Y539 VanDerWaalsContact O-CB 3.24Å; L535-Y539 WeakPolarHBondContact O-CB 3.33Å; L535-Y539 PolarHBondContact O-N 2.93Å
536	V	90.5	Very high	89.2	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-73.6	-44.6	-177.8	179.7	0	0	0	0	112	A531 S532 L533 Y539 I540 I560 L580 L583	A531-V536 HydrophobicContact CB-CG2 3.81Å; S532-V536 WeakPolarHBondContact O-CG2 3.4Å; S532-V536 PolarHBondContact O-N 3.42Å; L533-V536 PolarHBondContact O-N 3.01Å; V536-Y539 PolarHBondContact O-N 3.41Å; V536-I540 HydrophobicContact CG1-CG2 4.42Å; V536-I540 PolarHBondContact O-N 3.4Å; V536-I560 HydrophobicContact CG1-CD1 3.87Å; V536-I560 HydrophobicContact CG1-CG1 4.41Å; V536-L580 HydrophobicContact CG1-CD2 3.9Å; V536-L580 HydrophobicContact CG2-CD2 3.85Å; V536-L583 HydrophobicContact CG1-CD2 3.39Å
537	V	92.2	Very high	89.1	Confident	6 Å²	6	30 Å²	30	4%	0.036	16%	0.16	C	C	.	.	H	α-helix	trans	-59.8	-54.2	-178.8	174.9	0	0	0	0	112.6	L533 Y539 I540 R541 A556 I560	L533-V537 WeakPolarHBondContact O-CG2 3.5Å; L533-V537 PolarHBondContact O-N 3.36Å; V537-Y539 VanDerWaalsContact C-N 3.3Å; V537-Y539 PolarHBondContact O-N 3.45Å; V537-I540 WeakPolarHBondContact O-CG1 3.49Å; V537-I540 PolarHBondContact O-N 3.48Å; V537-R541 VanDerWaalsContact O-CG 3.28Å; V537-R541 WeakPolarHBondContact O-CG 3.46Å; V537-R541 PolarHBondContact O-N 3.43Å; V537-A556 HydrophobicContact CG1-CB 4.18Å; V537-I560 HydrophobicContact CG2-CD1 3.67Å
538	P	92.1	Very high	89.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61	-38.1	175	20.1	-30.7	0	0	0	112.4	I171 H175 F178 E534 R541 V542	I171-P538 HydrophobicContact CG2-CB 4.48Å; H175-P538 HydrophobicContact CB-CB 3.98Å; H175-P538 HydrophobicContact CB-CG 4.22Å; F178-P538 HydrophobicContact CB-CB 4.05Å; F178-P538 HydrophobicContact CB-CG 3.92Å; F178-P538 HydrophobicContact CD1-CB 3.92Å; F178-P538 HydrophobicContact CD1-CG 4.22Å; F178-P538 HydrophobicContact CD2-CB 4.2Å; F178-P538 HydrophobicContact CD2-CG 3.58Å; F178-P538 HydrophobicContact CE1-CB 4.41Å; F178-P538 HydrophobicContact CE2-CG 4.1Å; F178-P538 HydrophobicContact CG-CB 3.79Å; F178-P538 HydrophobicContact CG-CG 3.64Å; E534-P538 VanDerWaalsContact O-CD 3.22Å; E534-P538 WeakPolarHBondContact O-CD 3.17Å; E534-P538 WeakPolarHBondContact O-CG 3.45Å; P538-R541 PolarHBondContact O-N 3.22Å; P538-V542 WeakPolarHBondContact O-CB 3.42Å; P538-V542 VanDerWaalsContact O-CG2 3.25Å; P538-V542 WeakPolarHBondContact O-CG2 3.42Å; P538-V542 PolarHBondContact O-N 3.16Å
539	Y	92.6	Very high	89	Confident	13 Å²	13	27.9 Å²	27.9	5%	0.051	16%	0.157	C	C	.	.	H	α-helix	trans	-59.6	-49.5	178.8	175.4	-93.5	0	0	0	112.7	F187 L223 L535 V536 V537 R541 V542 L543 I584	F187-Y539 HydrophobicContact CE1-CE2 4.2Å; F187-Y539 HydrophobicContact CZ-CD2 4.01Å; F187-Y539 AromaticContact CZ-CE2 3.54Å; F187-Y539 HydrophobicContact CZ-CE2 3.54Å; L223-Y539 HydrophobicContact CD1-CD1 3.73Å; L223-Y539 HydrophobicContact CD1-CD2 3.71Å; L223-Y539 HydrophobicContact CD1-CE1 3.89Å; L223-Y539 HydrophobicContact CD1-CE2 3.84Å; L223-Y539 HydrophobicContact CD1-CG 3.63Å; L223-Y539 HydrophobicContact CD2-CD2 3.65Å; L223-Y539 HydrophobicContact CD2-CE2 4.32Å; L223-Y539 HydrophobicContact CD2-CG 3.9Å; L223-Y539 HydrophobicContact CG-CD2 3.91Å; L223-Y539 HydrophobicContact CG-CE2 4.1Å; L223-Y539 HydrophobicContact CG-CG 4.23Å; L535-Y539 VanDerWaalsContact O-CB 3.24Å; L535-Y539 WeakPolarHBondContact O-CB 3.33Å; L535-Y539 PolarHBondContact O-N 2.93Å; V536-Y539 PolarHBondContact O-N 3.41Å; V537-Y539 VanDerWaalsContact C-N 3.3Å; V537-Y539 PolarHBondContact O-N 3.45Å; Y539-R541 VanDerWaalsContact C-N 3.33Å; Y539-R541 PolarHBondContact O-N 3.21Å; Y539-V542 PolarHBondContact O-N 3.22Å; Y539-L543 HydrophobicContact CE1-CD1 3.84Å; Y539-L543 WeakPolarHBondContact O-CB 3.41Å; Y539-L543 PolarHBondContact O-N 2.83Å; Y539-I584 HydrophobicContact CE1-CD1 4.15Å
540	I	92.1	Very high	89.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-69.3	-30.8	-179.2	63.1	173.2	0	0	0	113	V536 V537 L543 C544 L551 A556 I560 L583 L587	V536-I540 HydrophobicContact CG1-CG2 4.42Å; V536-I540 PolarHBondContact O-N 3.4Å; V537-I540 WeakPolarHBondContact O-CG1 3.49Å; V537-I540 PolarHBondContact O-N 3.48Å; I540-L543 PolarHBondContact O-N 3.15Å; I540-C544 PolarHBondContact O-N 3.01Å; I540-C544 PolarHBondContact O-SG 2.84Å; I540-C544 VanDerWaalsContact O-SG 3.34Å; I540-L551 HydrophobicContact CD1-CD2 4.07Å; I540-L551 HydrophobicContact CG1-CD2 4.01Å; I540-A556 HydrophobicContact CD1-CB 3.98Å; I540-A556 HydrophobicContact CG1-CB 4.4Å; I540-I560 HydrophobicContact CD1-CD1 3.99Å; I540-I560 HydrophobicContact CD1-CG1 4.16Å; I540-L583 HydrophobicContact CD1-CD1 4.21Å; I540-L583 HydrophobicContact CD1-CD2 4.38Å; I540-L583 HydrophobicContact CG2-CD2 3.69Å; I540-L583 HydrophobicContact CG2-CG 4Å; I540-L587 HydrophobicContact CB-CD2 3.81Å; I540-L587 HydrophobicContact CG2-CD2 4.17Å
541	R	93.4	Very high	89.4	Confident	11 Å²	11	24.5 Å²	24.5	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-67.4	-43	173.7	-66.4	174.4	70.6	-153.5	3.8	111.6	I171 D174 H175 V537 P538 Y539 L543 L545 L551 V553 A556	I171-R541 HydrophobicContact CD1-CB 4.16Å; I171-R541 HydrophobicContact CG1-CB 4.49Å; D174-R541 IonicContact OD2-CZ 2.7Å; D174-R541 IonicContact OD2-NH1 3.26Å; D174-R541 PolarHBondContact OD2-NH1 3.25Å; D174-R541 IonicContact OD2-NH2 3.54Å; D174-R541 PolarHBondContact OD2-NH2 2.99Å; H175-R541 PolarHBondContact CD2-NH1 2.89Å; H175-R541 VanDerWaalsContact CD2-NH1 3.32Å; H175-R541 PolarHBondContact NE2-NH1 3.46Å; V537-R541 VanDerWaalsContact O-CG 3.28Å; V537-R541 WeakPolarHBondContact O-CG 3.46Å; V537-R541 PolarHBondContact O-N 3.43Å; P538-R541 PolarHBondContact O-N 3.22Å; Y539-R541 VanDerWaalsContact C-N 3.33Å; Y539-R541 PolarHBondContact O-N 3.21Å; R541-L543 VanDerWaalsContact C-N 3.34Å; R541-L545 WeakPolarHBondContact O-CB 3.38Å; R541-L545 PolarHBondContact O-N 2.85Å; R541-L551 HydrophobicContact CG-CB 4.26Å; R541-L551 HydrophobicContact CG-CD2 4.03Å; R541-L551 HydrophobicContact CG-CG 4.32Å; R541-L551 WeakPolarHBondContact CG-O 3.5Å; R541-L551 PolarHBondContact NE-O 3.18Å; R541-V553 VanDerWaalsContact CZ-CG2 3.47Å; R541-V553 VanDerWaalsContact NH1-CG2 3.28Å; R541-A556 HydrophobicContact CG-CB 4.22Å
542	V	92.1	Very high	89.4	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.6	-33.8	175.1	174	0	0	0	0	112	I171 I180 C183 F184 F187 P538 Y539 N546	I171-V542 HydrophobicContact CD1-CG2 4.33Å; I171-V542 HydrophobicContact CG2-CG2 4.13Å; I180-V542 HydrophobicContact CG1-CG2 4.45Å; I180-V542 HydrophobicContact CG2-CG2 3.83Å; C183-V542 HydrophobicContact CB-CG1 4.26Å; F184-V542 HydrophobicContact CB-CG1 3.84Å; F184-V542 HydrophobicContact CD2-CG1 4.01Å; F184-V542 HydrophobicContact CG-CG1 4.44Å; F187-V542 HydrophobicContact CD2-CG1 3.96Å; F187-V542 HydrophobicContact CE2-CG1 3.92Å; P538-V542 WeakPolarHBondContact O-CB 3.42Å; P538-V542 VanDerWaalsContact O-CG2 3.25Å; P538-V542 WeakPolarHBondContact O-CG2 3.42Å; P538-V542 PolarHBondContact O-N 3.16Å; Y539-V542 PolarHBondContact O-N 3.22Å; V542-N546 PolarHBondContact O-N 3.37Å; V542-N546 VanDerWaalsContact O-N 3.1Å
543	L	92	Very high	89.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-66.6	-50.6	175	-163.1	165.2	0	0	0	110.8	F187 W210 Y214 Y539 I540 R541 L545 N546 E547 I584 L587	F187-L543 HydrophobicContact CE2-CB 3.95Å; F187-L543 HydrophobicContact CE2-CG 4.33Å; W210-L543 HydrophobicContact CD2-CD2 4.03Å; W210-L543 HydrophobicContact CE3-CD2 3.33Å; W210-L543 HydrophobicContact CZ3-CD2 3.6Å; Y214-L543 HydrophobicContact CD1-CG 4.32Å; Y214-L543 HydrophobicContact CD2-CD1 3.83Å; Y214-L543 HydrophobicContact CD2-CD2 3.72Å; Y214-L543 HydrophobicContact CD2-CG 3.74Å; Y214-L543 HydrophobicContact CE1-CG 4.39Å; Y214-L543 HydrophobicContact CE2-CD1 4.43Å; Y214-L543 HydrophobicContact CE2-CD2 3.52Å; Y214-L543 HydrophobicContact CE2-CG 3.83Å; Y214-L543 HydrophobicContact CG-CD1 3.94Å; Y214-L543 HydrophobicContact CG-CD2 4.49Å; Y214-L543 HydrophobicContact CG-CG 4.01Å; Y539-L543 HydrophobicContact CE1-CD1 3.84Å; Y539-L543 WeakPolarHBondContact O-CB 3.41Å; Y539-L543 PolarHBondContact O-N 2.83Å; I540-L543 PolarHBondContact O-N 3.15Å; R541-L543 VanDerWaalsContact C-N 3.34Å; L543-L545 VanDerWaalsContact C-N 3.28Å; L543-L545 PolarHBondContact O-N 3.27Å; L543-N546 PolarHBondContact O-N 3.46Å; L543-E547 HydrophobicContact CD2-CG 4.48Å; L543-E547 PolarHBondContact O-N 2.83Å; L543-I584 HydrophobicContact CD1-CD1 4.39Å; L543-I584 HydrophobicContact CD1-CG1 4.15Å; L543-I584 HydrophobicContact CD1-CG2 4.46Å; L543-L587 HydrophobicContact CD2-CD2 4.41Å
544	C	90.9	Very high	89.6	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-55.2	-43.7	173.2	-72.5	0	0	0	0	112.5	I540 N546 E547 G548 Y549 L551 L587	I540-C544 PolarHBondContact O-N 3.01Å; I540-C544 PolarHBondContact O-SG 2.84Å; I540-C544 VanDerWaalsContact O-SG 3.34Å; C544-N546 VanDerWaalsContact C-N 3.29Å; C544-N546 PolarHBondContact O-N 3.39Å; C544-E547 CarbonylContact O-C 3.08Å; C544-E547 WeakPolarHBondContact O-CA 3.45Å; C544-E547 PolarHBondContact O-N 3.38Å; C544-G548 PolarHBondContact O-N 2.83Å; C544-G548 VanDerWaalsContact O-N 3.11Å; C544-Y549 CarbonylContact C-O 3.55Å; C544-Y549 VanDerWaalsContact CB-O 3.3Å; C544-Y549 WeakPolarHBondContact CB-O 3.31Å; C544-Y549 PolarHBondContact O-N 3.27Å; C544-L551 HydrophobicContact CB-CB 4.05Å; C544-L587 VanDerWaalsContact SG-CD1 3.54Å; C544-L587 VanDerWaalsContact SG-CD2 3.55Å; C544-L587 VanDerWaalsContact SG-CG 3.53Å
545	L	90.6	Very high	89.5	Confident	6 Å²	6	23.4 Å²	23.4	3%	0.031	12%	0.124	C	C	.	.	H	α-helix	trans	-66.8	-31.4	-177.5	-171.9	60.2	0	0	0	112.2	T161 C167 L168 I171 F184 R541 L543 E547 G548 Y549	T161-L545 HydrophobicContact CG2-CD1 3.74Å; C167-L545 HydrophobicContact CB-CD1 3.68Å; C167-L545 HydrophobicContact CB-CD2 3.69Å; C167-L545 HydrophobicContact CB-CG 4.38Å; L168-L545 HydrophobicContact CD2-CD2 3.81Å; L168-L545 HydrophobicContact CG-CD2 3.78Å; I171-L545 HydrophobicContact CD1-CD2 3.87Å; F184-L545 HydrophobicContact CE2-CB 4.4Å; F184-L545 HydrophobicContact CE2-CG 4.15Å; R541-L545 WeakPolarHBondContact O-CB 3.38Å; R541-L545 PolarHBondContact O-N 2.85Å; L543-L545 VanDerWaalsContact C-N 3.28Å; L543-L545 PolarHBondContact O-N 3.27Å; L545-E547 PolarHBondContact O-N 3.31Å; L545-G548 PolarHBondContact O-N 3.32Å; L545-Y549 WeakPolarHBondContact CA-O 3.34Å; L545-Y549 PolarHBondContact N-O 2.9Å; L545-Y549 VanDerWaalsContact N-O 3.15Å
546	N	90.1	Very high	89.4	Confident	22 Å²	22	22.1 Å²	22.1	12%	0.118	12%	0.117	C	C	.	.	H	α-helix	trans	-69.1	-22.8	171.9	-172	101.5	0	0	0	112.4	F184 F187 Q188 Y214 V542 L543 C544	F184-N546 HydrophobicContact CD2-CB 4.25Å; F184-N546 HydrophobicContact CE2-CB 4.01Å; F187-N546 HydrophobicContact CB-CB 4.15Å; F187-N546 WeakPolarHBondContact CB-OD1 3.43Å; F187-N546 HydrophobicContact CD2-CB 4.26Å; Q188-N546 PolarHBondContact N-OD1 3.16Å; Y214-N546 PolarHBondContact OH-ND2 3.33Å; V542-N546 PolarHBondContact O-N 3.37Å; V542-N546 VanDerWaalsContact O-N 3.1Å; L543-N546 PolarHBondContact O-N 3.46Å; C544-N546 VanDerWaalsContact C-N 3.29Å; C544-N546 PolarHBondContact O-N 3.39Å
547	E	88.3	Confident	89.3	Confident	41 Å²	41	24.4 Å²	24.4	19%	0.192	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	7.4	175.9	-57.3	-74.7	-126.9	0	0	112.2	W210 K213 Y214 L543 C544 L545 Y549	W210-E547 HydrophobicContact CD2-CG 4.4Å; W210-E547 VanDerWaalsContact CE2-OE1 3.27Å; W210-E547 HydrophobicContact CH2-CB 3.83Å; W210-E547 HydrophobicContact CH2-CG 3.8Å; W210-E547 HydrophobicContact CZ2-CB 3.61Å; W210-E547 HydrophobicContact CZ2-CG 3.46Å; W210-E547 VanDerWaalsContact CZ2-CG 3.46Å; W210-E547 HydrophobicContact CZ3-CG 4.42Å; W210-E547 PolarHBondContact NE1-OE1 2.87Å; K213-E547 WeakPolarHBondContact CE-OE1 3.37Å; K213-E547 IonicContact NZ-OE1 3.57Å; K213-E547 PolarHBondContact NZ-OE1 3.37Å; K213-E547 IonicContact NZ-OE2 3.2Å; K213-E547 PolarHBondContact NZ-OE2 3.16Å; Y214-E547 HydrophobicContact CE2-CG 4.22Å; Y214-E547 WeakPolarHBondContact OH-CG 3.34Å; Y214-E547 PolarHBondContact OH-OE1 2.9Å; Y214-E547 PolarHBondContact OH-OE2 2.91Å; L543-E547 HydrophobicContact CD2-CG 4.48Å; L543-E547 PolarHBondContact O-N 2.83Å; C544-E547 CarbonylContact O-C 3.08Å; C544-E547 WeakPolarHBondContact O-CA 3.45Å; C544-E547 PolarHBondContact O-N 3.38Å; L545-E547 PolarHBondContact O-N 3.31Å; E547-Y549 HydrophobicContact CB-CD2 4.38Å; E547-Y549 VanDerWaalsContact O-CD2 3.26Å; E547-Y549 WeakPolarHBondContact O-CD2 3.38Å; E547-Y549 WeakPolarHBondContact O-CE2 3.34Å
548	G	86.3	Confident	88.9	Confident	29 Å²	29	27.3 Å²	27.3	30%	0.299	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	11.2	173.7	0	0	0	0	0	116	K160 T161 C544 L545	K160-G548 WeakPolarHBondContact CA-O 3.45Å; T161-G548 PolarHBondContact N-O 3.31Å; T161-G548 PolarHBondContact OG1-O 2.8Å; C544-G548 PolarHBondContact O-N 2.83Å; C544-G548 VanDerWaalsContact O-N 3.11Å; L545-G548 PolarHBondContact O-N 3.32Å
549	Y	87.3	Confident	88.5	Confident	32 Å²	32	27.5 Å²	27.5	13%	0.125	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.8	-176.8	-62.3	-85.6	0	0	0	112.3	L158 K160 C544 L545 E547 C591 S595	L158-Y549 HydrophobicContact CD2-CD1 3.45Å; L158-Y549 VanDerWaalsContact CD2-CD1 3.45Å; L158-Y549 HydrophobicContact CD2-CE1 4.13Å; L158-Y549 HydrophobicContact CD2-CG 3.91Å; L158-Y549 HydrophobicContact CG-CD1 3.96Å; L158-Y549 HydrophobicContact CG-CG 4.35Å; K160-Y549 HydrophobicContact CD-CE1 4.23Å; K160-Y549 WeakPolarHBondContact CE-OH 3.38Å; K160-Y549 HydrophobicContact CG-CD1 3.91Å; K160-Y549 HydrophobicContact CG-CE1 3.55Å; C544-Y549 CarbonylContact C-O 3.55Å; C544-Y549 VanDerWaalsContact CB-O 3.3Å; C544-Y549 WeakPolarHBondContact CB-O 3.31Å; C544-Y549 PolarHBondContact O-N 3.27Å; L545-Y549 WeakPolarHBondContact CA-O 3.34Å; L545-Y549 PolarHBondContact N-O 2.9Å; L545-Y549 VanDerWaalsContact N-O 3.15Å; E547-Y549 HydrophobicContact CB-CD2 4.38Å; E547-Y549 VanDerWaalsContact O-CD2 3.26Å; E547-Y549 WeakPolarHBondContact O-CD2 3.38Å; E547-Y549 WeakPolarHBondContact O-CE2 3.34Å; Y549-C591 HydrophobicContact CD2-CB 3.78Å; Y549-C591 HydrophobicContact CE2-CB 3.88Å; Y549-C591 HydrophobicContact CG-CB 4.16Å; Y549-C591 PolarHBondContact OH-O 3.22Å; Y549-S595 WeakPolarHBondContact OH-CB 3.41Å
550	N	86.9	Confident	88.2	Confident	46 Å²	46	27 Å²	27	25%	0.246	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	119	168.6	174.4	58.7	0	0	0	109.9	S159 T161	S159-N550 PolarHBondContact N-O 3.26Å; S159-N550 PolarHBondContact O-N 3.03Å; T161-N550 HydrophobicContact CG2-CB 3.51Å
551	L	88	Confident	87.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.			trans	-105.5	122.4	171.5	-175.7	75.1	0	0	0	109.2	L158 I540 R541 C544 T555 A556 L587 F590	L158-L551 HydrophobicContact CD1-CB 4.31Å; L158-L551 HydrophobicContact CD1-CD1 3.94Å; I540-L551 HydrophobicContact CD1-CD2 4.07Å; I540-L551 HydrophobicContact CG1-CD2 4.01Å; R541-L551 HydrophobicContact CG-CB 4.26Å; R541-L551 HydrophobicContact CG-CD2 4.03Å; R541-L551 HydrophobicContact CG-CG 4.32Å; R541-L551 WeakPolarHBondContact CG-O 3.5Å; R541-L551 PolarHBondContact NE-O 3.18Å; C544-L551 HydrophobicContact CB-CB 4.05Å; L551-T555 HydrophobicContact CD1-CG2 3.83Å; L551-A556 HydrophobicContact CD2-CB 3.72Å; L551-A556 HydrophobicContact CG-CB 4.08Å; L551-L587 HydrophobicContact CD2-CD1 3.93Å; L551-F590 HydrophobicContact CD1-CE1 4.46Å
552	D	85.7	Confident	86.9	Confident	44 Å²	44	35.4 Å²	35.4	24%	0.235	19%	0.192	C	C	.	.			trans	-79	166.7	175.9	75.4	-81.2	0	0	0	112.2	Q554 T555 A556	D552-Q554 VanDerWaalsContact C-N 3.34Å; D552-Q554 PolarHBondContact O-N 3.31Å; D552-Q554 VanDerWaalsContact OD2-CA 3.3Å; D552-Q554 WeakPolarHBondContact OD2-CA 3.29Å; D552-Q554 VanDerWaalsContact OD2-CB 3.27Å; D552-Q554 WeakPolarHBondContact OD2-CB 3.33Å; D552-Q554 PolarHBondContact OD2-N 2.81Å; D552-T555 WeakPolarHBondContact OD1-CB 3.37Å; D552-T555 PolarHBondContact OD1-OG1 3.49Å; D552-T555 PolarHBondContact OD2-N 3.37Å; D552-A556 WeakPolarHBondContact O-CB 3.43Å; D552-A556 PolarHBondContact O-N 3.01Å
553	V	88.5	Confident	86.1	Confident	46 Å²	46	35.6 Å²	35.6	28%	0.279	19%	0.193	S	C	.	.	H	α-helix	trans	-66.9	-32.8	-177.2	179.3	0	0	0	0	112.5	R541 N557	R541-V553 VanDerWaalsContact CZ-CG2 3.47Å; R541-V553 VanDerWaalsContact NH1-CG2 3.28Å; V553-N557 WeakPolarHBondContact O-CB 3.46Å; V553-N557 PolarHBondContact O-N 2.94Å; V553-N557 VanDerWaalsContact O-N 3.1Å; V553-N557 PolarHBondContact O-ND2 3.46Å
554	Q	86.3	Confident	85.2	Confident	155 Å²	155	37.4 Å²	37.4	72%	0.724	20%	0.201	S	C	*	.	H	α-helix	trans	-75.2	-48.8	-177	-53.4	-173.4	7.1	0	0	110.4	D552 A556 N557 S558	D552-Q554 VanDerWaalsContact C-N 3.34Å; D552-Q554 PolarHBondContact O-N 3.31Å; D552-Q554 VanDerWaalsContact OD2-CA 3.3Å; D552-Q554 WeakPolarHBondContact OD2-CA 3.29Å; D552-Q554 VanDerWaalsContact OD2-CB 3.27Å; D552-Q554 WeakPolarHBondContact OD2-CB 3.33Å; D552-Q554 PolarHBondContact OD2-N 2.81Å; Q554-A556 VanDerWaalsContact C-N 3.34Å; Q554-A556 PolarHBondContact O-N 3.46Å; Q554-N557 PolarHBondContact O-N 2.89Å; Q554-S558 PolarHBondContact O-N 2.83Å; Q554-S558 PolarHBondContact O-OG 2.94Å; Q554-S558 VanDerWaalsContact O-OG 3.13Å
555	T	84.8	Confident	83.4	Confident	13 Å²	13	41 Å²	41	8%	0.08	23%	0.227	C	C	.	.	H	α-helix	trans	-61.6	-41.2	175.1	-52.8	0	0	0	0	111.5	L551 D552 N557 S558 L559 F590	L551-T555 HydrophobicContact CD1-CG2 3.83Å; D552-T555 WeakPolarHBondContact OD1-CB 3.37Å; D552-T555 PolarHBondContact OD1-OG1 3.49Å; D552-T555 PolarHBondContact OD2-N 3.37Å; T555-N557 PolarHBondContact O-N 3.28Å; T555-S558 PolarHBondContact O-N 3.26Å; T555-L559 WeakPolarHBondContact O-CB 3.49Å; T555-L559 PolarHBondContact O-N 2.85Å; T555-F590 HydrophobicContact CG2-CE1 3.87Å; T555-F590 HydrophobicContact CG2-CZ 4.05Å
556	A	87.6	Confident	81.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-56.3	-46.3	173.3	0	0	0	0	0	112.6	V537 I540 R541 L551 D552 Q554 I560	V537-A556 HydrophobicContact CG1-CB 4.18Å; I540-A556 HydrophobicContact CD1-CB 3.98Å; I540-A556 HydrophobicContact CG1-CB 4.4Å; R541-A556 HydrophobicContact CG-CB 4.22Å; L551-A556 HydrophobicContact CD2-CB 3.72Å; L551-A556 HydrophobicContact CG-CB 4.08Å; D552-A556 WeakPolarHBondContact O-CB 3.43Å; D552-A556 PolarHBondContact O-N 3.01Å; Q554-A556 VanDerWaalsContact C-N 3.34Å; Q554-A556 PolarHBondContact O-N 3.46Å; A556-I560 WeakPolarHBondContact O-CD1 3.49Å; A556-I560 WeakPolarHBondContact O-CG1 3.42Å; A556-I560 PolarHBondContact O-N 3.14Å
557	N	88.4	Confident	78.7	Confident	48 Å²	48	52.3 Å²	52.3	26%	0.257	29%	0.293	S	S	.	.	H	α-helix	trans	-69.8	-36.9	177.5	-83.8	-77.8	0	0	0	112.8	V553 Q554 T555 I560 K561	V553-N557 WeakPolarHBondContact O-CB 3.46Å; V553-N557 PolarHBondContact O-N 2.94Å; V553-N557 VanDerWaalsContact O-N 3.1Å; V553-N557 PolarHBondContact O-ND2 3.46Å; Q554-N557 PolarHBondContact O-N 2.89Å; T555-N557 PolarHBondContact O-N 3.28Å; N557-I560 PolarHBondContact O-N 3Å; N557-K561 VanDerWaalsContact O-CG 3.27Å; N557-K561 WeakPolarHBondContact O-CG 3.24Å; N557-K561 PolarHBondContact O-N 3Å
558	S	83.7	Confident	76.1	Confident	68 Å²	68	58.5 Å²	58.5	48%	0.476	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-40.6	176.9	-65.9	0	0	0	0	112.2	Q554 T555 K561 S562	Q554-S558 PolarHBondContact O-N 2.83Å; Q554-S558 PolarHBondContact O-OG 2.94Å; Q554-S558 VanDerWaalsContact O-OG 3.13Å; T555-S558 PolarHBondContact O-N 3.26Å; S558-K561 PolarHBondContact O-N 3.4Å; S558-S562 PolarHBondContact O-N 3.5Å
559	L	83	Confident	73.4	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.021	35%	0.348	C	S	.	.	H	α-helix	trans	-65.2	-39.4	174.7	-175.2	67.5	0	0	0	112.3	T555 K561 S562 I563 L583 E586 L587	T555-L559 WeakPolarHBondContact O-CB 3.49Å; T555-L559 PolarHBondContact O-N 2.85Å; L559-K561 VanDerWaalsContact C-N 3.32Å; L559-K561 PolarHBondContact O-N 2.79Å; L559-S562 PolarHBondContact O-N 3.39Å; L559-S562 PolarHBondContact O-OG 3.1Å; L559-I563 HydrophobicContact CG-CD1 4.42Å; L559-I563 WeakPolarHBondContact O-CG1 3.44Å; L559-I563 PolarHBondContact O-N 3.12Å; L559-L583 HydrophobicContact CD2-CD1 3.85Å; L559-L583 HydrophobicContact CG-CD1 3.92Å; L559-E586 HydrophobicContact CD1-CB 3.98Å; L559-L587 HydrophobicContact CD2-CB 4.13Å; L559-L587 HydrophobicContact CD2-CD1 3.41Å; L559-L587 VanDerWaalsContact CD2-CD1 3.41Å; L559-L587 HydrophobicContact CD2-CG 4.41Å
560	I	85.6	Confident	70.9	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-64.7	-40.6	175.1	-65.9	163.6	0	0	0	110.5	L533 V536 V537 I540 A556 N557 S562 I563 Q564 L583	L533-I560 HydrophobicContact CD2-CG2 3.74Å; V536-I560 HydrophobicContact CG1-CD1 3.87Å; V536-I560 HydrophobicContact CG1-CG1 4.41Å; V537-I560 HydrophobicContact CG2-CD1 3.67Å; I540-I560 HydrophobicContact CD1-CD1 3.99Å; I540-I560 HydrophobicContact CD1-CG1 4.16Å; A556-I560 WeakPolarHBondContact O-CD1 3.49Å; A556-I560 WeakPolarHBondContact O-CG1 3.42Å; A556-I560 PolarHBondContact O-N 3.14Å; N557-I560 PolarHBondContact O-N 3Å; I560-S562 PolarHBondContact O-N 2.69Å; I560-I563 PolarHBondContact O-N 2.79Å; I560-Q564 HydrophobicContact CG2-CG 4.21Å; I560-Q564 WeakPolarHBondContact O-CG 3.45Å; I560-Q564 PolarHBondContact O-N 2.81Å; I560-L583 HydrophobicContact CG1-CD1 3.94Å; I560-L583 HydrophobicContact CG1-CD2 3.98Å
561	K	83.2	Confident	68.3	Low	142 Å²	142	73 Å²	73	62%	0.617	40%	0.403	S	S	*	.	H	α-helix	trans	-65	-33	177.5	-73.8	169.1	-177.7	177.8	0	114	N557 S558 L559 I563	N557-K561 VanDerWaalsContact O-CG 3.27Å; N557-K561 WeakPolarHBondContact O-CG 3.24Å; N557-K561 PolarHBondContact O-N 3Å; S558-K561 PolarHBondContact O-N 3.4Å; L559-K561 VanDerWaalsContact C-N 3.32Å; L559-K561 PolarHBondContact O-N 2.79Å; K561-I563 VanDerWaalsContact C-N 3.29Å
562	S	75.4	Confident	65.9	Low	47 Å²	47	82.9 Å²	82.9	33%	0.329	45%	0.446	S	S	.	.	H	α-helix	trans	-71.7	-25.6	176.5	65.8	0	0	0	0	112.7	S558 L559 I560	S558-S562 PolarHBondContact O-N 3.5Å; L559-S562 PolarHBondContact O-N 3.39Å; L559-S562 PolarHBondContact O-OG 3.1Å; I560-S562 PolarHBondContact O-N 2.69Å
563	I	74.8	Confident	63.6	Low	4 Å²	4	89 Å²	89	2%	0.021	48%	0.478	C	S	.	.	H	α-helix	trans	-88.3	-35.6	179.9	-62.7	174.3	0	0	0	111.8	L559 I560 K561 S565 R582 L583 E586	L559-I563 HydrophobicContact CG-CD1 4.42Å; L559-I563 WeakPolarHBondContact O-CG1 3.44Å; L559-I563 PolarHBondContact O-N 3.12Å; I560-I563 PolarHBondContact O-N 2.79Å; K561-I563 VanDerWaalsContact C-N 3.29Å; I563-S565 VanDerWaalsContact C-N 3.28Å; I563-S565 PolarHBondContact O-N 3.22Å; I563-S565 PolarHBondContact O-OG 3.23Å; I563-R582 HydrophobicContact CD1-CG 4.43Å; I563-R582 HydrophobicContact CG1-CG 4.47Å; I563-R582 HydrophobicContact CG2-CB 4.17Å; I563-R582 HydrophobicContact CG2-CG 4.01Å; I563-L583 VanDerWaalsContact CD1-CA 3.42Å; I563-L583 HydrophobicContact CD1-CB 3.9Å; I563-L583 HydrophobicContact CD1-CD1 3.69Å; I563-L583 HydrophobicContact CD1-CG 4.41Å; I563-E586 HydrophobicContact CD1-CB 4.06Å; I563-E586 HydrophobicContact CD1-CG 3.49Å; I563-E586 VanDerWaalsContact CD1-CG 3.49Å; I563-E586 HydrophobicContact CG1-CG 3.95Å
564	Q	73.4	Confident	61.3	Low	37 Å²	37	90.1 Å²	90.1	17%	0.173	49%	0.487	C	S	.	.	S	Bend	trans	-63	88.7	169.6	-75.7	-179.5	-42.6	0	0	109.8	I560 E576 C578	I560-Q564 HydrophobicContact CG2-CG 4.21Å; I560-Q564 WeakPolarHBondContact O-CG 3.45Å; I560-Q564 PolarHBondContact O-N 2.81Å; Q564-E576 PolarHBondContact NE2-O 3.28Å; Q564-C578 HydrophobicContact CG-CB 4.41Å
565	S	54.2	Low	59.5	Low	76 Å²	76	88.2 Å²	88.2	53%	0.531	49%	0.491	S	S	.	.			trans	-68.9	119.2	-166.5	-60.6	0	0	0	0	110.5	I563 N567	I563-S565 VanDerWaalsContact C-N 3.28Å; I563-S565 PolarHBondContact O-N 3.22Å; I563-S565 PolarHBondContact O-OG 3.23Å; S565-N567 PolarHBondContact O-N 3.37Å
566	P	45.2	Very low	58.5	Low	119 Å²	119	94.2 Å²	94.2	77%	0.773	52%	0.518	S	S	*	.	S	Bend	trans	-71.7	-20.8	-159.6	23.6	-34.3	0	0	0	115.7
567	N	36.2	Very low	57.9	Low	146 Å²	146	96.6 Å²	96.6	78%	0.781	53%	0.529	S	S	*	.			trans	-159.7	112.3	179.4	-83.2	-71.1	0	0	0	112.5	S565	S565-N567 PolarHBondContact O-N 3.37Å
568	L	34.6	Very low	57.7	Low	172 Å²	172	94.4 Å²	94.4	90%	0.901	52%	0.518	S	S	*	.			trans	-171.5	56.2	147.3	-117.8	150.3	0	0	0	116.3
569	T	29.4	Very low	57.9	Low	121 Å²	121	91.6 Å²	91.6	74%	0.742	50%	0.497	S	S	*	.			trans	-167.8	165.8	142.3	15.1	0	0	0	0	110
570	I	34.1	Very low	58.2	Low	163 Å²	163	92.6 Å²	92.6	84%	0.836	50%	0.503	S	S	*	.	S	Bend	trans	-87.9	-8.6	-166.1	-71.1	171	0	0	0	113.7	K572	I570-K572 PolarHBondContact O-N 3.45Å
571	D	33	Very low	58.4	Low	126 Å²	126	97 Å²	97	67%	0.674	52%	0.519	S	S	*	.			trans	-80.5	118	-177.3	-69	-44.2	0	0	0	112.8	L573	D571-L573 PolarHBondContact O-N 2.88Å
572	K	36.4	Very low	58.6	Low	209 Å²	209	91 Å²	91	91%	0.909	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	30.9	-169.7	-61.7	-178.8	175.1	179.3	0	115.9	I570	I570-K572 PolarHBondContact O-N 3.45Å
573	L	37.9	Very low	59.2	Low	173 Å²	173	88.7 Å²	88.7	91%	0.906	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	-0.1	-172.7	-113.2	79.5	0	0	0	115.5	D571	D571-L573 PolarHBondContact O-N 2.88Å
574	S	40.3	Very low	60	Low	68 Å²	68	89.2 Å²	89.2	48%	0.476	48%	0.479	S	S	.	.			trans	-125.6	20	-165.9	55.6	0	0	0	0	116	E576 H577	S574-E576 PolarHBondContact O-N 3.23Å; S574-H577 PolarHBondContact O-N 3.24Å
575	S	47.6	Very low	60.6	Low	116 Å²	116	90 Å²	90	81%	0.811	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-3.1	-179	52	0	0	0	0	116.1
576	E	64	Low	61.9	Low	139 Å²	139	87.5 Å²	87.5	65%	0.65	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.2	24.3	-176.9	-60.9	-175.9	177.4	0	0	112.9	S530 Q564 S574 C578	S530-E576 PolarHBondContact OG-O 3.11Å; S530-E576 VanDerWaalsContact OG-O 3.06Å; Q564-E576 PolarHBondContact NE2-O 3.28Å; S574-E576 PolarHBondContact O-N 3.23Å; E576-C578 PolarHBondContact O-N 2.86Å
577	H	76.3	Confident	63.9	Low	50 Å²	50	81.8 Å²	81.8	23%	0.231	43%	0.428	C	S	.	.			trans	-71.1	106.9	-179	-174.2	35	0	0	0	113.3	P362 H363 S530 S574	P362-H577 WeakPolarHBondContact CB-CE1 3.41Å; P362-H577 WeakPolarHBondContact CB-NE2 3.47Å; H363-H577 PolarHBondContact O-CE1 3.23Å; H363-H577 PolarHBondContact O-NE2 2.92Å; S530-H577 WeakPolarHBondContact OG-CA 3.45Å; S530-H577 PolarHBondContact OG-ND1 3.27Å; S574-H577 PolarHBondContact O-N 3.24Å
578	C	83.9	Confident	66.3	Low	2 Å²	2	76.6 Å²	76.6	1%	0.014	40%	0.399	C	S	.	.			trans	-98.4	112.2	169.3	-176.5	0	0	0	0	110.2	S530 Q564 E576 L580	S530-C578 PolarHBondContact OG-N 2.62Å; Q564-C578 HydrophobicContact CG-CB 4.41Å; E576-C578 PolarHBondContact O-N 2.86Å; C578-L580 PolarHBondContact O-N 3.19Å
579	D	87.9	Confident	68.3	Low	8 Å²	8	70.9 Å²	70.9	4%	0.043	37%	0.365	C	S	.	.			trans	-79.4	106.4	169.4	-177	-33.5	0	0	0	109.2	G364 R581 R582 L583 S914	G364-D579 VanDerWaalsContact CA-CG 3.42Å; G364-D579 WeakPolarHBondContact CA-OD1 3.44Å; G364-D579 PolarHBondContact N-OD2 2.65Å; D579-R581 VanDerWaalsContact C-N 3.28Å; D579-R581 PolarHBondContact O-N 3.39Å; D579-R581 WeakPolarHBondContact OD1-CA 3.43Å; D579-R581 VanDerWaalsContact OD1-CB 3.24Å; D579-R581 WeakPolarHBondContact OD1-CB 3.46Å; D579-R581 PolarHBondContact OD1-N 3.19Å; D579-R582 HydrophobicContact CB-CB 4.01Å; D579-R582 PolarHBondContact O-N 3.24Å; D579-R582 PolarHBondContact OD1-N 3.11Å; D579-L583 WeakPolarHBondContact O-CB 3.36Å; D579-L583 PolarHBondContact O-N 2.7Å; D579-S914 VanDerWaalsContact OD2-CB 3.31Å; D579-S914 WeakPolarHBondContact OD2-CB 3.37Å; D579-S914 PolarHBondContact OD2-OG 3.44Å
580	L	88.7	Confident	70.5	Confident	26 Å²	26	66.3 Å²	66.3	14%	0.136	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-26.8	179.6	-67.4	175.3	0	0	0	113.7	L223 A531 V536 C578 L583 I584	L223-L580 HydrophobicContact CD1-CD1 4.05Å; A531-L580 HydrophobicContact CB-CD1 4.5Å; V536-L580 HydrophobicContact CG1-CD2 3.9Å; V536-L580 HydrophobicContact CG2-CD2 3.85Å; C578-L580 PolarHBondContact O-N 3.19Å; L580-L583 HydrophobicContact CD2-CD2 4.2Å; L580-I584 WeakPolarHBondContact O-CB 3.41Å; L580-I584 WeakPolarHBondContact O-CD1 3.47Å; L580-I584 WeakPolarHBondContact O-CG1 3.47Å; L580-I584 PolarHBondContact O-N 3.02Å
581	R	90	Very high	72.7	Confident	92 Å²	92	58.6 Å²	58.6	35%	0.347	30%	0.296	S	S	.	.	H	α-helix	trans	-71.4	-46.4	176.4	179	-170.5	-63.5	158.6	1.2	109.9	V211 D579 I584 N585 R912	V211-R581 HydrophobicContact CG1-CG 4.02Å; V211-R581 HydrophobicContact CG2-CG 3.89Å; D579-R581 VanDerWaalsContact C-N 3.28Å; D579-R581 PolarHBondContact O-N 3.39Å; D579-R581 WeakPolarHBondContact OD1-CA 3.43Å; D579-R581 VanDerWaalsContact OD1-CB 3.24Å; D579-R581 WeakPolarHBondContact OD1-CB 3.46Å; D579-R581 PolarHBondContact OD1-N 3.19Å; R581-I584 PolarHBondContact O-N 3.25Å; R581-N585 PolarHBondContact O-N 3.34Å; R581-N585 VanDerWaalsContact O-N 3.12Å; R581-R912 PolarHBondContact NH1-O 3.47Å
582	R	86.4	Confident	74.7	Confident	16 Å²	16	56.1 Å²	56.1	6%	0.06	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-48.6	173.8	-173.9	166.8	165.8	-155	-5.5	109.9	I563 D579 I584 N585 E586 R865 C866	I563-R582 HydrophobicContact CD1-CG 4.43Å; I563-R582 HydrophobicContact CG1-CG 4.47Å; I563-R582 HydrophobicContact CG2-CB 4.17Å; I563-R582 HydrophobicContact CG2-CG 4.01Å; D579-R582 HydrophobicContact CB-CB 4.01Å; D579-R582 PolarHBondContact O-N 3.24Å; D579-R582 PolarHBondContact OD1-N 3.11Å; R582-I584 PolarHBondContact O-N 2.96Å; R582-N585 WeakPolarHBondContact O-CA 3.41Å; R582-N585 WeakPolarHBondContact O-CB 3.36Å; R582-N585 PolarHBondContact O-N 3.34Å; R582-E586 HydrophobicContact CG-CG 4.08Å; R582-E586 WeakPolarHBondContact CG-OE1 3.31Å; R582-E586 IonicContact NE-OE1 2.7Å; R582-E586 PolarHBondContact NE-OE1 3.27Å; R582-E586 VanDerWaalsContact NE-OE1 3.11Å; R582-E586 WeakPolarHBondContact O-CG 3.09Å; R582-E586 PolarHBondContact O-N 3.3Å; R582-R865 PolarHBondContact NH2-O 3.15Å; R582-C866 VanDerWaalsContact CZ-O 3.26Å; R582-C866 PolarHBondContact NE-O 2.98Å; R582-C866 PolarHBondContact NH2-O 2.67Å
583	L	89.1	Confident	76	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.3	-45.3	177.5	-178.8	62.8	0	0	0	113.7	V536 I540 L559 I560 I563 D579 L580 N585 L587	V536-L583 HydrophobicContact CG1-CD2 3.39Å; I540-L583 HydrophobicContact CD1-CD1 4.21Å; I540-L583 HydrophobicContact CD1-CD2 4.38Å; I540-L583 HydrophobicContact CG2-CD2 3.69Å; I540-L583 HydrophobicContact CG2-CG 4Å; L559-L583 HydrophobicContact CD2-CD1 3.85Å; L559-L583 HydrophobicContact CG-CD1 3.92Å; I560-L583 HydrophobicContact CG1-CD1 3.94Å; I560-L583 HydrophobicContact CG1-CD2 3.98Å; I563-L583 VanDerWaalsContact CD1-CA 3.42Å; I563-L583 HydrophobicContact CD1-CB 3.9Å; I563-L583 HydrophobicContact CD1-CD1 3.69Å; I563-L583 HydrophobicContact CD1-CG 4.41Å; D579-L583 WeakPolarHBondContact O-CB 3.36Å; D579-L583 PolarHBondContact O-N 2.7Å; L580-L583 HydrophobicContact CD2-CD2 4.2Å; L583-N585 VanDerWaalsContact C-N 3.35Å; L583-L587 WeakPolarHBondContact O-CB 3.47Å; L583-L587 PolarHBondContact O-N 3.42Å
584	I	90.4	Very high	77.1	Confident	14 Å²	14	41 Å²	41	7%	0.072	22%	0.221	C	C	.	.	H	α-helix	trans	-68	-34.7	177.6	-67.2	165.9	0	0	0	111.7	W210 V211 Y539 L543 L580 R581 R582 Q588	W210-I584 HydrophobicContact CB-CG2 3.42Å; W210-I584 VanDerWaalsContact CB-CG2 3.42Å; V211-I584 HydrophobicContact CG2-CB 3.91Å; V211-I584 HydrophobicContact CG2-CG2 3.79Å; Y539-I584 HydrophobicContact CE1-CD1 4.15Å; L543-I584 HydrophobicContact CD1-CD1 4.39Å; L543-I584 HydrophobicContact CD1-CG1 4.15Å; L543-I584 HydrophobicContact CD1-CG2 4.46Å; L580-I584 WeakPolarHBondContact O-CB 3.41Å; L580-I584 WeakPolarHBondContact O-CD1 3.47Å; L580-I584 WeakPolarHBondContact O-CG1 3.47Å; L580-I584 PolarHBondContact O-N 3.02Å; R581-I584 PolarHBondContact O-N 3.25Å; R582-I584 PolarHBondContact O-N 2.96Å; I584-Q588 WeakPolarHBondContact O-CB 3.41Å; I584-Q588 PolarHBondContact O-N 3.45Å
585	N	85.9	Confident	77.7	Confident	54 Å²	54	39.3 Å²	39.3	29%	0.289	21%	0.21	S	C	.	.	H	α-helix	trans	-68.6	-48.6	175.3	-75.6	-12.8	0	0	0	112.7	V211 R581 R582 L583 L587 Q588 W589	V211-N585 WeakPolarHBondContact CG2-OD1 3.5Å; R581-N585 PolarHBondContact O-N 3.34Å; R581-N585 VanDerWaalsContact O-N 3.12Å; R582-N585 WeakPolarHBondContact O-CA 3.41Å; R582-N585 WeakPolarHBondContact O-CB 3.36Å; R582-N585 PolarHBondContact O-N 3.34Å; L583-N585 VanDerWaalsContact C-N 3.35Å; N585-L587 PolarHBondContact O-N 3.37Å; N585-Q588 PolarHBondContact O-N 3.16Å; N585-W589 PolarHBondContact O-N 2.93Å
586	E	83.1	Confident	77.6	Confident	23 Å²	23	39.7 Å²	39.7	11%	0.107	20%	0.199	C	C	.	.	H	α-helix	trans	-60.9	-37.5	177.2	-53.6	-57.7	178	0	0	110.6	L559 I563 R582 W589 F590 G867	L559-E586 HydrophobicContact CD1-CB 3.98Å; I563-E586 HydrophobicContact CD1-CB 4.06Å; I563-E586 HydrophobicContact CD1-CG 3.49Å; I563-E586 VanDerWaalsContact CD1-CG 3.49Å; I563-E586 HydrophobicContact CG1-CG 3.95Å; R582-E586 HydrophobicContact CG-CG 4.08Å; R582-E586 WeakPolarHBondContact CG-OE1 3.31Å; R582-E586 IonicContact NE-OE1 2.7Å; R582-E586 PolarHBondContact NE-OE1 3.27Å; R582-E586 VanDerWaalsContact NE-OE1 3.11Å; R582-E586 WeakPolarHBondContact O-CG 3.09Å; R582-E586 PolarHBondContact O-N 3.3Å; E586-W589 PolarHBondContact O-N 2.67Å; E586-F590 WeakPolarHBondContact O-CB 3.34Å; E586-F590 PolarHBondContact O-N 3.44Å; E586-G867 WeakPolarHBondContact OE1-CA 3.4Å
587	L	85.8	Confident	76.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-67.8	-41.6	178.2	-165.5	74.5	0	0	0	112.5	W210 I540 L543 C544 L551 L559 L583 N585 W589 F590 C591	W210-L587 HydrophobicContact CZ3-CB 4.35Å; W210-L587 HydrophobicContact CZ3-CD2 4.11Å; W210-L587 HydrophobicContact CZ3-CG 3.97Å; I540-L587 HydrophobicContact CB-CD2 3.81Å; I540-L587 HydrophobicContact CG2-CD2 4.17Å; L543-L587 HydrophobicContact CD2-CD2 4.41Å; C544-L587 VanDerWaalsContact SG-CD1 3.54Å; C544-L587 VanDerWaalsContact SG-CD2 3.55Å; C544-L587 VanDerWaalsContact SG-CG 3.53Å; L551-L587 HydrophobicContact CD2-CD1 3.93Å; L559-L587 HydrophobicContact CD2-CB 4.13Å; L559-L587 HydrophobicContact CD2-CD1 3.41Å; L559-L587 VanDerWaalsContact CD2-CD1 3.41Å; L559-L587 HydrophobicContact CD2-CG 4.41Å; L583-L587 WeakPolarHBondContact O-CB 3.47Å; L583-L587 PolarHBondContact O-N 3.42Å; N585-L587 PolarHBondContact O-N 3.37Å; L587-W589 VanDerWaalsContact C-N 3.31Å; L587-F590 PolarHBondContact O-N 2.76Å; L587-C591 PolarHBondContact O-N 2.74Å; L587-C591 PolarHBondContact O-SG 2.85Å
588	Q	87.8	Confident	74.9	Confident	37 Å²	37	38.9 Å²	38.9	17%	0.173	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-45.5	171.2	180	169.9	6.6	0	0	110.7	W210 I584 N585 T592	W210-Q588 HydrophobicContact CB-CB 4.15Å; W210-Q588 HydrophobicContact CB-CG 4.49Å; W210-Q588 HydrophobicContact CD2-CB 3.46Å; W210-Q588 VanDerWaalsContact CD2-CB 3.46Å; W210-Q588 HydrophobicContact CD2-CG 3.75Å; W210-Q588 HydrophobicContact CE3-CB 3.71Å; W210-Q588 HydrophobicContact CE3-CG 4.45Å; W210-Q588 HydrophobicContact CG-CB 3.66Å; W210-Q588 HydrophobicContact CG-CG 3.73Å; W210-Q588 HydrophobicContact CZ2-CG 4.41Å; W210-Q588 HydrophobicContact CZ3-CB 4.37Å; I584-Q588 WeakPolarHBondContact O-CB 3.41Å; I584-Q588 PolarHBondContact O-N 3.45Å; N585-Q588 PolarHBondContact O-N 3.16Å; Q588-T592 WeakPolarHBondContact O-CB 3.44Å; Q588-T592 PolarHBondContact O-N 3.22Å; Q588-T592 PolarHBondContact O-OG1 3.14Å
589	W	76.7	Confident	72.7	Confident	51 Å²	51	41.3 Å²	41.3	19%	0.193	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-46	179.9	-178.1	80.9	0	0	0	111.9	N585 E586 L587 C591 T592 S593 N871 L879	N585-W589 PolarHBondContact O-N 2.93Å; E586-W589 PolarHBondContact O-N 2.67Å; L587-W589 VanDerWaalsContact C-N 3.31Å; W589-C591 PolarHBondContact O-N 2.88Å; W589-T592 PolarHBondContact O-N 2.82Å; W589-S593 WeakPolarHBondContact O-CB 3.35Å; W589-S593 PolarHBondContact O-N 2.97Å; W589-S593 PolarHBondContact O-OG 3.08Å; W589-N871 HydrophobicContact CZ3-CB 4.2Å; W589-L879 HydrophobicContact CH2-CD1 3.92Å; W589-L879 HydrophobicContact CZ2-CD1 3.56Å; W589-L879 HydrophobicContact CZ2-CD2 3.83Å; W589-L879 HydrophobicContact CZ2-CG 4.33Å
590	F	74.7	Confident	70.2	Confident	26 Å²	26	45.5 Å²	45.5	11%	0.114	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-46.3	177.6	-174.1	-121.7	0	0	0	112.3	L158 L551 T555 E586 L587 T592 S593 A594 N871	L158-F590 HydrophobicContact CB-CE1 4.03Å; L158-F590 HydrophobicContact CB-CZ 4.42Å; L158-F590 HydrophobicContact CD1-CD1 4.27Å; L158-F590 HydrophobicContact CD1-CE1 3.99Å; L158-F590 HydrophobicContact CD2-CD1 4.3Å; L158-F590 HydrophobicContact CD2-CE1 4.36Å; L158-F590 HydrophobicContact CG-CE1 4.36Å; L551-F590 HydrophobicContact CD1-CE1 4.46Å; T555-F590 HydrophobicContact CG2-CE1 3.87Å; T555-F590 HydrophobicContact CG2-CZ 4.05Å; E586-F590 WeakPolarHBondContact O-CB 3.34Å; E586-F590 PolarHBondContact O-N 3.44Å; L587-F590 PolarHBondContact O-N 2.76Å; F590-T592 PolarHBondContact O-N 2.97Å; F590-S593 PolarHBondContact O-N 2.88Å; F590-A594 PolarHBondContact O-N 3.04Å; F590-A594 VanDerWaalsContact O-N 3.13Å; F590-N871 HydrophobicContact CD2-CB 3.84Å; F590-N871 WeakPolarHBondContact CD2-ND2 3.47Å; F590-N871 HydrophobicContact CE2-CB 4Å; F590-N871 VanDerWaalsContact CE2-ND2 3.33Å; F590-N871 WeakPolarHBondContact CE2-ND2 3.43Å
591	C	79.8	Confident	67.6	Low	1 Å²	1	49.8 Å²	49.8	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-67.5	-34.8	177.7	-61.5	0	0	0	0	112.7	L158 W210 Y549 L587 W589	L158-C591 HydrophobicContact CD2-CB 4.17Å; W210-C591 HydrophobicContact CH2-CB 3.64Å; W210-C591 HydrophobicContact CZ2-CB 4.17Å; Y549-C591 HydrophobicContact CD2-CB 3.78Å; Y549-C591 HydrophobicContact CE2-CB 3.88Å; Y549-C591 HydrophobicContact CG-CB 4.16Å; Y549-C591 PolarHBondContact OH-O 3.22Å; L587-C591 PolarHBondContact O-N 2.74Å; L587-C591 PolarHBondContact O-SG 2.85Å; W589-C591 PolarHBondContact O-N 2.88Å
592	T	75.3	Confident	65.2	Low	73 Å²	73	52.6 Å²	52.6	45%	0.448	27%	0.266	S	S	.	.	H	α-helix	trans	-67.6	-43.4	175.5	-53.5	0	0	0	0	110.9	Q588 W589 F590 S595	Q588-T592 WeakPolarHBondContact O-CB 3.44Å; Q588-T592 PolarHBondContact O-N 3.22Å; Q588-T592 PolarHBondContact O-OG1 3.14Å; W589-T592 PolarHBondContact O-N 2.82Å; F590-T592 PolarHBondContact O-N 2.97Å; T592-S595 WeakPolarHBondContact O-CB 3.4Å; T592-S595 PolarHBondContact O-N 2.84Å; T592-S595 PolarHBondContact O-OG 3.42Å
593	S	64.8	Low	62.6	Low	40 Å²	40	58 Å²	58	28%	0.28	29%	0.288	S	S	.	.	H	α-helix	trans	-61.8	-46.8	180	-57.6	0	0	0	0	112.4	W589 F590 S595 H596 E597	W589-S593 WeakPolarHBondContact O-CB 3.35Å; W589-S593 PolarHBondContact O-N 2.97Å; W589-S593 PolarHBondContact O-OG 3.08Å; F590-S593 PolarHBondContact O-N 2.88Å; S593-S595 PolarHBondContact O-N 3.25Å; S593-S595 VanDerWaalsContact O-N 3.12Å; S593-H596 PolarHBondContact O-N 3.14Å; S593-H596 VanDerWaalsContact O-N 3.08Å; S593-E597 PolarHBondContact O-N 3.29Å
594	A	60.4	Low	59.9	Low	24 Å²	24	62 Å²	62	20%	0.198	31%	0.309	C	S	.	.	H	α-helix	trans	-58	-27.9	176.7	0	0	0	0	0	113.3	L158 F590 H596 E597 E598	L158-A594 HydrophobicContact CD2-CB 3.79Å; F590-A594 PolarHBondContact O-N 3.04Å; F590-A594 VanDerWaalsContact O-N 3.13Å; A594-H596 PolarHBondContact O-N 2.95Å; A594-E597 PolarHBondContact O-N 3.44Å; A594-E598 PolarHBondContact O-N 2.83Å
595	S	53.7	Low	57.2	Low	34 Å²	34	67.9 Å²	67.9	24%	0.238	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-32.3	178.4	83.4	0	0	0	0	113.5	Y549 T592 S593 A599	Y549-S595 WeakPolarHBondContact OH-CB 3.41Å; T592-S595 WeakPolarHBondContact O-CB 3.4Å; T592-S595 PolarHBondContact O-N 2.84Å; T592-S595 PolarHBondContact O-OG 3.42Å; S593-S595 PolarHBondContact O-N 3.25Å; S593-S595 VanDerWaalsContact O-N 3.12Å; S595-A599 PolarHBondContact O-N 2.88Å
596	H	45.8	Very low	54.8	Low	123 Å²	123	70.4 Å²	70.4	57%	0.569	35%	0.348	S	S	*	.	H	α-helix	trans	-76.5	-35.9	175.2	-89	-95.4	0	0	0	112.3	S593 A594 E598 A599 N600	S593-H596 PolarHBondContact O-N 3.14Å; S593-H596 VanDerWaalsContact O-N 3.08Å; A594-H596 PolarHBondContact O-N 2.95Å; H596-E598 PolarHBondContact O-N 2.99Å; H596-A599 WeakPolarHBondContact O-CB 3.49Å; H596-A599 PolarHBondContact O-N 3.22Å; H596-N600 PolarHBondContact O-N 2.93Å
597	E	42.9	Very low	52.2	Low	99 Å²	99	73.1 Å²	73.1	46%	0.463	36%	0.36	S	S	.	.	H	α-helix	trans	-59.9	-45.5	174.6	-85.3	-164.8	-137.3	0	0	112.4	S593 A594 A599 N600 R601	S593-E597 PolarHBondContact O-N 3.29Å; A594-E597 PolarHBondContact O-N 3.44Å; E597-A599 VanDerWaalsContact C-N 3.29Å; E597-A599 PolarHBondContact O-N 3.02Å; E597-N600 PolarHBondContact O-N 3.42Å; E597-R601 WeakPolarHBondContact O-CB 3.41Å; E597-R601 VanDerWaalsContact O-CG 3.25Å; E597-R601 WeakPolarHBondContact O-CG 3.22Å; E597-R601 PolarHBondContact O-N 3.24Å; E597-R601 IonicContact OE2-CZ 2.74Å; E597-R601 IonicContact OE2-NE 2.72Å; E597-R601 IonicContact OE2-NH2 3.03Å; E597-R601 PolarHBondContact OE2-NH2 3.35Å
598	E	40.6	Very low	49.5	Very low	74 Å²	74	78 Å²	78	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-62.5	-35.7	176.1	-74.4	-173.7	170	0	0	112.8	K160 A594 H596 K602	K160-E598 VanDerWaalsContact CD-OE2 3.25Å; K160-E598 WeakPolarHBondContact CD-OE2 3.13Å; K160-E598 VanDerWaalsContact CE-OE2 3.24Å; K160-E598 WeakPolarHBondContact CE-OE2 3.04Å; K160-E598 IonicContact NZ-OE2 2.59Å; K160-E598 PolarHBondContact NZ-OE2 3.1Å; A594-E598 PolarHBondContact O-N 2.83Å; H596-E598 PolarHBondContact O-N 2.99Å; E598-K602 PolarHBondContact O-N 3.18Å
599	A	36.4	Very low	46.7	Very low	52 Å²	52	84.7 Å²	84.7	43%	0.43	42%	0.417	S	S	.	.	H	α-helix	trans	-64.6	-46.5	175	0	0	0	0	0	110.6	S595 H596 E597 K602 Y603	S595-A599 PolarHBondContact O-N 2.88Å; H596-A599 WeakPolarHBondContact O-CB 3.49Å; H596-A599 PolarHBondContact O-N 3.22Å; E597-A599 VanDerWaalsContact C-N 3.29Å; E597-A599 PolarHBondContact O-N 3.02Å; A599-K602 PolarHBondContact O-N 3.25Å; A599-Y603 WeakPolarHBondContact O-CB 3.32Å; A599-Y603 PolarHBondContact O-N 3.33Å
600	N	36	Very low	44.5	Very low	96 Å²	96	86.4 Å²	86.4	51%	0.513	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-39.9	176.2	-69	-9.9	0	0	0	112	H596 E597 K602 Y603 N604	H596-N600 PolarHBondContact O-N 2.93Å; E597-N600 PolarHBondContact O-N 3.42Å; N600-K602 PolarHBondContact O-N 3.34Å; N600-Y603 PolarHBondContact O-N 3.47Å; N600-N604 WeakPolarHBondContact O-CB 3.42Å; N600-N604 VanDerWaalsContact O-CG 3.22Å; N600-N604 PolarHBondContact O-N 2.94Å; N600-N604 PolarHBondContact O-ND2 3.21Å
601	R	35.2	Very low	42.2	Very low	117 Å²	117	87.7 Å²	87.7	44%	0.442	44%	0.442	S	S	.	.	H	α-helix	trans	-62.6	-39.8	174.2	-70	175.3	-160.5	-153.7	7.2	111.5	E597 H605	E597-R601 WeakPolarHBondContact O-CB 3.41Å; E597-R601 VanDerWaalsContact O-CG 3.25Å; E597-R601 WeakPolarHBondContact O-CG 3.22Å; E597-R601 PolarHBondContact O-N 3.24Å; E597-R601 IonicContact OE2-CZ 2.74Å; E597-R601 IonicContact OE2-NE 2.72Å; E597-R601 IonicContact OE2-NH2 3.03Å; E597-R601 PolarHBondContact OE2-NH2 3.35Å; R601-H605 PolarHBondContact O-N 3.37Å
602	K	38.7	Very low	39.8	Very low	150 Å²	150	95.8 Å²	95.8	65%	0.652	49%	0.485	S	S	*	.	H	α-helix	trans	-67.3	-42.9	172.5	-80.6	-179.2	175.7	175.8	0	112.6	E598 A599 N600 N604 H605 I606	E598-K602 PolarHBondContact O-N 3.18Å; A599-K602 PolarHBondContact O-N 3.25Å; N600-K602 PolarHBondContact O-N 3.34Å; K602-N604 VanDerWaalsContact C-N 3.29Å; K602-N604 PolarHBondContact O-N 2.78Å; K602-H605 PolarHBondContact O-N 3.13Å; K602-I606 WeakPolarHBondContact O-CG1 3.35Å; K602-I606 PolarHBondContact O-N 3.05Å
603	Y	31.9	Very low	37.5	Very low	130 Å²	130	98.5 Å²	98.5	51%	0.51	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-41	176.2	-150.1	-70.5	0	0	0	110.8	A599 N600 I606 K607	A599-Y603 WeakPolarHBondContact O-CB 3.32Å; A599-Y603 PolarHBondContact O-N 3.33Å; N600-Y603 PolarHBondContact O-N 3.47Å; Y603-I606 PolarHBondContact O-N 2.99Å; Y603-K607 HydrophobicContact CD1-CD 4.34Å; Y603-K607 HydrophobicContact CD1-CG 4.18Å; Y603-K607 HydrophobicContact CE1-CG 4.44Å; Y603-K607 WeakPolarHBondContact O-CG 2.93Å; Y603-K607 PolarHBondContact O-N 3.34Å
604	N	31.1	Very low	35.6	Very low	85 Å²	85	100.2 Å²	100.2	46%	0.455	50%	0.501	S	S	.	.	H	α-helix	trans	-68.5	-33	175.2	-71.2	-14.9	0	0	0	112.9	N600 K602 K607 N608	N600-N604 WeakPolarHBondContact O-CB 3.42Å; N600-N604 VanDerWaalsContact O-CG 3.22Å; N600-N604 PolarHBondContact O-N 2.94Å; N600-N604 PolarHBondContact O-ND2 3.21Å; K602-N604 VanDerWaalsContact C-N 3.29Å; K602-N604 PolarHBondContact O-N 2.78Å; N604-K607 CarbonylContact O-C 3.57Å; N604-K607 PolarHBondContact O-N 2.94Å; N604-N608 PolarHBondContact O-N 3.34Å
605	H	34.4	Very low	34	Very low	136 Å²	136	105.9 Å²	105.9	63%	0.63	53%	0.528	S	S	*	.	H	α-helix	trans	-64.1	-38.4	169.4	-103.3	-78.3	0	0	0	112.6	R601 K602 N608 E609	R601-H605 PolarHBondContact O-N 3.37Å; K602-H605 PolarHBondContact O-N 3.13Å; H605-N608 WeakPolarHBondContact O-CB 3.47Å; H605-N608 PolarHBondContact O-N 3.46Å; H605-E609 PolarHBondContact O-N 3.02Å
606	I	36.3	Very low	32.8	Very low	107 Å²	107	110.4 Å²	110.4	55%	0.549	55%	0.545	S	S	.	.	H	α-helix	trans	-70.9	-33.5	174.4	-64.1	166.2	0	0	0	111	K602 Y603 N608 N610	K602-I606 WeakPolarHBondContact O-CG1 3.35Å; K602-I606 PolarHBondContact O-N 3.05Å; Y603-I606 PolarHBondContact O-N 2.99Å; I606-N608 VanDerWaalsContact C-N 3.31Å; I606-N610 PolarHBondContact O-N 3.46Å; I606-N610 PolarHBondContact O-ND2 2.79Å
607	K	27.7	Very low	32	Very low	81 Å²	81	111.7 Å²	111.7	35%	0.352	55%	0.549	S	S	.	.	H	α-helix	trans	-65.9	-30.5	168.1	-71	-172.1	174.1	-175.8	0	112.5	Y603 N604 E609 N610 S611 L614	Y603-K607 HydrophobicContact CD1-CD 4.34Å; Y603-K607 HydrophobicContact CD1-CG 4.18Å; Y603-K607 HydrophobicContact CE1-CG 4.44Å; Y603-K607 WeakPolarHBondContact O-CG 2.93Å; Y603-K607 PolarHBondContact O-N 3.34Å; N604-K607 CarbonylContact O-C 3.57Å; N604-K607 PolarHBondContact O-N 2.94Å; K607-E609 PolarHBondContact O-N 3.47Å; K607-N610 CarbonylContact O-C 3.59Å; K607-N610 WeakPolarHBondContact O-CA 3.11Å; K607-N610 PolarHBondContact O-N 2.93Å; K607-S611 WeakPolarHBondContact O-CA 3.43Å; K607-S611 PolarHBondContact O-N 2.81Å; K607-L614 HydrophobicContact CB-CD1 4.35Å; K607-L614 HydrophobicContact CD-CD1 3.9Å; K607-L614 HydrophobicContact CG-CD1 3.74Å
608	N	29.2	Very low	31.5	Very low	102 Å²	102	115 Å²	115	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-70.5	-26.1	178.7	-80.9	-14.3	0	0	0	113.7	N604 H605 I606 N610 S611	N604-N608 PolarHBondContact O-N 3.34Å; H605-N608 WeakPolarHBondContact O-CB 3.47Å; H605-N608 PolarHBondContact O-N 3.46Å; I606-N608 VanDerWaalsContact C-N 3.31Å; N608-N610 VanDerWaalsContact C-N 3.35Å; N608-S611 WeakPolarHBondContact O-CB 3.41Å; N608-S611 PolarHBondContact O-OG 3.2Å
609	E	30.3	Very low	31	Very low	178 Å²	178	113.6 Å²	113.6	83%	0.832	56%	0.563	S	S	*	*	H	α-helix	trans	-78.8	-21	167.5	-65.4	-171	150.1	0	0	112.4	H605 K607	H605-E609 PolarHBondContact O-N 3.02Å; K607-E609 PolarHBondContact O-N 3.47Å
610	N	29.8	Very low	31.1	Very low	87 Å²	87	115.5 Å²	115.5	47%	0.465	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99	22.4	171.2	-65.6	-77.4	0	0	0	112.9	I606 K607 N608 L612 I613	I606-N610 PolarHBondContact O-N 3.46Å; I606-N610 PolarHBondContact O-ND2 2.79Å; K607-N610 CarbonylContact O-C 3.59Å; K607-N610 WeakPolarHBondContact O-CA 3.11Å; K607-N610 PolarHBondContact O-N 2.93Å; N608-N610 VanDerWaalsContact C-N 3.35Å; N610-L612 PolarHBondContact O-N 3.13Å; N610-I613 PolarHBondContact O-N 3.15Å; N610-I613 VanDerWaalsContact O-N 3.08Å
611	S	26.9	Very low	31	Very low	52 Å²	52	115.6 Å²	115.6	36%	0.364	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.4	-2.3	-168.7	48.6	0	0	0	0	115.5	K607 N608 N615	K607-S611 WeakPolarHBondContact O-CA 3.43Å; K607-S611 PolarHBondContact O-N 2.81Å; N608-S611 WeakPolarHBondContact O-CB 3.41Å; N608-S611 PolarHBondContact O-OG 3.2Å; S611-N615 PolarHBondContact O-ND2 2.97Å; S611-N615 VanDerWaalsContact O-ND2 3.08Å
612	L	28.1	Very low	31.1	Very low	171 Å²	171	114.3 Å²	114.3	90%	0.895	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-6.8	172.2	-72.4	169.2	0	0	0	113.9	N610	N610-L612 PolarHBondContact O-N 3.13Å
613	I	27.5	Very low	31.1	Very low	130 Å²	130	110.4 Å²	110.4	67%	0.667	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	-17.8	-172.1	-58.6	-179.7	0	0	0	113.3	N610	N610-I613 PolarHBondContact O-N 3.15Å; N610-I613 VanDerWaalsContact O-N 3.08Å
614	L	24.7	Very low	31.5	Very low	76 Å²	76	107.3 Å²	107.3	40%	0.398	55%	0.551	S	S	.	*	S	Bend	trans	-110.6	12.6	-172.8	-79.2	167.2	0	0	0	116.2	K607 E616	K607-L614 HydrophobicContact CB-CD1 4.35Å; K607-L614 HydrophobicContact CD-CD1 3.9Å; K607-L614 HydrophobicContact CG-CD1 3.74Å; L614-E616 PolarHBondContact O-N 3.11Å
615	N	26.6	Very low	31.8	Very low	143 Å²	143	105.5 Å²	105.5	77%	0.765	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	6.5	173	-72.5	-30.4	0	0	0	114.1	S611	S611-N615 PolarHBondContact O-ND2 2.97Å; S611-N615 VanDerWaalsContact O-ND2 3.08Å
616	E	29.3	Very low	32	Very low	130 Å²	130	103.9 Å²	103.9	61%	0.607	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-5.3	-178.2	-67.8	-161	106.8	0	0	115.4	L614	L614-E616 PolarHBondContact O-N 3.11Å
617	F	29.1	Very low	32	Very low	150 Å²	150	104.4 Å²	104.4	66%	0.658	54%	0.535	S	S	*	.	S	Bend	trans	-121.2	15.4	-168.7	-86.7	-81.2	0	0	0	116
618	I	31.5	Very low	32.4	Very low	168 Å²	168	104.3 Å²	104.3	86%	0.862	54%	0.537	S	S	*	.			trans	-124	62.9	157.9	-48.2	-179.1	0	0	0	108
619	D	29.5	Very low	32.6	Very low	45 Å²	45	101 Å²	101	24%	0.241	52%	0.522	C	S	.	.			trans	-73.4	146.1	160	-100.4	-46.2	0	0	0	109.4	N623 K627	D619-N623 HydrophobicContact CB-CB 3.69Å; D619-N623 VanDerWaalsContact OD1-CB 3.23Å; D619-N623 WeakPolarHBondContact OD1-CB 3.4Å; D619-N623 PolarHBondContact OD1-ND2 2.8Å; D619-K627 WeakPolarHBondContact OD2-CE 3.41Å; D619-K627 IonicContact OD2-NZ 3.75Å; D619-K627 PolarHBondContact OD2-NZ 3.02Å
620	D	38.3	Very low	32.8	Very low	91 Å²	91	96.3 Å²	96.3	49%	0.487	51%	0.507	S	S	.	.			trans	-50.3	138.7	164.2	-174.2	-49.4	0	0	0	108.9	L622 N623 L624	D620-L622 PolarHBondContact O-N 2.92Å; D620-L622 WeakPolarHBondContact OD1-CD1 3.31Å; D620-L622 PolarHBondContact OD1-N 3.35Å; D620-N623 HydrophobicContact CB-CB 4.47Å; D620-N623 WeakPolarHBondContact O-CA 3.5Å; D620-N623 WeakPolarHBondContact O-CB 3.49Å; D620-N623 PolarHBondContact O-N 3.47Å; D620-L624 PolarHBondContact O-N 3.36Å; D620-L624 VanDerWaalsContact O-N 3.07Å
621	P	35.1	Very low	32.9	Very low	98 Å²	98	96 Å²	96	64%	0.636	51%	0.512	S	S	*	.	H	α-helix	trans	-50.9	-27.3	177.2	17.2	-30.8	0	0	0	114	V625	P621-V625 WeakPolarHBondContact O-CG2 3.18Å; P621-V625 PolarHBondContact O-N 2.93Å
622	L	37	Very low	33.3	Very low	90 Å²	90	96.9 Å²	96.9	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-68.1	-41	169.9	-77.6	96.5	0	0	0	113.5	D620 L624 V625 Q626 L708	D620-L622 PolarHBondContact O-N 2.92Å; D620-L622 WeakPolarHBondContact OD1-CD1 3.31Å; D620-L622 PolarHBondContact OD1-N 3.35Å; L622-L624 VanDerWaalsContact C-N 3.31Å; L622-L624 PolarHBondContact O-N 3.12Å; L622-V625 PolarHBondContact O-N 2.94Å; L622-Q626 WeakPolarHBondContact O-CB 3.45Å; L622-Q626 PolarHBondContact O-N 3.3Å; L622-L708 HydrophobicContact CD2-CD1 4.47Å
623	N	39.8	Very low	33.7	Very low	68 Å²	68	90.1 Å²	90.1	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-64.3	-35.9	174.8	-80.3	6.3	0	0	0	111.6	D619 D620 Q626 K627	D619-N623 HydrophobicContact CB-CB 3.69Å; D619-N623 VanDerWaalsContact OD1-CB 3.23Å; D619-N623 WeakPolarHBondContact OD1-CB 3.4Å; D619-N623 PolarHBondContact OD1-ND2 2.8Å; D620-N623 HydrophobicContact CB-CB 4.47Å; D620-N623 WeakPolarHBondContact O-CA 3.5Å; D620-N623 WeakPolarHBondContact O-CB 3.49Å; D620-N623 PolarHBondContact O-N 3.47Å; N623-Q626 WeakPolarHBondContact O-CB 3.37Å; N623-Q626 PolarHBondContact O-N 3.03Å; N623-K627 PolarHBondContact O-N 3.24Å
624	L	40	Very low	34.1	Very low	65 Å²	65	90.9 Å²	90.9	34%	0.34	48%	0.484	S	S	.	.	H	α-helix	trans	-66.2	-41.5	176.8	-162.9	73.4	0	0	0	111.4	D620 L622 Q626 K627 I628	D620-L624 PolarHBondContact O-N 3.36Å; D620-L624 VanDerWaalsContact O-N 3.07Å; L622-L624 VanDerWaalsContact C-N 3.31Å; L622-L624 PolarHBondContact O-N 3.12Å; L624-Q626 VanDerWaalsContact C-N 3.33Å; L624-K627 PolarHBondContact O-N 3.4Å; L624-I628 HydrophobicContact CD2-CD1 4.47Å; L624-I628 HydrophobicContact CG-CD1 4.01Å; L624-I628 WeakPolarHBondContact O-CB 3.49Å; L624-I628 VanDerWaalsContact O-CG1 3.29Å; L624-I628 WeakPolarHBondContact O-CG1 3.3Å; L624-I628 PolarHBondContact O-N 2.93Å
625	V	37.3	Very low	34.6	Very low	48 Å²	48	90.2 Å²	90.2	29%	0.291	48%	0.481	S	S	.	.	H	α-helix	trans	-60.8	-42.8	170.8	170.6	0	0	0	0	111	P621 L622 K627 I628 S629 L708	P621-V625 WeakPolarHBondContact O-CG2 3.18Å; P621-V625 PolarHBondContact O-N 2.93Å; L622-V625 PolarHBondContact O-N 2.94Å; V625-K627 VanDerWaalsContact C-N 3.34Å; V625-K627 PolarHBondContact O-N 3.23Å; V625-I628 PolarHBondContact O-N 2.85Å; V625-S629 PolarHBondContact O-N 3.37Å; V625-L708 HydrophobicContact CG2-CD2 4.37Å
626	Q	38.9	Very low	35.1	Very low	102 Å²	102	84.8 Å²	84.8	48%	0.477	45%	0.454	S	S	.	.	H	α-helix	trans	-64.1	-34	178.1	-170.8	168.4	82.1	0	0	113.2	L622 N623 L624 P630 C633	L622-Q626 WeakPolarHBondContact O-CB 3.45Å; L622-Q626 PolarHBondContact O-N 3.3Å; N623-Q626 WeakPolarHBondContact O-CB 3.37Å; N623-Q626 PolarHBondContact O-N 3.03Å; L624-Q626 VanDerWaalsContact C-N 3.33Å; Q626-P630 WeakPolarHBondContact O-CA 3.1Å; Q626-P630 WeakPolarHBondContact O-CG 3.37Å; Q626-C633 VanDerWaalsContact CA-SG 3.6Å; Q626-C633 VanDerWaalsContact CB-SG 3.55Å; Q626-C633 HydrophobicContact CG-CB 4.12Å
627	K	36.5	Very low	35.2	Very low	117 Å²	117	81.7 Å²	81.7	51%	0.509	46%	0.457	S	S	.	.	H	α-helix	trans	-71.9	-38.4	172	-80.1	178	168.7	176	0	112.9	D619 N623 L624 V625	D619-K627 WeakPolarHBondContact OD2-CE 3.41Å; D619-K627 IonicContact OD2-NZ 3.75Å; D619-K627 PolarHBondContact OD2-NZ 3.02Å; N623-K627 PolarHBondContact O-N 3.24Å; L624-K627 PolarHBondContact O-N 3.4Å; V625-K627 VanDerWaalsContact C-N 3.34Å; V625-K627 PolarHBondContact O-N 3.23Å
628	I	34.4	Very low	35.1	Very low	80 Å²	80	84.7 Å²	84.7	41%	0.41	47%	0.465	S	S	.	.	H	α-helix	trans	-78.6	-34.1	-176.6	-69	167	0	0	0	112.2	L624 V625 I809 L813	L624-I628 HydrophobicContact CD2-CD1 4.47Å; L624-I628 HydrophobicContact CG-CD1 4.01Å; L624-I628 WeakPolarHBondContact O-CB 3.49Å; L624-I628 VanDerWaalsContact O-CG1 3.29Å; L624-I628 WeakPolarHBondContact O-CG1 3.3Å; L624-I628 PolarHBondContact O-N 2.93Å; V625-I628 PolarHBondContact O-N 2.85Å; I628-I809 HydrophobicContact CD1-CG2 3.88Å; I628-L813 HydrophobicContact CG2-CD1 4.45Å; I628-L813 HydrophobicContact CG2-CD2 4.34Å
629	S	33.7	Very low	34.9	Very low	32 Å²	32	83.9 Å²	83.9	22%	0.224	46%	0.461	C	S	.	.			trans	-144.7	83.3	176.3	-170.1	0	0	0	0	111.8	V625 S631 L632	V625-S629 PolarHBondContact O-N 3.37Å; S629-S631 PolarHBondContact O-N 3.37Å; S629-S631 VanDerWaalsContact O-N 3.1Å; S629-S631 PolarHBondContact OG-OG 3.13Å; S629-L632 PolarHBondContact O-N 3.35Å; S629-L632 WeakPolarHBondContact OG-CD1 3.5Å
630	P	35.8	Very low	34.9	Very low	80 Å²	80	87.6 Å²	87.6	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-57.5	-26.4	177.8	-25.1	33.6	0	0	0	113.7	Q626	Q626-P630 WeakPolarHBondContact O-CA 3.1Å; Q626-P630 WeakPolarHBondContact O-CG 3.37Å
631	S	32	Very low	34.3	Very low	80 Å²	80	90 Å²	90	56%	0.559	50%	0.498	S	S	*	.	H	α-helix	trans	-69.8	-25.5	176.4	41.7	0	0	0	0	113.9	S629	S629-S631 PolarHBondContact O-N 3.37Å; S629-S631 VanDerWaalsContact O-N 3.1Å; S629-S631 PolarHBondContact OG-OG 3.13Å
632	L	33.7	Very low	33.8	Very low	71 Å²	71	91.2 Å²	91.2	37%	0.372	51%	0.506	S	S	.	.	H	α-helix	trans	-71.4	-42.3	174.8	-111.2	85.8	0	0	0	111.8	S629 N634 L635 I704	S629-L632 PolarHBondContact O-N 3.35Å; S629-L632 WeakPolarHBondContact OG-CD1 3.5Å; L632-N634 PolarHBondContact O-N 2.96Å; L632-L635 WeakPolarHBondContact O-CB 3.46Å; L632-L635 PolarHBondContact O-N 3Å; L632-I704 HydrophobicContact CD2-CD1 4.25Å; L632-I704 HydrophobicContact CD2-CG1 4.11Å; L632-I704 HydrophobicContact CG-CD1 4.08Å; L632-I704 HydrophobicContact CG-CG1 4.47Å
633	C	36.5	Very low	33.3	Very low	29 Å²	29	96 Å²	96	20%	0.196	52%	0.523	C	S	.	.	H	α-helix	trans	-68.5	-17.2	-178.1	-66.6	0	0	0	0	113.9	Q626 L635 S636	Q626-C633 VanDerWaalsContact CA-SG 3.6Å; Q626-C633 VanDerWaalsContact CB-SG 3.55Å; Q626-C633 HydrophobicContact CG-CB 4.12Å; C633-L635 PolarHBondContact O-N 3.48Å; C633-S636 PolarHBondContact O-OG 3.19Å
634	N	37.5	Very low	32.6	Very low	146 Å²	146	98.2 Å²	98.2	78%	0.781	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-7.5	171	-72.6	-21	0	0	0	113.5	L632	L632-N634 PolarHBondContact O-N 2.96Å
635	L	33.8	Very low	31.8	Very low	62 Å²	62	100.9 Å²	100.9	33%	0.325	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.3	-27.7	177.4	-72.6	159.6	0	0	0	113	L632 C633 G637 S701 I704	L632-L635 WeakPolarHBondContact O-CB 3.46Å; L632-L635 PolarHBondContact O-N 3Å; C633-L635 PolarHBondContact O-N 3.48Å; L635-G637 PolarHBondContact O-N 3.25Å; L635-G637 VanDerWaalsContact O-N 3.16Å; L635-S701 WeakPolarHBondContact O-CB 3.38Å; L635-I704 HydrophobicContact CB-CD1 3.83Å
636	S	38	Very low	31.3	Very low	29 Å²	29	104.6 Å²	104.6	20%	0.203	59%	0.587	C	S	.	*	S	Bend	trans	-75.6	95.1	170.1	53.1	0	0	0	0	110.1	C633 Y638	C633-S636 PolarHBondContact O-OG 3.19Å; S636-Y638 PolarHBondContact O-N 3.25Å
637	G	31	Very low	30.5	Very low	65 Å²	65	106.9 Å²	106.9	67%	0.67	60%	0.603	S	S	*	*			trans	-69.5	21.4	-165.2	0	0	0	0	0	118.1	L635	L635-G637 PolarHBondContact O-N 3.25Å; L635-G637 VanDerWaalsContact O-N 3.16Å
638	Y	26.5	Very low	30.1	Very low	212 Å²	212	106.9 Å²	106.9	83%	0.831	62%	0.618	S	S	*	*			trans	-145.4	113.7	-179.4	-92.5	-87.5	0	0	0	112.3	S636	S636-Y638 PolarHBondContact O-N 3.25Å
639	I	27.2	Very low	29.5	Very low	151 Å²	151	112 Å²	112	77%	0.774	64%	0.637	S	S	*	*			trans	-177	149.9	132	-98.5	157.4	0	0	0	110.8
640	V	29.5	Very low	29.1	Very low	123 Å²	123	116.2 Å²	116.2	75%	0.745	67%	0.665	S	S	*	*			trans	72.2	117.3	-176.9	-153.8	0	0	0	0	117.8
641	N	25.5	Very low	28.6	Very low	141 Å²	141	118.4 Å²	118.4	75%	0.754	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-56.1	153.1	167.8	-54.2	-73.9	0	0	0	113.3	K643	N641-K643 PolarHBondContact O-N 3.34Å
642	P	25.6	Very low	28.2	Very low	125 Å²	125	122 Å²	122	81%	0.812	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-59.3	125.5	161.6	27.6	-33.6	0	0	0	109.6
643	K	25.9	Very low	27.7	Very low	190 Å²	190	126.2 Å²	126.2	83%	0.826	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-60.8	144.1	172.5	-75.1	-180	178.7	174.4	0	109.5	N641 S645	N641-K643 PolarHBondContact O-N 3.34Å; K643-S645 PolarHBondContact O-N 2.96Å
644	P	25	Very low	27.2	Very low	114 Å²	114	130.9 Å²	130.9	74%	0.74	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-62.6	128.8	-174.2	25.5	-34.7	0	0	0	111.2	V646	P644-V646 PolarHBondContact O-N 3.48Å
645	S	23.3	Very low	26.8	Very low	121 Å²	121	130.3 Å²	130.3	85%	0.846	73%	0.726	S	S	*	*			trans	-72.6	87.6	178.7	56.2	0	0	0	0	111.2	K643	K643-S645 PolarHBondContact O-N 2.96Å
646	V	27	Very low	26.4	Very low	126 Å²	126	135.5 Å²	135.5	76%	0.764	75%	0.753	S	S	*	*			trans	-110.2	105.8	170.9	-177.1	0	0	0	0	109.6	P644	P644-V646 PolarHBondContact O-N 3.48Å
647	N	23	Very low	25.9	Very low	150 Å²	150	139.1 Å²	139.1	80%	0.802	78%	0.777	S	S	*	*			trans	-26.3	120.8	179.4	-60.3	-46.3	0	0	0	117.4
648	S	27.4	Very low	25.7	Very low	117 Å²	117	142.6 Å²	142.6	82%	0.818	78%	0.781	S	S	*	*			trans	-101.8	112.9	142.5	56.1	0	0	0	0	109.1
649	K	22.4	Very low	25.6	Very low	187 Å²	187	138.5 Å²	138.5	81%	0.813	77%	0.772	S	S	*	*			trans	-72.8	170.2	165.3	-75.8	-176.2	173.2	-176.8	0	110
650	C	24.8	Very low	25.6	Very low	121 Å²	121	139.4 Å²	139.4	82%	0.818	77%	0.771	S	S	*	*			trans	78.6	127.9	174.7	-55	0	0	0	0	113.2
651	V	25.2	Very low	25.5	Very low	126 Å²	126	139.6 Å²	139.6	76%	0.764	77%	0.773	S	S	*	*			cis	-140.7	150.9	0.7	-177.9	0	0	0	0	109.2
652	I	22.5	Very low	25.5	Very low	157 Å²	157	139 Å²	139	81%	0.805	77%	0.774	S	S	*	*			trans	-115	156.7	162.5	-54.6	177.1	0	0	0	106.7
653	E	24.5	Very low	25.5	Very low	159 Å²	159	140.7 Å²	140.7	74%	0.743	78%	0.776	S	S	*	*			trans	86.4	132.2	-177.9	-60	178.9	-160.1	0	0	113.6
654	N	26.7	Very low	25.8	Very low	126 Å²	126	136.4 Å²	136.4	67%	0.674	78%	0.776	S	S	*	*			cis	-143	171.4	12.5	-103.5	-32.3	0	0	0	115
655	D	27.9	Very low	25.9	Very low	134 Å²	134	138.8 Å²	138.8	72%	0.717	78%	0.777	S	S	*	*			trans	62.1	89.4	158.1	-57.2	-26.3	0	0	0	119.6
656	L	26.3	Very low	26.2	Very low	172 Å²	172	138.7 Å²	138.7	90%	0.901	77%	0.768	S	S	*	*				-159.4	143.1	88.2	-102.5	167.2	0	0	0	112.1
657	C	26.1	Very low	26.3	Very low	104 Å²	104	138.1 Å²	138.1	70%	0.703	76%	0.764	S	S	*	*			trans	-70.2	172.1	178.7	-47.1	0	0	0	0	111
658	D	26.5	Very low	26.8	Very low	139 Å²	139	136 Å²	136	74%	0.743	76%	0.758	S	S	*	*			cis	-168.3	179	29.5	-153.4	-12.3	0	0	0	112.9
659	L	25.7	Very low	26.8	Very low	125 Å²	125	136.3 Å²	136.3	65%	0.654	75%	0.751	S	S	*	*			trans	84.1	83.7	161	-54.2	166.3	0	0	0	119.3
660	F	26.9	Very low	27	Very low	171 Å²	171	135.1 Å²	135.1	75%	0.75	75%	0.748	S	S	*	*			trans	64.6	98.9	143	-46.2	-52.4	0	0	0	119.2
661	T	26.8	Very low	27.2	Very low	127 Å²	127	135.6 Å²	135.6	78%	0.779	75%	0.747	S	S	*	*				87.4	129.2	54.7	66.1	0	0	0	0	116.1
662	T	26.1	Very low	27.4	Very low	128 Å²	128	134.6 Å²	134.6	79%	0.785	75%	0.752	S	S	*	*			trans	-73.8	157.5	169.7	51.1	0	0	0	0	112.7
663	D	26.1	Very low	27.7	Very low	161 Å²	161	130.8 Å²	130.8	86%	0.861	75%	0.752	S	S	*	*			trans	-117.2	141	156.7	-76.9	-56.1	0	0	0	111.5
664	A	30.8	Very low	28	Very low	99 Å²	99	132.6 Å²	132.6	82%	0.818	76%	0.757	S	S	*	*			trans	-138	139.8	174.9	0	0	0	0	0	108.9
665	E	28.3	Very low	27.8	Very low	164 Å²	164	133 Å²	133	77%	0.766	76%	0.764	S	S	*	*			trans	-134.7	150.1	-166.3	-90.4	-162.4	179.1	0	0	109.6
666	N	29.8	Very low	27.9	Very low	120 Å²	120	130.8 Å²	130.8	64%	0.642	76%	0.764	S	S	*	*			cis	-161.4	168.3	21.3	-111.6	-26.9	0	0	0	109
667	V	27.8	Very low	27.8	Very low	114 Å²	114	128.4 Å²	128.4	69%	0.691	76%	0.758	S	S	*	*			cis	-168.1	-161.3	-15	80.4	0	0	0	0	104.6
668	P	34.6	Very low	27.7	Very low	104 Å²	104	129.7 Å²	129.7	68%	0.675	76%	0.757	S	S	*	*			cis	-74.4	-166.5	-11	-17.7	37.2	0	0	0	114.3
669	D	27.2	Very low	27.7	Very low	124 Å²	124	130.4 Å²	130.4	66%	0.663	76%	0.756	S	S	*	*			cis	-148.4	142.1	10.4	-138.6	-25	0	0	0	114.8
670	Q	26.9	Very low	27.7	Very low	162 Å²	162	131.7 Å²	131.7	76%	0.757	76%	0.762	S	S	*	*			trans	64.9	120.6	149.2	-91.3	164.6	88.6	0	0	124.9
671	V	29.2	Very low	27.6	Very low	131 Å²	131	129.6 Å²	129.6	79%	0.794	76%	0.763	S	S	*	*			trans	101.2	79.3	147.5	-171.4	0	0	0	0	121
672	A	28.4	Very low	27.5	Very low	106 Å²	106	132 Å²	132	88%	0.876	76%	0.763	S	S	*	*				56.8	125.9	126.3	0	0	0	0	0	124.8
673	G	29.4	Very low	27.5	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	76%	0.756	S	S	*	*			trans	169.3	60.2	153.4	0	0	0	0	0	125.3
674	K	29.5	Very low	27.4	Very low	196 Å²	196	133.1 Å²	133.1	85%	0.852	76%	0.759	S	S	*	*			trans	61.6	105.7	142.6	-66	-178.8	177.8	177.6	0	124.7
675	T	23.8	Very low	27.3	Very low	134 Å²	134	132.4 Å²	132.4	82%	0.822	75%	0.745	S	S	*	*				63.8	144.9	121.6	59.4	0	0	0	0	126.1
676	A	29.9	Very low	27.3	Very low	88 Å²	88	131 Å²	131	73%	0.727	74%	0.741	S	S	*	*			trans	90.8	157.4	150.1	0	0	0	0	0	119.6
677	T	23.6	Very low	27.2	Very low	123 Å²	123	134.3 Å²	134.3	76%	0.755	75%	0.753	S	S	*	*				-179.5	152.7	-63.5	31.7	0	0	0	0	110.5
678	N	24.6	Very low	27.3	Very low	130 Å²	130	133.8 Å²	133.8	70%	0.695	75%	0.75	S	S	*	*			trans	70.8	160.1	171.3	-61.3	17	0	0	0	116.2
679	E	27	Very low	27	Very low	154 Å²	154	133.8 Å²	133.8	72%	0.72	74%	0.744	S	S	*	*			cis	-151	120.9	6.3	-138	145.7	-109.9	0	0	110.2
680	I	24.2	Very low	27.1	Very low	152 Å²	152	132.1 Å²	132.1	78%	0.779	74%	0.741	S	S	*	*				49.5	133.7	104.7	-40.8	178.2	0	0	0	118
681	V	25	Very low	27.4	Very low	127 Å²	127	131.6 Å²	131.6	77%	0.77	74%	0.739	S	S	*	*			trans	111.8	124.5	159	-175.9	0	0	0	0	116.2
682	K	24.9	Very low	27.5	Very low	179 Å²	179	129.4 Å²	129.4	78%	0.778	72%	0.723	S	S	*	*			trans	74.7	139.6	-171.1	-62.8	177.4	-179.8	-169.8	0	114.3
683	E	26.2	Very low	27.7	Very low	135 Å²	135	126.8 Å²	126.8	63%	0.631	70%	0.698	S	S	*	*			cis	-147.8	123.8	7.1	-128.8	159.3	-137.4	0	0	112.5	V685	E683-V685 HydrophobicContact CB-CG2 4.32Å; E683-V685 HydrophobicContact CG-CG2 3.89Å; E683-V685 PolarHBondContact O-N 2.91Å; E683-V685 VanDerWaalsContact O-N 3.12Å
684	N	24.9	Very low	27.9	Very low	176 Å²	176	127.1 Å²	127.1	94%	0.941	68%	0.684	S	S	*	*			trans	-83.9	74.6	174.3	-75.2	8.9	0	0	0	110.6
685	V	27.7	Very low	28.3	Very low	84 Å²	84	120.5 Å²	120.5	51%	0.509	66%	0.656	S	S	.	*			trans	-134.1	-13.9	-174.1	-179.6	0	0	0	0	114.2	E683	E683-V685 HydrophobicContact CB-CG2 4.32Å; E683-V685 HydrophobicContact CG-CG2 3.89Å; E683-V685 PolarHBondContact O-N 2.91Å; E683-V685 VanDerWaalsContact O-N 3.12Å
686	I	28.8	Very low	28.9	Very low	135 Å²	135	120 Å²	120	69%	0.692	64%	0.643	S	S	*	*	S	Bend	trans	-93.1	-23.9	-164.3	-61.1	-179.7	0	0	0	114.3	T688 N689	I686-T688 VanDerWaalsContact C-N 3.25Å; I686-T688 PolarHBondContact O-N 3.22Å; I686-T688 VanDerWaalsContact O-N 3.11Å; I686-N689 PolarHBondContact O-N 2.75Å
687	E	27.7	Very low	29.2	Very low	190 Å²	190	119.8 Å²	119.8	89%	0.888	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-12	-172.2	-69.9	-170.1	132.2	0	0	115.7
688	T	29.8	Very low	30.1	Very low	102 Å²	102	119.7 Å²	119.7	63%	0.626	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-21.4	179.1	52.2	0	0	0	0	114.8	I686 C690	I686-T688 VanDerWaalsContact C-N 3.25Å; I686-T688 PolarHBondContact O-N 3.22Å; I686-T688 VanDerWaalsContact O-N 3.11Å; T688-C690 PolarHBondContact O-N 3.09Å
689	N	29.1	Very low	31	Very low	105 Å²	105	118.1 Å²	118.1	56%	0.561	61%	0.608	S	S	*	*	H	α-helix	trans	-82.5	-14.4	-168.8	-71.8	-14.6	0	0	0	114.7	I686 S693	I686-N689 PolarHBondContact O-N 2.75Å; N689-S693 PolarHBondContact O-OG 3.47Å
690	C	29.3	Very low	31.7	Very low	89 Å²	89	112.2 Å²	112.2	60%	0.601	58%	0.583	S	S	*	*	H	α-helix	trans	-84.3	-23.8	179.3	-72.7	0	0	0	0	114.3	T688 S693 V694	T688-C690 PolarHBondContact O-N 3.09Å; C690-S693 WeakPolarHBondContact CA-OG 3.33Å; C690-S693 PolarHBondContact O-OG 2.91Å; C690-V694 WeakPolarHBondContact O-CG2 3.41Å
691	Q	31.6	Very low	32.7	Very low	150 Å²	150	106 Å²	106	70%	0.701	55%	0.553	S	S	*	*	H	α-helix	trans	-83.7	-39.9	175.3	-70.6	-176.4	-92.6	0	0	111.4	S693 V694 E695	Q691-S693 PolarHBondContact O-N 3.48Å; Q691-V694 PolarHBondContact O-N 3.22Å; Q691-V694 VanDerWaalsContact O-N 3.13Å; Q691-E695 PolarHBondContact O-N 2.86Å
692	D	31.7	Very low	33.8	Very low	85 Å²	85	105.7 Å²	105.7	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-58.6	-34.5	177	-128.7	53.5	0	0	0	112.8	K696	D692-K696 WeakPolarHBondContact O-CB 3.38Å; D692-K696 WeakPolarHBondContact O-CD 3.45Å; D692-K696 VanDerWaalsContact O-CG 3.24Å; D692-K696 WeakPolarHBondContact O-CG 3.43Å; D692-K696 PolarHBondContact O-N 3.39Å; D692-K696 VanDerWaalsContact O-N 3.09Å; D692-K696 IonicContact OD2-NZ 2.8Å; D692-K696 PolarHBondContact OD2-NZ 2.83Å
693	S	33.7	Very low	34.9	Very low	52 Å²	52	98.2 Å²	98.2	36%	0.364	52%	0.515	S	S	.	.	H	α-helix	trans	-75.3	-38.4	175.1	40.9	0	0	0	0	113	N689 C690 Q691 N697	N689-S693 PolarHBondContact O-OG 3.47Å; C690-S693 WeakPolarHBondContact CA-OG 3.33Å; C690-S693 PolarHBondContact O-OG 2.91Å; Q691-S693 PolarHBondContact O-N 3.48Å; S693-N697 VanDerWaalsContact O-CB 3.31Å; S693-N697 WeakPolarHBondContact O-CB 3.43Å; S693-N697 PolarHBondContact O-N 2.82Å; S693-N697 PolarHBondContact O-ND2 3.35Å; S693-N697 PolarHBondContact O-OD1 2.89Å
694	V	33.8	Very low	35.9	Very low	83 Å²	83	92.7 Å²	92.7	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-67.8	-41.9	175.1	173.4	0	0	0	0	111.4	C690 Q691 N697 Q698	C690-V694 WeakPolarHBondContact O-CG2 3.41Å; Q691-V694 PolarHBondContact O-N 3.22Å; Q691-V694 VanDerWaalsContact O-N 3.13Å; V694-N697 PolarHBondContact O-N 2.95Å; V694-Q698 PolarHBondContact O-N 3.49Å
695	E	36.4	Very low	37.1	Very low	57 Å²	57	87.2 Å²	87.2	27%	0.266	46%	0.46	S	S	.	.	H	α-helix	trans	-66.1	-41.9	175	-83	-156	-159.7	0	0	113	Q691 N697 Q698 K699 Y834	Q691-E695 PolarHBondContact O-N 2.86Å; E695-N697 VanDerWaalsContact C-N 3.34Å; E695-Q698 PolarHBondContact O-N 2.89Å; E695-K699 WeakPolarHBondContact O-CB 3.41Å; E695-K699 WeakPolarHBondContact O-CD 3.29Å; E695-K699 VanDerWaalsContact O-CG 3.3Å; E695-K699 WeakPolarHBondContact O-CG 3.43Å; E695-K699 PolarHBondContact O-N 2.94Å; E695-K699 IonicContact OE2-NZ 2.96Å; E695-K699 PolarHBondContact OE2-NZ 3.04Å; E695-Y834 WeakPolarHBondContact OE1-CE2 3.18Å; E695-Y834 VanDerWaalsContact OE1-CZ 3.28Å; E695-Y834 PolarHBondContact OE1-OH 3.37Å
696	K	36.6	Very low	38.1	Very low	125 Å²	125	88.2 Å²	88.2	54%	0.543	46%	0.458	S	S	.	.	H	α-helix	trans	-60.5	-45.4	174	-79.7	166.4	179.7	147.6	0	110.8	D692 Q698 K699 S700	D692-K696 WeakPolarHBondContact O-CB 3.38Å; D692-K696 WeakPolarHBondContact O-CD 3.45Å; D692-K696 VanDerWaalsContact O-CG 3.24Å; D692-K696 WeakPolarHBondContact O-CG 3.43Å; D692-K696 PolarHBondContact O-N 3.39Å; D692-K696 VanDerWaalsContact O-N 3.09Å; D692-K696 IonicContact OD2-NZ 2.8Å; D692-K696 PolarHBondContact OD2-NZ 2.83Å; K696-Q698 PolarHBondContact O-N 3Å; K696-K699 PolarHBondContact O-N 2.96Å; K696-S700 PolarHBondContact O-N 3.08Å; K696-S700 PolarHBondContact O-OG 3.45Å; K696-S700 VanDerWaalsContact O-OG 3.06Å
697	N	36.2	Very low	38.9	Very low	82 Å²	82	82.7 Å²	82.7	44%	0.439	43%	0.431	S	S	.	.	H	α-helix	trans	-63.4	-39.1	178	-70.9	-4.4	0	0	0	112.5	S693 V694 E695 S700 S701	S693-N697 VanDerWaalsContact O-CB 3.31Å; S693-N697 WeakPolarHBondContact O-CB 3.43Å; S693-N697 PolarHBondContact O-N 2.82Å; S693-N697 PolarHBondContact O-ND2 3.35Å; S693-N697 PolarHBondContact O-OD1 2.89Å; V694-N697 PolarHBondContact O-N 2.95Å; E695-N697 VanDerWaalsContact C-N 3.34Å; N697-S700 WeakPolarHBondContact CA-OG 3.49Å; N697-S700 PolarHBondContact O-OG 3.17Å; N697-S701 WeakPolarHBondContact O-CB 3.46Å; N697-S701 PolarHBondContact O-N 3.04Å
698	Q	43.5	Very low	39.9	Very low	121 Å²	121	75.8 Å²	75.8	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-66.5	-42.5	173	-77.2	-173.3	-17.1	0	0	112.4	V694 E695 K696 S701 L702	V694-Q698 PolarHBondContact O-N 3.49Å; E695-Q698 PolarHBondContact O-N 2.89Å; K696-Q698 PolarHBondContact O-N 3Å; Q698-S701 PolarHBondContact O-N 3.3Å; Q698-L702 WeakPolarHBondContact O-CB 3.42Å; Q698-L702 WeakPolarHBondContact O-CG 3.24Å; Q698-L702 PolarHBondContact O-N 3.39Å
699	K	43.9	Very low	40.9	Very low	98 Å²	98	75.8 Å²	75.8	43%	0.426	40%	0.396	S	S	.	.	H	α-helix	trans	-62.6	-41.4	176	-75	160.6	178	158.7	0	111.3	E695 K696 L702 L703	E695-K699 WeakPolarHBondContact O-CB 3.41Å; E695-K699 WeakPolarHBondContact O-CD 3.29Å; E695-K699 VanDerWaalsContact O-CG 3.3Å; E695-K699 WeakPolarHBondContact O-CG 3.43Å; E695-K699 PolarHBondContact O-N 2.94Å; E695-K699 IonicContact OE2-NZ 2.96Å; E695-K699 PolarHBondContact OE2-NZ 3.04Å; K696-K699 PolarHBondContact O-N 2.96Å; K699-L702 PolarHBondContact O-N 2.91Å; K699-L703 WeakPolarHBondContact O-CB 3.43Å; K699-L703 WeakPolarHBondContact O-CG 3.35Å; K699-L703 PolarHBondContact O-N 3.43Å
700	S	39.9	Very low	41.8	Very low	30 Å²	30	71.9 Å²	71.9	21%	0.21	38%	0.377	C	S	.	.	H	α-helix	trans	-70.3	-36.7	173.8	55.8	0	0	0	0	113.3	K696 N697 L703 I704	K696-S700 PolarHBondContact O-N 3.08Å; K696-S700 PolarHBondContact O-OG 3.45Å; K696-S700 VanDerWaalsContact O-OG 3.06Å; N697-S700 WeakPolarHBondContact CA-OG 3.49Å; N697-S700 PolarHBondContact O-OG 3.17Å; S700-L703 PolarHBondContact O-N 3.42Å; S700-I704 WeakPolarHBondContact O-CB 3.26Å; S700-I704 WeakPolarHBondContact O-CD1 2.88Å; S700-I704 VanDerWaalsContact O-CG1 3.23Å; S700-I704 WeakPolarHBondContact O-CG1 3.13Å; S700-I704 PolarHBondContact O-N 3.37Å
701	S	45.9	Very low	42.5	Very low	20 Å²	20	69.7 Å²	69.7	14%	0.14	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-48.8	172.4	-169.8	0	0	0	0	110.1	L635 N697 Q698 L703 I704 D705	L635-S701 WeakPolarHBondContact O-CB 3.38Å; N697-S701 WeakPolarHBondContact O-CB 3.46Å; N697-S701 PolarHBondContact O-N 3.04Å; Q698-S701 PolarHBondContact O-N 3.3Å; S701-L703 VanDerWaalsContact C-N 3.33Å; S701-L703 PolarHBondContact O-N 3.26Å; S701-I704 CarbonylContact O-C 3.53Å; S701-I704 PolarHBondContact O-N 3.06Å; S701-I704 VanDerWaalsContact O-N 3.11Å; S701-D705 WeakPolarHBondContact O-CB 3.46Å; S701-D705 VanDerWaalsContact O-CG 3.26Å; S701-D705 PolarHBondContact O-N 3.36Å; S701-D705 PolarHBondContact OG-OD2 3.49Å
702	L	49.1	Very low	43.4	Very low	121 Å²	121	68.3 Å²	68.3	63%	0.634	35%	0.351	S	S	*	.	H	α-helix	trans	-63.5	-35.4	178.1	-70.7	169.6	0	0	0	112.9	Q698 K699 F706	Q698-L702 WeakPolarHBondContact O-CB 3.42Å; Q698-L702 WeakPolarHBondContact O-CG 3.24Å; Q698-L702 PolarHBondContact O-N 3.39Å; K699-L702 PolarHBondContact O-N 2.91Å; L702-F706 WeakPolarHBondContact O-CB 3.46Å; L702-F706 PolarHBondContact O-N 3.3Å
703	L	47	Very low	44.2	Very low	23 Å²	23	69.4 Å²	69.4	12%	0.12	35%	0.354	C	S	.	.	H	α-helix	trans	-65.7	-40.5	171.5	-84.3	161	0	0	0	112.3	K699 S700 S701 S707 L820 A823 E824 L827	K699-L703 WeakPolarHBondContact O-CB 3.43Å; K699-L703 WeakPolarHBondContact O-CG 3.35Å; K699-L703 PolarHBondContact O-N 3.43Å; S700-L703 PolarHBondContact O-N 3.42Å; S701-L703 VanDerWaalsContact C-N 3.33Å; S701-L703 PolarHBondContact O-N 3.26Å; L703-S707 VanDerWaalsContact O-CB 3.25Å; L703-S707 WeakPolarHBondContact O-CB 3.24Å; L703-S707 PolarHBondContact O-N 2.99Å; L703-S707 PolarHBondContact O-OG 3.13Å; L703-L820 HydrophobicContact CB-CD1 3.98Å; L703-L820 HydrophobicContact CD2-CD1 4.11Å; L703-L820 HydrophobicContact CG-CD1 4.5Å; L703-A823 HydrophobicContact CD2-CB 3.53Å; L703-E824 HydrophobicContact CD1-CG 4.32Å; L703-L827 HydrophobicContact CD1-CD1 3.88Å; L703-L827 HydrophobicContact CD2-CD1 4.25Å; L703-L827 HydrophobicContact CG-CD1 4.28Å
704	I	47.6	Very low	44.7	Very low	19 Å²	19	70.1 Å²	70.1	10%	0.097	35%	0.352	C	S	.	.	H	α-helix	trans	-67.9	-47.8	176.3	-70.4	164.9	0	0	0	110.1	L632 L635 S700 S701 F706 S707 L708	L632-I704 HydrophobicContact CD2-CD1 4.25Å; L632-I704 HydrophobicContact CD2-CG1 4.11Å; L632-I704 HydrophobicContact CG-CD1 4.08Å; L632-I704 HydrophobicContact CG-CG1 4.47Å; L635-I704 HydrophobicContact CB-CD1 3.83Å; S700-I704 WeakPolarHBondContact O-CB 3.26Å; S700-I704 WeakPolarHBondContact O-CD1 2.88Å; S700-I704 VanDerWaalsContact O-CG1 3.23Å; S700-I704 WeakPolarHBondContact O-CG1 3.13Å; S700-I704 PolarHBondContact O-N 3.37Å; S701-I704 CarbonylContact O-C 3.53Å; S701-I704 PolarHBondContact O-N 3.06Å; S701-I704 VanDerWaalsContact O-N 3.11Å; I704-F706 PolarHBondContact O-N 3.41Å; I704-S707 CarbonylContact O-C 3.43Å; I704-S707 WeakPolarHBondContact O-CB 3.34Å; I704-S707 PolarHBondContact O-N 2.99Å; I704-S707 VanDerWaalsContact O-N 3.15Å; I704-L708 HydrophobicContact CG2-CD1 3.83Å; I704-L708 HydrophobicContact CG2-CG 4.34Å; I704-L708 WeakPolarHBondContact O-CB 3.12Å; I704-L708 WeakPolarHBondContact O-CG 3.33Å; I704-L708 PolarHBondContact O-N 3.39Å
705	D	49.7	Very low	45.2	Very low	61 Å²	61	70.2 Å²	70.2	33%	0.326	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-41.5	177.2	-67.5	-43.3	0	0	0	111.4	S701 N709	S701-D705 WeakPolarHBondContact O-CB 3.46Å; S701-D705 VanDerWaalsContact O-CG 3.26Å; S701-D705 PolarHBondContact O-N 3.36Å; S701-D705 PolarHBondContact OG-OD2 3.49Å; D705-N709 WeakPolarHBondContact O-CB 3.42Å; D705-N709 PolarHBondContact O-N 3.22Å; D705-N709 PolarHBondContact O-ND2 2.93Å
706	F	49.8	Very low	45.5	Very low	105 Å²	105	72 Å²	72	46%	0.461	36%	0.361	S	S	.	.	H	α-helix	trans	-63.5	-41.5	172.8	179	-97.8	0	0	0	111.9	L702 I704 S710	L702-F706 WeakPolarHBondContact O-CB 3.46Å; L702-F706 PolarHBondContact O-N 3.3Å; I704-F706 PolarHBondContact O-N 3.41Å; F706-S710 VanDerWaalsContact O-CB 3.27Å; F706-S710 WeakPolarHBondContact O-CB 3.35Å; F706-S710 PolarHBondContact O-N 3.07Å; F706-S710 PolarHBondContact O-OG 3.22Å
707	S	45.6	Very low	45.8	Very low	19 Å²	19	68.5 Å²	68.5	13%	0.133	35%	0.348	C	S	.	.	H	α-helix	trans	-66.1	-43.2	177.7	-61.9	0	0	0	0	111.8	L703 I704 S710 L711	L703-S707 VanDerWaalsContact O-CB 3.25Å; L703-S707 WeakPolarHBondContact O-CB 3.24Å; L703-S707 PolarHBondContact O-N 2.99Å; L703-S707 PolarHBondContact O-OG 3.13Å; I704-S707 CarbonylContact O-C 3.43Å; I704-S707 WeakPolarHBondContact O-CB 3.34Å; I704-S707 PolarHBondContact O-N 2.99Å; I704-S707 VanDerWaalsContact O-N 3.15Å; S707-S710 PolarHBondContact O-N 3.07Å; S707-L711 WeakPolarHBondContact O-CB 3.47Å; S707-L711 PolarHBondContact O-N 3.24Å
708	L	48.1	Very low	46.2	Very low	44 Å²	44	67 Å²	67	23%	0.23	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-43.5	177.5	-72.7	171.8	0	0	0	112.1	L622 V625 I704 S710 L711 K712	L622-L708 HydrophobicContact CD2-CD1 4.47Å; V625-L708 HydrophobicContact CG2-CD2 4.37Å; I704-L708 HydrophobicContact CG2-CD1 3.83Å; I704-L708 HydrophobicContact CG2-CG 4.34Å; I704-L708 WeakPolarHBondContact O-CB 3.12Å; I704-L708 WeakPolarHBondContact O-CG 3.33Å; I704-L708 PolarHBondContact O-N 3.39Å; L708-S710 VanDerWaalsContact C-N 3.35Å; L708-L711 WeakPolarHBondContact O-CB 3.2Å; L708-L711 PolarHBondContact O-N 2.92Å; L708-K712 WeakPolarHBondContact O-CB 3.41Å; L708-K712 PolarHBondContact O-N 2.89Å
709	N	50.6	Low	46.3	Very low	102 Å²	102	61.2 Å²	61.2	55%	0.545	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-38.8	174.1	-77.5	-68.3	0	0	0	111.7	D705 K712 E713	D705-N709 WeakPolarHBondContact O-CB 3.42Å; D705-N709 PolarHBondContact O-N 3.22Å; D705-N709 PolarHBondContact O-ND2 2.93Å; N709-K712 PolarHBondContact O-N 3.32Å; N709-E713 WeakPolarHBondContact O-CB 3.37Å; N709-E713 PolarHBondContact O-N 3.27Å
710	S	47.2	Very low	46.2	Very low	23 Å²	23	59.4 Å²	59.4	16%	0.161	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-41.6	173.3	-60.3	0	0	0	0	112	F706 S707 L708 E713 M714	F706-S710 VanDerWaalsContact O-CB 3.27Å; F706-S710 WeakPolarHBondContact O-CB 3.35Å; F706-S710 PolarHBondContact O-N 3.07Å; F706-S710 PolarHBondContact O-OG 3.22Å; S707-S710 PolarHBondContact O-N 3.07Å; L708-S710 VanDerWaalsContact C-N 3.35Å; S710-E713 PolarHBondContact O-N 2.8Å; S710-M714 WeakPolarHBondContact O-CB 3.37Å; S710-M714 VanDerWaalsContact O-CG 3.26Å; S710-M714 WeakPolarHBondContact O-CG 3.46Å; S710-M714 PolarHBondContact O-N 2.98Å
711	L	45.6	Very low	46.4	Very low	44 Å²	44	61.9 Å²	61.9	23%	0.23	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-45.8	175.1	-121.2	139.1	0	0	0	110.9	S707 L708 M714 T715 L812	S707-L711 WeakPolarHBondContact O-CB 3.47Å; S707-L711 PolarHBondContact O-N 3.24Å; L708-L711 WeakPolarHBondContact O-CB 3.2Å; L708-L711 PolarHBondContact O-N 2.92Å; L711-M714 PolarHBondContact O-N 2.98Å; L711-T715 PolarHBondContact O-N 3.35Å; L711-T715 PolarHBondContact O-OG1 3.42Å; L711-L812 HydrophobicContact CD2-CD2 4.04Å
712	K	48.8	Very low	46.3	Very low	121 Å²	121	62.2 Å²	62.2	53%	0.526	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-50.2	176.1	-177.2	173.4	175.9	175.3	0	111.6	L708 N709 M714 T715 E716	L708-K712 WeakPolarHBondContact O-CB 3.41Å; L708-K712 PolarHBondContact O-N 2.89Å; N709-K712 PolarHBondContact O-N 3.32Å; K712-M714 VanDerWaalsContact C-N 3.27Å; K712-M714 PolarHBondContact O-N 3.28Å; K712-T715 WeakPolarHBondContact CA-OG1 3.05Å; K712-T715 PolarHBondContact O-N 3.37Å; K712-T715 VanDerWaalsContact O-N 3.16Å; K712-T715 PolarHBondContact O-OG1 3.45Å; K712-E716 WeakPolarHBondContact CE-OE1 3.48Å; K712-E716 WeakPolarHBondContact CG-OE1 3.43Å; K712-E716 WeakPolarHBondContact O-CB 3.46Å; K712-E716 WeakPolarHBondContact O-CG 3.49Å; K712-E716 PolarHBondContact O-N 3.32Å
713	E	50.1	Low	46.1	Very low	108 Å²	108	57.3 Å²	57.3	51%	0.505	28%	0.284	S	S	.	.	H	α-helix	trans	-60.8	-35.7	177.1	-168.2	-178.9	173.9	0	0	111.8	N709 S710 E716 N717	N709-E713 WeakPolarHBondContact O-CB 3.37Å; N709-E713 PolarHBondContact O-N 3.27Å; S710-E713 PolarHBondContact O-N 2.8Å; E713-E716 PolarHBondContact O-N 2.87Å; E713-N717 WeakPolarHBondContact CG-ND2 3.26Å; E713-N717 WeakPolarHBondContact O-CB 3.26Å; E713-N717 PolarHBondContact O-N 2.95Å; E713-N717 PolarHBondContact O-ND2 3.32Å
714	M	42.5	Very low	45.9	Very low	67 Å²	67	57 Å²	57	33%	0.33	28%	0.284	S	S	.	.	H	α-helix	trans	-65.3	-48.2	172.6	-75	-178.9	-176.7	0	0	112.1	S710 L711 K712 E716 N717 L718 Q815	S710-M714 WeakPolarHBondContact O-CB 3.37Å; S710-M714 VanDerWaalsContact O-CG 3.26Å; S710-M714 WeakPolarHBondContact O-CG 3.46Å; S710-M714 PolarHBondContact O-N 2.98Å; L711-M714 PolarHBondContact O-N 2.98Å; K712-M714 VanDerWaalsContact C-N 3.27Å; K712-M714 PolarHBondContact O-N 3.28Å; M714-E716 PolarHBondContact O-N 3.28Å; M714-N717 PolarHBondContact O-N 3.29Å; M714-L718 HydrophobicContact CB-CD1 4.03Å; M714-L718 HydrophobicContact CG-CD1 3.92Å; M714-L718 WeakPolarHBondContact O-CB 3.46Å; M714-L718 PolarHBondContact O-N 3.07Å; M714-Q815 HydrophobicContact SD-CG 4.35Å
715	T	44.6	Very low	45.8	Very low	85 Å²	85	60.6 Å²	60.6	52%	0.521	30%	0.301	S	S	.	.	H	α-helix	trans	-64.3	-26.4	176.7	52.3	0	0	0	0	113.4	L711 K712	L711-T715 PolarHBondContact O-N 3.35Å; L711-T715 PolarHBondContact O-OG1 3.42Å; K712-T715 WeakPolarHBondContact CA-OG1 3.05Å; K712-T715 PolarHBondContact O-N 3.37Å; K712-T715 VanDerWaalsContact O-N 3.16Å; K712-T715 PolarHBondContact O-OG1 3.45Å
716	E	44.1	Very low	45.4	Very low	94 Å²	94	59.2 Å²	59.2	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-87.3	-10.7	178.1	-74.8	-175.5	-156.3	0	0	114.3	K712 E713 M714 K877	K712-E716 WeakPolarHBondContact CE-OE1 3.48Å; K712-E716 WeakPolarHBondContact CG-OE1 3.43Å; K712-E716 WeakPolarHBondContact O-CB 3.46Å; K712-E716 WeakPolarHBondContact O-CG 3.49Å; K712-E716 PolarHBondContact O-N 3.32Å; E713-E716 PolarHBondContact O-N 2.87Å; M714-E716 PolarHBondContact O-N 3.28Å; E716-K877 WeakPolarHBondContact O-CD 3.3Å; E716-K877 WeakPolarHBondContact O-CE 3.27Å; E716-K877 PolarHBondContact O-NZ 3.22Å
717	N	42.5	Very low	45	Very low	52 Å²	52	54.7 Å²	54.7	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-139.1	-8.3	-169.7	-61.6	-71.1	0	0	0	116.8	E713 M714 K877	E713-N717 WeakPolarHBondContact CG-ND2 3.26Å; E713-N717 WeakPolarHBondContact O-CB 3.26Å; E713-N717 PolarHBondContact O-N 2.95Å; E713-N717 PolarHBondContact O-ND2 3.32Å; M714-N717 PolarHBondContact O-N 3.29Å; N717-K877 PolarHBondContact OD1-NZ 2.85Å
718	L	44	Very low	44.9	Very low	50 Å²	50	56.9 Å²	56.9	26%	0.262	29%	0.291	S	S	.	.	S	Bend	trans	-108.5	152.8	176.1	-63.2	173.8	0	0	0	111.1	M714 D722 I723 L856	M714-L718 HydrophobicContact CB-CD1 4.03Å; M714-L718 HydrophobicContact CG-CD1 3.92Å; M714-L718 WeakPolarHBondContact O-CB 3.46Å; M714-L718 PolarHBondContact O-N 3.07Å; L718-D722 HydrophobicContact CB-CB 4.45Å; L718-I723 HydrophobicContact CB-CD1 3.89Å; L718-I723 HydrophobicContact CB-CG1 3.72Å; L718-I723 HydrophobicContact CD1-CG1 3.93Å; L718-I723 HydrophobicContact CG-CG1 4.5Å; L718-L856 HydrophobicContact CD2-CD2 4.26Å
719	S	44.8	Very low	44.5	Very low	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.298	C	S	.	.			trans	-72	157.2	169.2	58	0	0	0	0	111.5	W721 D722 I723 C881 D882	S719-W721 PolarHBondContact O-N 3.12Å; S719-W721 PolarHBondContact OG-N 3.17Å; S719-D722 PolarHBondContact N-OD2 3.15Å; S719-D722 PolarHBondContact O-N 2.76Å; S719-D722 WeakPolarHBondContact OG-CB 3.39Å; S719-D722 PolarHBondContact OG-N 3.24Å; S719-D722 PolarHBondContact OG-OD2 2.92Å; S719-I723 WeakPolarHBondContact O-CG1 3.49Å; S719-I723 PolarHBondContact O-N 3.04Å; S719-I723 VanDerWaalsContact O-N 3.15Å; S719-C881 VanDerWaalsContact CB-C 3.46Å; S719-C881 PolarHBondContact OG-O 2.89Å; S719-D882 WeakPolarHBondContact CB-OD1 3.26Å
720	F	43.2	Very low	43.9	Very low	60 Å²	60	58.7 Å²	58.7	26%	0.263	29%	0.294	S	S	.	.	H	α-helix	trans	-49.8	-40.1	162.6	168.7	-104.2	0	0	0	110.7	I723 C724 F796 F804 W808	F720-I723 PolarHBondContact O-N 2.87Å; F720-C724 WeakPolarHBondContact CE2-SG 3.49Å; F720-C724 WeakPolarHBondContact CZ-SG 3.23Å; F720-C724 WeakPolarHBondContact O-CB 3.36Å; F720-C724 PolarHBondContact O-N 3.03Å; F720-C724 PolarHBondContact O-SG 2.98Å; F720-C724 VanDerWaalsContact O-SG 3.41Å; F720-F796 AromaticContact CE1-CE1 3.96Å; F720-F796 HydrophobicContact CE1-CE1 3.96Å; F720-F796 HydrophobicContact CE1-CZ 4.44Å; F720-F796 HydrophobicContact CZ-CE1 4.37Å; F720-F804 HydrophobicContact CD2-CZ 4.37Å; F720-F804 HydrophobicContact CE1-CE2 4.45Å; F720-F804 AromaticContact CE2-CE2 3.51Å; F720-F804 HydrophobicContact CE2-CE2 3.51Å; F720-F804 AromaticContact CE2-CZ 3.65Å; F720-F804 HydrophobicContact CE2-CZ 3.65Å; F720-F804 HydrophobicContact CZ-CD2 4.41Å; F720-F804 AromaticContact CZ-CE2 3.45Å; F720-F804 HydrophobicContact CZ-CE2 3.45Å; F720-F804 VanDerWaalsContact CZ-CE2 3.45Å; F720-F804 HydrophobicContact CZ-CZ 4.06Å; F720-W808 AromaticContact CD2-CE2 3.79Å; F720-W808 AromaticContact CD2-CZ2 3.71Å; F720-W808 HydrophobicContact CD2-CZ2 3.71Å; F720-W808 AromaticContact CD2-NE1 3.61Å; F720-W808 AromaticContact CE2-CE2 3.91Å; F720-W808 HydrophobicContact CE2-CZ2 4.26Å; F720-W808 AromaticContact CE2-NE1 3.5Å
721	W	43.4	Very low	43.4	Very low	81 Å²	81	59.8 Å²	59.8	31%	0.307	31%	0.305	S	S	.	.	H	α-helix	trans	-67.4	-44.7	-179.9	-130.8	101.8	0	0	0	114	S719 I723 C724 Q725 V793 P885	S719-W721 PolarHBondContact O-N 3.12Å; S719-W721 PolarHBondContact OG-N 3.17Å; W721-I723 VanDerWaalsContact C-N 3.31Å; W721-I723 PolarHBondContact O-N 3.02Å; W721-C724 PolarHBondContact O-N 2.75Å; W721-Q725 HydrophobicContact CE3-CB 4.04Å; W721-Q725 HydrophobicContact CZ3-CB 4.02Å; W721-Q725 HydrophobicContact CZ3-CG 4.36Å; W721-Q725 WeakPolarHBondContact O-CB 3.38Å; W721-Q725 PolarHBondContact O-N 3.45Å; W721-V793 HydrophobicContact CH2-CG2 3.88Å; W721-V793 HydrophobicContact CZ2-CB 4.35Å; W721-V793 HydrophobicContact CZ2-CG1 4.07Å; W721-V793 HydrophobicContact CZ2-CG2 3.91Å; W721-P885 HydrophobicContact CB-CG 4.32Å; W721-P885 HydrophobicContact CE3-CB 4.47Å; W721-P885 HydrophobicContact CE3-CG 4.36Å
722	D	43.7	Very low	43	Very low	28 Å²	28	60.5 Å²	60.5	15%	0.15	31%	0.313	C	S	.	.	H	α-helix	trans	-61.8	-40.6	176.8	-71	-61.8	0	0	0	110.7	L718 S719 Q725 S726	L718-D722 HydrophobicContact CB-CB 4.45Å; S719-D722 PolarHBondContact N-OD2 3.15Å; S719-D722 PolarHBondContact O-N 2.76Å; S719-D722 WeakPolarHBondContact OG-CB 3.39Å; S719-D722 PolarHBondContact OG-N 3.24Å; S719-D722 PolarHBondContact OG-OD2 2.92Å; D722-Q725 PolarHBondContact O-N 3.43Å; D722-S726 VanDerWaalsContact O-CB 3.28Å; D722-S726 WeakPolarHBondContact O-CB 3.42Å; D722-S726 PolarHBondContact O-N 3.49Å
723	I	45.6	Very low	42.4	Very low	17 Å²	17	59.6 Å²	59.6	9%	0.087	31%	0.313	C	S	.	.	H	α-helix	trans	-72.8	-40	-179.9	-54	164.8	0	0	0	110.7	L718 S719 F720 W721 S726 G727 W808 I811	L718-I723 HydrophobicContact CB-CD1 3.89Å; L718-I723 HydrophobicContact CB-CG1 3.72Å; L718-I723 HydrophobicContact CD1-CG1 3.93Å; L718-I723 HydrophobicContact CG-CG1 4.5Å; S719-I723 WeakPolarHBondContact O-CG1 3.49Å; S719-I723 PolarHBondContact O-N 3.04Å; S719-I723 VanDerWaalsContact O-N 3.15Å; F720-I723 PolarHBondContact O-N 2.87Å; W721-I723 VanDerWaalsContact C-N 3.31Å; W721-I723 PolarHBondContact O-N 3.02Å; I723-S726 WeakPolarHBondContact O-CB 3.47Å; I723-S726 PolarHBondContact O-N 3.31Å; I723-G727 PolarHBondContact O-N 2.87Å; I723-W808 HydrophobicContact CB-CH2 3.81Å; I723-W808 HydrophobicContact CB-CZ3 4.17Å; I723-W808 HydrophobicContact CD1-CH2 3.75Å; I723-W808 HydrophobicContact CG1-CH2 4.39Å; I723-W808 HydrophobicContact CG2-CH2 3.55Å; I723-W808 HydrophobicContact CG2-CZ3 3.41Å; I723-W808 VanDerWaalsContact CG2-CZ3 3.41Å; I723-I811 HydrophobicContact CG2-CG2 4.04Å
724	C	42.9	Very low	41.8	Very low	18 Å²	18	58.2 Å²	58.2	12%	0.122	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-42.2	170.9	-76.2	0	0	0	0	112.7	F720 W721 G727 V728	F720-C724 WeakPolarHBondContact CE2-SG 3.49Å; F720-C724 WeakPolarHBondContact CZ-SG 3.23Å; F720-C724 WeakPolarHBondContact O-CB 3.36Å; F720-C724 PolarHBondContact O-N 3.03Å; F720-C724 PolarHBondContact O-SG 2.98Å; F720-C724 VanDerWaalsContact O-SG 3.41Å; W721-C724 PolarHBondContact O-N 2.75Å; C724-G727 PolarHBondContact O-N 3.34Å; C724-V728 WeakPolarHBondContact O-CB 3.41Å; C724-V728 WeakPolarHBondContact O-CG2 3.47Å; C724-V728 PolarHBondContact O-N 3.26Å
725	Q	44.3	Very low	41.6	Very low	94 Å²	94	58.1 Å²	58.1	44%	0.439	32%	0.315	S	S	.	.	H	α-helix	trans	-66.7	-40.8	177.2	-175.6	173.2	-11.7	0	0	111.3	W721 D722 T729	W721-Q725 HydrophobicContact CE3-CB 4.04Å; W721-Q725 HydrophobicContact CZ3-CB 4.02Å; W721-Q725 HydrophobicContact CZ3-CG 4.36Å; W721-Q725 WeakPolarHBondContact O-CB 3.38Å; W721-Q725 PolarHBondContact O-N 3.45Å; D722-Q725 PolarHBondContact O-N 3.43Å; Q725-T729 VanDerWaalsContact O-CB 3.23Å; Q725-T729 WeakPolarHBondContact O-CB 3.16Å; Q725-T729 PolarHBondContact O-N 3.48Å; Q725-T729 PolarHBondContact O-OG1 3.28Å
726	S	43	Very low	41.2	Very low	32 Å²	32	57.8 Å²	57.8	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-56.4	-52.7	170.4	176.1	0	0	0	0	110.8	D722 I723 V728 T729 R730 Q815	D722-S726 VanDerWaalsContact O-CB 3.28Å; D722-S726 WeakPolarHBondContact O-CB 3.42Å; D722-S726 PolarHBondContact O-N 3.49Å; I723-S726 WeakPolarHBondContact O-CB 3.47Å; I723-S726 PolarHBondContact O-N 3.31Å; S726-V728 PolarHBondContact O-N 3.05Å; S726-T729 PolarHBondContact O-N 3.37Å; S726-R730 VanDerWaalsContact O-CB 3.31Å; S726-R730 WeakPolarHBondContact O-CB 3.3Å; S726-R730 WeakPolarHBondContact O-CG 3.36Å; S726-R730 PolarHBondContact O-N 3.03Å; S726-R730 PolarHBondContact OG-NH1 3.38Å; S726-Q815 PolarHBondContact OG-OE1 3.47Å; S726-Q815 VanDerWaalsContact OG-OE1 3.11Å
727	G	40.2	Very low	40.8	Very low	9 Å²	9	56.2 Å²	56.2	9%	0.093	31%	0.31	C	S	.	.	H	α-helix	trans	-59.2	-47.1	179.8	0	0	0	0	0	113.5	I723 C724 A731	I723-G727 PolarHBondContact O-N 2.87Å; C724-G727 PolarHBondContact O-N 3.34Å; G727-A731 WeakPolarHBondContact O-CB 3.48Å; G727-A731 PolarHBondContact O-N 2.97Å
728	V	43.9	Very low	40.6	Very low	66 Å²	66	57.7 Å²	57.7	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-66.4	-40.4	177.4	170.6	0	0	0	0	111.6	C724 S726 S732 F807	C724-V728 WeakPolarHBondContact O-CB 3.41Å; C724-V728 WeakPolarHBondContact O-CG2 3.47Å; C724-V728 PolarHBondContact O-N 3.26Å; S726-V728 PolarHBondContact O-N 3.05Å; V728-S732 VanDerWaalsContact O-CB 3.31Å; V728-S732 WeakPolarHBondContact O-CB 3.32Å; V728-S732 PolarHBondContact O-N 3.25Å; V728-S732 PolarHBondContact O-OG 3.48Å; V728-F807 HydrophobicContact CG2-CZ 4Å
729	T	38.8	Very low	40.3	Very low	62 Å²	62	58.3 Å²	58.3	38%	0.38	33%	0.326	S	S	.	.	H	α-helix	trans	-68.7	-41.6	178.8	-53.4	0	0	0	0	111	Q725 S726 S732 L733	Q725-T729 VanDerWaalsContact O-CB 3.23Å; Q725-T729 WeakPolarHBondContact O-CB 3.16Å; Q725-T729 PolarHBondContact O-N 3.48Å; Q725-T729 PolarHBondContact O-OG1 3.28Å; S726-T729 PolarHBondContact O-N 3.37Å; T729-S732 PolarHBondContact O-N 3.19Å; T729-L733 PolarHBondContact O-N 3.01Å
730	R	39	Very low	39.9	Very low	122 Å²	122	62.4 Å²	62.4	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-71.1	-38.3	176.6	-75.1	-178.8	161.3	117.1	5.2	112.6	S726 L733 L734	S726-R730 VanDerWaalsContact O-CB 3.31Å; S726-R730 WeakPolarHBondContact O-CB 3.3Å; S726-R730 WeakPolarHBondContact O-CG 3.36Å; S726-R730 PolarHBondContact O-N 3.03Å; S726-R730 PolarHBondContact OG-NH1 3.38Å; R730-L733 CarbonylContact O-C 3.52Å; R730-L733 WeakPolarHBondContact O-CB 3.41Å; R730-L733 PolarHBondContact O-N 3.22Å; R730-L734 WeakPolarHBondContact O-CB 3.32Å; R730-L734 PolarHBondContact O-N 3.06Å
731	A	37.4	Very low	39.5	Very low	46 Å²	46	62.4 Å²	62.4	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-37.8	172	0	0	0	0	0	112.4	G727 L734 S735	G727-A731 WeakPolarHBondContact O-CB 3.48Å; G727-A731 PolarHBondContact O-N 2.97Å; A731-L734 PolarHBondContact O-N 2.77Å; A731-S735 PolarHBondContact O-N 3.3Å
732	S	37.1	Very low	39.2	Very low	58 Å²	58	64.5 Å²	64.5	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-61.4	-46.3	171.9	-59.1	0	0	0	0	110.9	V728 T729 S735 V736	V728-S732 VanDerWaalsContact O-CB 3.31Å; V728-S732 WeakPolarHBondContact O-CB 3.32Å; V728-S732 PolarHBondContact O-N 3.25Å; V728-S732 PolarHBondContact O-OG 3.48Å; T729-S732 PolarHBondContact O-N 3.19Å; S732-S735 PolarHBondContact O-N 3.44Å; S732-S735 PolarHBondContact O-OG 3.15Å; S732-V736 WeakPolarHBondContact O-CG2 3.45Å; S732-V736 PolarHBondContact O-N 3.34Å
733	L	35.9	Very low	38.9	Very low	102 Å²	102	68.1 Å²	68.1	53%	0.534	39%	0.386	S	S	.	.	H	α-helix	trans	-59.7	-42.5	172.9	-102.7	159.1	0	0	0	112.6	T729 R730 S735 V736 T737	T729-L733 PolarHBondContact O-N 3.01Å; R730-L733 CarbonylContact O-C 3.52Å; R730-L733 WeakPolarHBondContact O-CB 3.41Å; R730-L733 PolarHBondContact O-N 3.22Å; L733-S735 PolarHBondContact O-N 3.2Å; L733-V736 CarbonylContact O-C 3.55Å; L733-V736 WeakPolarHBondContact O-CA 3.41Å; L733-V736 WeakPolarHBondContact O-CB 3.36Å; L733-V736 PolarHBondContact O-N 2.65Å; L733-T737 PolarHBondContact O-N 2.65Å; L733-T737 PolarHBondContact O-OG1 2.7Å
734	L	37	Very low	38.5	Very low	80 Å²	80	72 Å²	72	42%	0.419	41%	0.406	S	S	.	.	H	α-helix	trans	-61.6	-45.7	-179.8	-165.5	70.7	0	0	0	111.3	R730 A731 V736 T737 D738	R730-L734 WeakPolarHBondContact O-CB 3.32Å; R730-L734 PolarHBondContact O-N 3.06Å; A731-L734 PolarHBondContact O-N 2.77Å; L734-V736 PolarHBondContact O-N 2.77Å; L734-T737 WeakPolarHBondContact CA-OG1 3.49Å; L734-T737 PolarHBondContact O-N 3.18Å; L734-T737 VanDerWaalsContact O-N 3.13Å; L734-T737 PolarHBondContact O-OG1 2.64Å; L734-D738 WeakPolarHBondContact O-CB 3.13Å; L734-D738 VanDerWaalsContact O-CG 3.3Å; L734-D738 PolarHBondContact O-N 3.39Å
735	S	39.2	Very low	38	Very low	65 Å²	65	75.6 Å²	75.6	46%	0.455	42%	0.424	S	S	.	.	H	α-helix	trans	-62.2	-28.7	173.9	70.5	0	0	0	0	113.6	A731 S732 L733 S739	A731-S735 PolarHBondContact O-N 3.3Å; S732-S735 PolarHBondContact O-N 3.44Å; S732-S735 PolarHBondContact O-OG 3.15Å; L733-S735 PolarHBondContact O-N 3.2Å; S735-S739 VanDerWaalsContact O-CB 3.31Å; S735-S739 WeakPolarHBondContact O-CB 3.42Å; S735-S739 PolarHBondContact O-N 2.89Å; S735-S739 VanDerWaalsContact O-N 3.1Å; S735-S739 PolarHBondContact O-OG 2.9Å
736	V	35	Very low	37.6	Very low	78 Å²	78	77.8 Å²	77.8	47%	0.473	44%	0.437	S	S	.	.	H	α-helix	trans	-76.7	-38.7	174	169.6	0	0	0	0	111	S732 L733 L734 S739 I740	S732-V736 WeakPolarHBondContact O-CG2 3.45Å; S732-V736 PolarHBondContact O-N 3.34Å; L733-V736 CarbonylContact O-C 3.55Å; L733-V736 WeakPolarHBondContact O-CA 3.41Å; L733-V736 WeakPolarHBondContact O-CB 3.36Å; L733-V736 PolarHBondContact O-N 2.65Å; L734-V736 PolarHBondContact O-N 2.77Å; V736-S739 PolarHBondContact O-N 2.82Å; V736-I740 HydrophobicContact CG1-CD1 3.9Å; V736-I740 WeakPolarHBondContact O-CB 3.49Å; V736-I740 WeakPolarHBondContact O-CD1 3.29Å; V736-I740 VanDerWaalsContact O-CG1 3.22Å; V736-I740 WeakPolarHBondContact O-CG1 3.36Å; V736-I740 PolarHBondContact O-N 3.13Å
737	T	37	Very low	37.3	Very low	61 Å²	61	84.1 Å²	84.1	37%	0.374	46%	0.461	S	S	.	.	H	α-helix	trans	-69.9	-39.4	174.4	49.3	0	0	0	0	112.1	L733 L734 S739 I740 S741	L733-T737 PolarHBondContact O-N 2.65Å; L733-T737 PolarHBondContact O-OG1 2.7Å; L734-T737 WeakPolarHBondContact CA-OG1 3.49Å; L734-T737 PolarHBondContact O-N 3.18Å; L734-T737 VanDerWaalsContact O-N 3.13Å; L734-T737 PolarHBondContact O-OG1 2.64Å; T737-S739 VanDerWaalsContact C-N 3.33Å; T737-S739 PolarHBondContact O-N 3.37Å; T737-I740 CarbonylContact O-C 3.58Å; T737-I740 WeakPolarHBondContact O-CA 3.22Å; T737-I740 WeakPolarHBondContact O-CB 3.22Å; T737-I740 PolarHBondContact O-N 3.48Å; T737-S741 PolarHBondContact O-N 2.99Å; T737-S741 PolarHBondContact O-OG 3.47Å
738	D	37.2	Very low	36.9	Very low	82 Å²	82	87.3 Å²	87.3	44%	0.439	48%	0.481	S	S	.	.	H	α-helix	trans	-62.5	-41.7	173.6	-69.1	-19.6	0	0	0	111	L734 I740 S741 Q742	L734-D738 WeakPolarHBondContact O-CB 3.13Å; L734-D738 VanDerWaalsContact O-CG 3.3Å; L734-D738 PolarHBondContact O-N 3.39Å; D738-I740 VanDerWaalsContact C-N 3.27Å; D738-I740 PolarHBondContact O-N 3.25Å; D738-S741 PolarHBondContact O-N 3.48Å; D738-Q742 WeakPolarHBondContact O-CG 3.47Å; D738-Q742 PolarHBondContact O-N 2.86Å
739	S	37.6	Very low	36.1	Very low	64 Å²	64	91.4 Å²	91.4	45%	0.448	50%	0.501	S	S	.	.	H	α-helix	trans	-62.2	-33.5	172.2	-61.7	0	0	0	0	112.4	S735 V736 T737 I743	S735-S739 VanDerWaalsContact O-CB 3.31Å; S735-S739 WeakPolarHBondContact O-CB 3.42Å; S735-S739 PolarHBondContact O-N 2.89Å; S735-S739 VanDerWaalsContact O-N 3.1Å; S735-S739 PolarHBondContact O-OG 2.9Å; V736-S739 PolarHBondContact O-N 2.82Å; T737-S739 VanDerWaalsContact C-N 3.33Å; T737-S739 PolarHBondContact O-N 3.37Å; S739-I743 VanDerWaalsContact O-CD1 3.3Å; S739-I743 WeakPolarHBondContact O-CD1 3.33Å; S739-I743 WeakPolarHBondContact O-CG1 3.08Å; S739-I743 PolarHBondContact O-N 2.98Å
740	I	36.5	Very low	35.8	Very low	86 Å²	86	92.9 Å²	92.9	44%	0.441	51%	0.514	S	S	.	.	H	α-helix	trans	-75.9	-41.6	177.1	-73.6	164.8	0	0	0	111.1	V736 T737 D738 I743 I744	V736-I740 HydrophobicContact CG1-CD1 3.9Å; V736-I740 WeakPolarHBondContact O-CB 3.49Å; V736-I740 WeakPolarHBondContact O-CD1 3.29Å; V736-I740 VanDerWaalsContact O-CG1 3.22Å; V736-I740 WeakPolarHBondContact O-CG1 3.36Å; V736-I740 PolarHBondContact O-N 3.13Å; T737-I740 CarbonylContact O-C 3.58Å; T737-I740 WeakPolarHBondContact O-CA 3.22Å; T737-I740 WeakPolarHBondContact O-CB 3.22Å; T737-I740 PolarHBondContact O-N 3.48Å; D738-I740 VanDerWaalsContact C-N 3.27Å; D738-I740 PolarHBondContact O-N 3.25Å; I740-I743 CarbonylContact O-C 3.54Å; I740-I743 WeakPolarHBondContact O-CA 3.42Å; I740-I743 PolarHBondContact O-N 2.96Å; I740-I743 VanDerWaalsContact O-N 3.1Å; I740-I744 HydrophobicContact CG2-CD1 3.76Å; I740-I744 HydrophobicContact CG2-CG1 4.42Å; I740-I744 WeakPolarHBondContact O-CG1 3.38Å; I740-I744 PolarHBondContact O-N 2.8Å
741	S	34.6	Very low	35.3	Very low	59 Å²	59	94.3 Å²	94.3	41%	0.413	53%	0.531	S	S	.	.	H	α-helix	trans	-60	-47.2	174.4	-62.6	0	0	0	0	110.9	T737 D738 I743 I744 D745	T737-S741 PolarHBondContact O-N 2.99Å; T737-S741 PolarHBondContact O-OG 3.47Å; D738-S741 PolarHBondContact O-N 3.48Å; S741-I743 PolarHBondContact O-N 3.06Å; S741-I744 CarbonylContact O-C 3.53Å; S741-I744 WeakPolarHBondContact O-CA 3.35Å; S741-I744 WeakPolarHBondContact O-CB 3.39Å; S741-I744 PolarHBondContact O-N 3.32Å; S741-D745 PolarHBondContact O-N 2.95Å
742	Q	37.3	Very low	34.9	Very low	125 Å²	125	99.6 Å²	99.6	58%	0.584	55%	0.553	S	S	*	*	H	α-helix	trans	-58.6	-33.7	173.5	-70.1	175	21.2	0	0	112.7	D738 I746	D738-Q742 WeakPolarHBondContact O-CG 3.47Å; D738-Q742 PolarHBondContact O-N 2.86Å; Q742-I746 WeakPolarHBondContact O-CB 3.2Å; Q742-I746 VanDerWaalsContact O-CD1 3.3Å; Q742-I746 WeakPolarHBondContact O-CD1 3.39Å; Q742-I746 WeakPolarHBondContact O-CG1 3.36Å; Q742-I746 PolarHBondContact O-N 3.14Å
743	I	37.8	Very low	34.5	Very low	104 Å²	104	105.2 Å²	105.2	53%	0.533	58%	0.578	S	S	.	*	H	α-helix	trans	-76.4	-23.8	175.3	-72.4	168	0	0	0	112.6	S739 I740 S741	S739-I743 VanDerWaalsContact O-CD1 3.3Å; S739-I743 WeakPolarHBondContact O-CD1 3.33Å; S739-I743 WeakPolarHBondContact O-CG1 3.08Å; S739-I743 PolarHBondContact O-N 2.98Å; I740-I743 CarbonylContact O-C 3.54Å; I740-I743 WeakPolarHBondContact O-CA 3.42Å; I740-I743 PolarHBondContact O-N 2.96Å; I740-I743 VanDerWaalsContact O-N 3.1Å; S741-I743 PolarHBondContact O-N 3.06Å
744	I	36.5	Very low	34.1	Very low	100 Å²	100	103.3 Å²	103.3	51%	0.513	58%	0.584	S	S	.	*	H	α-helix	trans	-80.6	-42.7	174.2	-71.3	167.4	0	0	0	110.4	I740 S741 I746 K747 S748	I740-I744 HydrophobicContact CG2-CD1 3.76Å; I740-I744 HydrophobicContact CG2-CG1 4.42Å; I740-I744 WeakPolarHBondContact O-CG1 3.38Å; I740-I744 PolarHBondContact O-N 2.8Å; S741-I744 CarbonylContact O-C 3.53Å; S741-I744 WeakPolarHBondContact O-CA 3.35Å; S741-I744 WeakPolarHBondContact O-CB 3.39Å; S741-I744 PolarHBondContact O-N 3.32Å; I744-I746 VanDerWaalsContact C-N 3.33Å; I744-I746 PolarHBondContact O-N 3.23Å; I744-K747 CarbonylContact O-C 3.56Å; I744-K747 WeakPolarHBondContact O-CA 3.37Å; I744-K747 WeakPolarHBondContact O-CB 3.39Å; I744-K747 PolarHBondContact O-N 3Å; I744-S748 PolarHBondContact O-N 3.22Å
745	D	33.6	Very low	33.7	Very low	93 Å²	93	104.3 Å²	104.3	50%	0.497	60%	0.597	S	S	.	*	H	α-helix	trans	-64	-38.8	177.4	-66.9	-31.8	0	0	0	111.6	S741 K747 S748 D749	S741-D745 PolarHBondContact O-N 2.95Å; D745-K747 PolarHBondContact O-N 3.48Å; D745-S748 WeakPolarHBondContact CA-OG 3.44Å; D745-S748 PolarHBondContact O-N 2.65Å; D745-S748 PolarHBondContact O-OG 3.42Å; D745-S748 VanDerWaalsContact O-OG 3.14Å; D745-D749 PolarHBondContact O-N 2.94Å
746	I	36.2	Very low	33.1	Very low	140 Å²	140	107.9 Å²	107.9	72%	0.718	61%	0.611	S	S	*	*	H	α-helix	trans	-62.9	-3.7	169.9	-70.4	169.2	0	0	0	112.9	Q742 I744	Q742-I746 WeakPolarHBondContact O-CB 3.2Å; Q742-I746 VanDerWaalsContact O-CD1 3.3Å; Q742-I746 WeakPolarHBondContact O-CD1 3.39Å; Q742-I746 WeakPolarHBondContact O-CG1 3.36Å; Q742-I746 PolarHBondContact O-N 3.14Å; I744-I746 VanDerWaalsContact C-N 3.33Å; I744-I746 PolarHBondContact O-N 3.23Å
747	K	34.9	Very low	33	Very low	165 Å²	165	111 Å²	111	72%	0.717	63%	0.625	S	S	*	*	H	α-helix	trans	-121.3	-9.6	174.8	-73.5	-175.3	174.3	-177.9	0	115.3	I744 D745	I744-K747 CarbonylContact O-C 3.56Å; I744-K747 WeakPolarHBondContact O-CA 3.37Å; I744-K747 WeakPolarHBondContact O-CB 3.39Å; I744-K747 PolarHBondContact O-N 3Å; D745-K747 PolarHBondContact O-N 3.48Å
748	S	31.7	Very low	32.7	Very low	75 Å²	75	113.7 Å²	113.7	52%	0.524	65%	0.646	S	S	.	*	H	α-helix	trans	-87.9	-26.7	171.2	51.1	0	0	0	0	112.1	I744 D745 S750	I744-S748 PolarHBondContact O-N 3.22Å; D745-S748 WeakPolarHBondContact CA-OG 3.44Å; D745-S748 PolarHBondContact O-N 2.65Å; D745-S748 PolarHBondContact O-OG 3.42Å; D745-S748 VanDerWaalsContact O-OG 3.14Å; S748-S750 PolarHBondContact O-N 3.26Å
749	D	27.9	Very low	32.5	Very low	152 Å²	152	115.8 Å²	115.8	81%	0.813	66%	0.664	S	S	*	*			trans	-73.2	69.3	174.8	-87.2	-14.5	0	0	0	113.3	D745	D745-D749 PolarHBondContact O-N 2.94Å
750	S	32.2	Very low	32.2	Very low	93 Å²	93	118.1 Å²	118.1	65%	0.65	68%	0.681	S	S	*	*	S	Bend	trans	-131.6	58	166.1	60.1	0	0	0	0	112.9	S748	S748-S750 PolarHBondContact O-N 3.26Å
751	N	29.5	Very low	31.6	Very low	153 Å²	153	121.3 Å²	121.3	82%	0.818	70%	0.699	S	S	*	*			trans	63.8	126.9	160.9	-60.3	-37.1	0	0	0	118.7
752	N	28.8	Very low	31.3	Very low	156 Å²	156	124.8 Å²	124.8	83%	0.834	72%	0.718	S	S	*	*				-154.1	112.4	129.5	-114.6	-40	0	0	0	113.5
753	N	27.3	Very low	30.7	Very low	176 Å²	176	126.2 Å²	126.2	94%	0.941	73%	0.729	S	S	*	*			trans	-167	96	157.2	-104.1	-33.2	0	0	0	107.3
754	G	28.8	Very low	30.7	Very low	63 Å²	63	126.4 Å²	126.4	65%	0.649	74%	0.737	S	S	*	*			trans	-168.5	4.9	-164.5	0	0	0	0	0	120.4
755	S	27.7	Very low	30.1	Very low	100 Å²	100	126.4 Å²	126.4	70%	0.699	75%	0.746	S	S	*	*			trans	59.8	137.7	162.7	71.6	0	0	0	0	121.5
756	N	27.4	Very low	29.7	Very low	141 Å²	141	128.4 Å²	128.4	75%	0.754	76%	0.761	S	S	*	*			trans	86.8	139.9	148.8	-56.7	-25.6	0	0	0	122.1
757	N	32.9	Very low	29	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	76%	0.764	S	S	*	*			trans	79.9	77.4	153.7	-62.3	-8.7	0	0	0	121.4
758	S	30.7	Very low	28.6	Very low	117 Å²	117	128.6 Å²	128.6	82%	0.818	77%	0.77	S	S	*	*				79.5	155.5	122.8	-57.2	0	0	0	0	120.7
759	P	33.6	Very low	28.2	Very low	126 Å²	126	130.5 Å²	130.5	82%	0.818	78%	0.779	S	S	*	*			trans	-122.2	158.5	-158.7	40.8	-26.9	0	0	0	116.2
760	S	29.6	Very low	28	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	78%	0.775	S	S	*	*			trans	-157.3	136.6	159.4	61.1	0	0	0	0	114
761	N	24.4	Very low	27.6	Very low	152 Å²	152	131.1 Å²	131.1	81%	0.813	78%	0.783	S	S	*	*			trans	-24	153.9	162.1	-46.2	-35	0	0	0	116.2
762	T	29.1	Very low	27.4	Very low	132 Å²	132	128.8 Å²	128.8	81%	0.81	78%	0.778	S	S	*	*			cis	-159.3	154.8	49.5	47.5	0	0	0	0	115.9
763	N	24	Very low	27.1	Very low	155 Å²	155	126.7 Å²	126.7	83%	0.829	78%	0.776	S	S	*	*			trans	-77.7	-175.6	160.5	-75.1	-26.1	0	0	0	111.9
764	P	38.8	Very low	26.9	Very low	108 Å²	108	125.9 Å²	125.9	70%	0.701	77%	0.769	S	S	*	*				-138.2	-171.2	-52.1	40.1	-23	0	0	0	113.7
765	S	22.5	Very low	26.8	Very low	101 Å²	101	128.4 Å²	128.4	71%	0.706	78%	0.775	S	S	*	*			trans	63.5	141.1	147.7	66.3	0	0	0	0	123.1
766	V	25.4	Very low	26.6	Very low	134 Å²	134	129.9 Å²	129.9	81%	0.812	78%	0.78	S	S	*	*				170.6	150.5	116.4	155.4	0	0	0	0	111.6
767	N	22.4	Very low	26.5	Very low	145 Å²	145	128.6 Å²	128.6	78%	0.775	78%	0.777	S	S	*	*			trans	-67.4	163.2	-179.6	-47.2	-45.5	0	0	0	114.4
768	I	26.1	Very low	26.1	Very low	164 Å²	164	127 Å²	127	84%	0.841	78%	0.777	S	S	*	*				179.8	160.8	112	-92.8	163.9	0	0	0	111.5
769	T	22.6	Very low	25.9	Very low	116 Å²	116	126.2 Å²	126.2	71%	0.712	77%	0.768	S	S	*	*			trans	-91	170	-172.3	52.8	0	0	0	0	114.7
770	S	24.2	Very low	25.4	Very low	103 Å²	103	129.1 Å²	129.1	72%	0.72	77%	0.767	S	S	*	*			trans	66.6	148.3	159.6	38.9	0	0	0	0	117
771	D	24.5	Very low	25.2	Very low	154 Å²	154	134.1 Å²	134.1	82%	0.824	77%	0.768	S	S	*	*			cis	-145	179.3	9.3	-138.5	-39.4	0	0	0	113.6
772	S	23.8	Very low	25.2	Very low	104 Å²	104	130.7 Å²	130.7	73%	0.727	75%	0.753	S	S	*	*			trans	-70.8	144	-165.9	65.3	0	0	0	0	117.9
773	S	24.1	Very low	25	Very low	112 Å²	112	131.1 Å²	131.1	78%	0.783	75%	0.749	S	S	*	*			trans	-168.9	148.8	131.6	53.7	0	0	0	0	114.1
774	M	22.8	Very low	25	Very low	160 Å²	160	130.5 Å²	130.5	79%	0.788	75%	0.745	S	S	*	*			trans	40.1	93.6	155.7	-67	-89.3	79.6	0	0	120.6
775	C	26.7	Very low	24.4	Very low	116 Å²	116	128.4 Å²	128.4	78%	0.784	73%	0.731	S	S	*	*			trans	-156.4	71.6	140.3	-151.6	0	0	0	0	114.1	V777	C775-V777 VanDerWaalsContact C-N 3.34Å; C775-V777 PolarHBondContact O-N 2.99Å
776	T	23	Very low	24.6	Very low	131 Å²	131	127.2 Å²	127.2	80%	0.804	72%	0.721	S	S	*	*			trans	-86.2	67	173.4	50.3	0	0	0	0	111.8
777	V	25.7	Very low	24.8	Very low	114 Å²	114	127 Å²	127	69%	0.691	72%	0.72	S	S	*	*			trans	-139.6	112.6	-176.8	177.2	0	0	0	0	112.1	C775	C775-V777 VanDerWaalsContact C-N 3.34Å; C775-V777 PolarHBondContact O-N 2.99Å
778	S	24.5	Very low	25	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	72%	0.721	S	S	*	*			trans	49.3	139.3	147.9	-94.9	0	0	0	0	120.8
779	T	25.6	Very low	25	Very low	100 Å²	100	128 Å²	128	61%	0.613	72%	0.716	S	S	*	*			cis	-142	151.1	9.1	58.3	0	0	0	0	106.8
780	K	23.9	Very low	25.2	Very low	186 Å²	186	132.2 Å²	132.2	81%	0.809	72%	0.719	S	S	*	*			cis	51.1	49	26.4	-111.3	-160.8	177.9	-177.9	0	114.9	V782	K780-V782 HydrophobicContact CB-CG2 4.39Å; K780-V782 HydrophobicContact CD-CG2 4.1Å; K780-V782 HydrophobicContact CG-CG2 3.9Å; K780-V782 WeakPolarHBondContact O-CB 3.43Å
781	R	25	Very low	25.2	Very low	219 Å²	219	130 Å²	130	83%	0.826	71%	0.713	S	S	*	*			trans	-84.6	111.6	139.8	-62.7	-178.8	-176.1	-176.8	0.8	105.3
782	V	23.9	Very low	25.3	Very low	80 Å²	80	128.7 Å²	128.7	49%	0.485	71%	0.712	S	S	.	*			cis	40.8	64.6	15.8	-166.2	0	0	0	0	110.3	K780 N784	K780-V782 HydrophobicContact CB-CG2 4.39Å; K780-V782 HydrophobicContact CD-CG2 4.1Å; K780-V782 HydrophobicContact CG-CG2 3.9Å; K780-V782 WeakPolarHBondContact O-CB 3.43Å; V782-N784 VanDerWaalsContact CG1-OD1 3.29Å; V782-N784 WeakPolarHBondContact CG1-OD1 3.33Å; V782-N784 PolarHBondContact O-N 3.27Å
783	I	24.8	Very low	25.5	Very low	141 Å²	141	128 Å²	128	72%	0.723	70%	0.703	S	S	*	*			trans	-60.7	101.7	149.2	-46.2	179.7	0	0	0	104.3	V785	I783-V785 HydrophobicContact CB-CG2 4.13Å; I783-V785 HydrophobicContact CG2-CG2 3.49Å; I783-V785 VanDerWaalsContact CG2-CG2 3.49Å; I783-V785 PolarHBondContact O-N 2.96Å
784	N	25.3	Very low	25.6	Very low	142 Å²	142	127.9 Å²	127.9	76%	0.759	70%	0.701	S	S	*	*			trans	-69.1	67.3	161.8	-89.1	-19.3	0	0	0	107.1	V782 P786	V782-N784 VanDerWaalsContact CG1-OD1 3.29Å; V782-N784 WeakPolarHBondContact CG1-OD1 3.33Å; V782-N784 PolarHBondContact O-N 3.27Å; N784-P786 WeakPolarHBondContact O-CD 3.22Å
785	V	24.9	Very low	25.8	Very low	65 Å²	65	123.4 Å²	123.4	39%	0.394	69%	0.69	S	S	.	*			trans	-58.7	121.9	153.9	-174.5	0	0	0	0	104.1	I783 T787	I783-V785 HydrophobicContact CB-CG2 4.13Å; I783-V785 HydrophobicContact CG2-CG2 3.49Å; I783-V785 VanDerWaalsContact CG2-CG2 3.49Å; I783-V785 PolarHBondContact O-N 2.96Å; V785-T787 VanDerWaalsContact C-N 3.31Å; V785-T787 PolarHBondContact O-N 2.62Å
786	P	27.8	Very low	26.2	Very low	76 Å²	76	122.9 Å²	122.9	49%	0.494	67%	0.674	S	S	.	*			trans	-65.1	100.8	168.2	27.1	-31.6	0	0	0	106.9	N784 Q788 H789	N784-P786 WeakPolarHBondContact O-CD 3.22Å; P786-Q788 PolarHBondContact O-N 3.2Å; P786-H789 PolarHBondContact O-N 3.32Å; P786-H789 VanDerWaalsContact O-N 3.08Å
787	T	29.5	Very low	26.4	Very low	129 Å²	129	123.7 Å²	123.7	79%	0.791	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	35.4	173.9	48.3	0	0	0	0	112.4	V785	V785-T787 VanDerWaalsContact C-N 3.31Å; V785-T787 PolarHBondContact O-N 2.62Å
788	Q	26.8	Very low	26.5	Very low	173 Å²	173	125.7 Å²	125.7	81%	0.808	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.7	-3.2	177.5	-60.8	-176.8	-8.8	0	0	111.1	P786	P786-Q788 PolarHBondContact O-N 3.2Å
789	H	26.1	Very low	26.9	Very low	156 Å²	156	123.8 Å²	123.8	72%	0.722	66%	0.66	S	S	*	*	S	Bend	trans	-121	-4.8	179.3	-75.5	83.6	0	0	0	114.5	P786 G791	P786-H789 PolarHBondContact O-N 3.32Å; P786-H789 VanDerWaalsContact O-N 3.08Å; H789-G791 PolarHBondContact O-N 3.02Å
790	W	26.3	Very low	27.4	Very low	206 Å²	206	125.2 Å²	125.2	78%	0.78	66%	0.663	S	S	*	*			trans	-78.5	98	157.2	-74.7	48.6	0	0	0	105.7
791	G	24.8	Very low	27.9	Very low	57 Å²	57	121.2 Å²	121.2	59%	0.588	65%	0.651	S	S	*	*			trans	-66.9	-173.4	174.3	0	0	0	0	0	111.7	H789 V793	H789-G791 PolarHBondContact O-N 3.02Å; G791-V793 PolarHBondContact O-N 3.13Å
792	P	25.4	Very low	28.5	Very low	126 Å²	126	116.7 Å²	116.7	82%	0.818	64%	0.643	S	S	*	*	S	Bend	trans	-54.9	141.1	163.6	28.1	-34.2	0	0	0	108.7	C794	P792-C794 PolarHBondContact O-N 3.21Å
793	V	29.4	Very low	29.1	Very low	88 Å²	88	120.1 Å²	120.1	53%	0.533	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-49.3	135.9	163.8	177.2	0	0	0	0	107.3	W721 G791 A795 F796	W721-V793 HydrophobicContact CH2-CG2 3.88Å; W721-V793 HydrophobicContact CZ2-CB 4.35Å; W721-V793 HydrophobicContact CZ2-CG1 4.07Å; W721-V793 HydrophobicContact CZ2-CG2 3.91Å; G791-V793 PolarHBondContact O-N 3.13Å; V793-A795 PolarHBondContact O-N 3.4Å; V793-F796 HydrophobicContact CG1-CE2 4.07Å
794	C	25.7	Very low	29.8	Very low	111 Å²	111	117 Å²	117	75%	0.75	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-47.8	127.4	-178.4	-67.1	0	0	0	0	109.5	P792 F796	P792-C794 PolarHBondContact O-N 3.21Å; C794-F796 PolarHBondContact O-N 2.88Å
795	A	26	Very low	30.5	Very low	66 Å²	66	113.8 Å²	113.8	55%	0.545	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-56.9	129.4	172.5	0	0	0	0	0	107.6	V793 D797	V793-A795 PolarHBondContact O-N 3.4Å; A795-D797 WeakPolarHBondContact CB-OD2 3.19Å; A795-D797 PolarHBondContact O-N 3.22Å
796	F	35.3	Very low	31.3	Very low	104 Å²	104	115.6 Å²	115.6	46%	0.456	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.5	2	-173.2	-77.5	-101.2	0	0	0	112.9	F720 V793 C794 I798 I799	F720-F796 AromaticContact CE1-CE1 3.96Å; F720-F796 HydrophobicContact CE1-CE1 3.96Å; F720-F796 HydrophobicContact CE1-CZ 4.44Å; F720-F796 HydrophobicContact CZ-CE1 4.37Å; V793-F796 HydrophobicContact CG1-CE2 4.07Å; C794-F796 PolarHBondContact O-N 2.88Å; F796-I798 PolarHBondContact O-N 3.05Å; F796-I798 VanDerWaalsContact O-N 3.07Å; F796-I799 HydrophobicContact CD1-CD1 3.67Å; F796-I799 HydrophobicContact CE1-CD1 4.25Å
797	D	27.3	Very low	32	Very low	148 Å²	148	116.4 Å²	116.4	79%	0.791	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-4	176.5	-46.2	-34.5	0	0	0	114.6	A795	A795-D797 WeakPolarHBondContact CB-OD2 3.19Å; A795-D797 PolarHBondContact O-N 3.22Å
798	I	29.4	Very low	32.7	Very low	156 Å²	156	112.8 Å²	112.8	80%	0.8	59%	0.594	S	S	*	*			trans	-135.3	68.8	179.1	-42.7	178.8	0	0	0	111	F796	F796-I798 PolarHBondContact O-N 3.05Å; F796-I798 VanDerWaalsContact O-N 3.07Å
799	I	32.7	Very low	33.5	Very low	71 Å²	71	107.1 Å²	107.1	36%	0.364	57%	0.569	S	S	.	*			trans	-128.4	119.9	163.3	-64.5	165.3	0	0	0	108.1	F796 F804	F796-I799 HydrophobicContact CD1-CD1 3.67Å; F796-I799 HydrophobicContact CE1-CD1 4.25Å; I799-F804 HydrophobicContact CG2-CB 3.89Å
800	N	34.7	Very low	34.4	Very low	129 Å²	129	104.6 Å²	104.6	69%	0.69	56%	0.558	S	S	*	*			trans	-70.9	133.1	159.4	-75.2	2	0	0	0	107.6	D802 F803	N800-D802 PolarHBondContact O-N 2.95Å; N800-F803 PolarHBondContact O-N 3.17Å
801	D	34.8	Very low	35.3	Very low	103 Å²	103	95.4 Å²	95.4	55%	0.551	52%	0.524	S	S	*	.	H	α-helix	trans	-51	-32.9	-174.2	-62.8	-50.8	0	0	0	113.6	F803 F804 N805	D801-F803 VanDerWaalsContact C-N 3.3Å; D801-F803 PolarHBondContact O-N 3.09Å; D801-F804 WeakPolarHBondContact O-CB 3.35Å; D801-F804 PolarHBondContact O-N 3.4Å; D801-N805 PolarHBondContact O-N 3.11Å; D801-N805 PolarHBondContact O-ND2 3.21Å; D801-N805 VanDerWaalsContact O-ND2 3.13Å
802	D	36.8	Very low	36.3	Very low	124 Å²	124	95.2 Å²	95.2	66%	0.663	51%	0.509	S	S	*	.	H	α-helix	trans	-54.3	-41.8	175.8	-55	-44.1	0	0	0	113.2	N800 V806	N800-D802 PolarHBondContact O-N 2.95Å; D802-V806 WeakPolarHBondContact O-CG2 3.49Å; D802-V806 PolarHBondContact O-N 2.89Å
803	F	36.9	Very low	37.3	Very low	151 Å²	151	92.4 Å²	92.4	66%	0.662	49%	0.487	S	S	*	.	H	α-helix	trans	-76.3	-30.7	-176.8	-156.7	-87.8	0	0	0	111.8	N800 D801 F807	N800-F803 PolarHBondContact O-N 3.17Å; D801-F803 VanDerWaalsContact C-N 3.3Å; D801-F803 PolarHBondContact O-N 3.09Å; F803-F807 VanDerWaalsContact O-CB 3.24Å; F803-F807 WeakPolarHBondContact O-CB 3.41Å; F803-F807 PolarHBondContact O-N 3.27Å; F803-F807 VanDerWaalsContact O-N 3.14Å
804	F	39.9	Very low	38.2	Very low	77 Å²	77	90.9 Å²	90.9	34%	0.338	48%	0.476	S	S	.	.	H	α-helix	trans	-59.8	-52.3	173.4	-174.8	-99.3	0	0	0	110.5	F720 I799 D801 V806 F807 W808	F720-F804 HydrophobicContact CD2-CZ 4.37Å; F720-F804 HydrophobicContact CE1-CE2 4.45Å; F720-F804 AromaticContact CE2-CE2 3.51Å; F720-F804 HydrophobicContact CE2-CE2 3.51Å; F720-F804 AromaticContact CE2-CZ 3.65Å; F720-F804 HydrophobicContact CE2-CZ 3.65Å; F720-F804 HydrophobicContact CZ-CD2 4.41Å; F720-F804 AromaticContact CZ-CE2 3.45Å; F720-F804 HydrophobicContact CZ-CE2 3.45Å; F720-F804 VanDerWaalsContact CZ-CE2 3.45Å; F720-F804 HydrophobicContact CZ-CZ 4.06Å; I799-F804 HydrophobicContact CG2-CB 3.89Å; D801-F804 WeakPolarHBondContact O-CB 3.35Å; D801-F804 PolarHBondContact O-N 3.4Å; F804-V806 PolarHBondContact O-N 3.3Å; F804-F807 PolarHBondContact O-N 3.35Å; F804-W808 AromaticContact CE1-CD1 3.45Å; F804-W808 VanDerWaalsContact CE1-CD1 3.45Å; F804-W808 AromaticContact CE1-NE1 3.88Å; F804-W808 AromaticContact CZ-CD1 3.65Å; F804-W808 AromaticContact CZ-NE1 3.72Å; F804-W808 WeakPolarHBondContact O-CB 3.13Å; F804-W808 PolarHBondContact O-N 3.07Å
805	N	39.9	Very low	39.2	Very low	73 Å²	73	86.5 Å²	86.5	39%	0.39	44%	0.444	S	S	.	.	H	α-helix	trans	-61.7	-44.8	-175.2	-66.1	-37.8	0	0	0	112.5	D801 I809	D801-N805 PolarHBondContact O-N 3.11Å; D801-N805 PolarHBondContact O-ND2 3.21Å; D801-N805 VanDerWaalsContact O-ND2 3.13Å; N805-I809 WeakPolarHBondContact O-CG1 3.48Å; N805-I809 PolarHBondContact O-N 3.49Å
806	V	41.5	Very low	40	Very low	103 Å²	103	84.9 Å²	84.9	62%	0.624	43%	0.429	S	S	*	.	H	α-helix	trans	-65.7	-42.9	177.8	176.6	0	0	0	0	111.5	D802 F804 Q810	D802-V806 WeakPolarHBondContact O-CG2 3.49Å; D802-V806 PolarHBondContact O-N 2.89Å; F804-V806 PolarHBondContact O-N 3.3Å; V806-Q810 PolarHBondContact O-N 3.15Å
807	F	43.4	Very low	40.4	Very low	93 Å²	93	87.3 Å²	87.3	41%	0.408	44%	0.435	S	S	.	.	H	α-helix	trans	-66.6	-39.2	-179.5	-173.8	-109.3	0	0	0	112.5	V728 F803 F804 Q810 I811	V728-F807 HydrophobicContact CG2-CZ 4Å; F803-F807 VanDerWaalsContact O-CB 3.24Å; F803-F807 WeakPolarHBondContact O-CB 3.41Å; F803-F807 PolarHBondContact O-N 3.27Å; F803-F807 VanDerWaalsContact O-N 3.14Å; F804-F807 PolarHBondContact O-N 3.35Å; F807-Q810 PolarHBondContact O-N 3.18Å; F807-I811 HydrophobicContact CD1-CD1 3.92Å; F807-I811 HydrophobicContact CE1-CD1 3.47Å; F807-I811 VanDerWaalsContact CE1-CD1 3.47Å; F807-I811 HydrophobicContact CE2-CD1 4.45Å; F807-I811 HydrophobicContact CZ-CD1 3.77Å; F807-I811 PolarHBondContact O-N 2.86Å
808	W	43	Very low	41.4	Very low	53 Å²	53	82.8 Å²	82.8	20%	0.201	41%	0.413	C	S	.	.	H	α-helix	trans	-62	-52.4	177.4	-125.9	143.8	0	0	0	111.8	F720 I723 F804 Q810 I811 L812	F720-W808 AromaticContact CD2-CE2 3.79Å; F720-W808 AromaticContact CD2-CZ2 3.71Å; F720-W808 HydrophobicContact CD2-CZ2 3.71Å; F720-W808 AromaticContact CD2-NE1 3.61Å; F720-W808 AromaticContact CE2-CE2 3.91Å; F720-W808 HydrophobicContact CE2-CZ2 4.26Å; F720-W808 AromaticContact CE2-NE1 3.5Å; I723-W808 HydrophobicContact CB-CH2 3.81Å; I723-W808 HydrophobicContact CB-CZ3 4.17Å; I723-W808 HydrophobicContact CD1-CH2 3.75Å; I723-W808 HydrophobicContact CG1-CH2 4.39Å; I723-W808 HydrophobicContact CG2-CH2 3.55Å; I723-W808 HydrophobicContact CG2-CZ3 3.41Å; I723-W808 VanDerWaalsContact CG2-CZ3 3.41Å; F804-W808 AromaticContact CE1-CD1 3.45Å; F804-W808 VanDerWaalsContact CE1-CD1 3.45Å; F804-W808 AromaticContact CE1-NE1 3.88Å; F804-W808 AromaticContact CZ-CD1 3.65Å; F804-W808 AromaticContact CZ-NE1 3.72Å; F804-W808 WeakPolarHBondContact O-CB 3.13Å; F804-W808 PolarHBondContact O-N 3.07Å; W808-Q810 PolarHBondContact O-N 2.9Å; W808-I811 HydrophobicContact CZ3-CG2 4.46Å; W808-I811 PolarHBondContact O-N 2.65Å; W808-I811 VanDerWaalsContact O-N 3.08Å; W808-L812 HydrophobicContact CE3-CD1 3.84Å; W808-L812 HydrophobicContact CE3-CD2 4.27Å; W808-L812 HydrophobicContact CE3-CG 3.73Å; W808-L812 HydrophobicContact CH2-CD2 4.44Å; W808-L812 HydrophobicContact CZ3-CD1 3.96Å; W808-L812 HydrophobicContact CZ3-CD2 3.65Å; W808-L812 HydrophobicContact CZ3-CG 3.64Å; W808-L812 PolarHBondContact O-N 3.39Å; W808-L812 VanDerWaalsContact O-N 3.14Å
809	I	45.2	Very low	42.1	Very low	55 Å²	55	77.3 Å²	77.3	28%	0.282	39%	0.385	S	S	.	.	H	α-helix	trans	-56.6	-41.4	-178.6	-70	167.8	0	0	0	110.5	I628 N805 I811 L812 L813	I628-I809 HydrophobicContact CD1-CG2 3.88Å; N805-I809 WeakPolarHBondContact O-CG1 3.48Å; N805-I809 PolarHBondContact O-N 3.49Å; I809-I811 PolarHBondContact O-N 3.41Å; I809-L812 PolarHBondContact O-N 3.29Å; I809-L813 HydrophobicContact CG2-CD1 3.77Å; I809-L813 HydrophobicContact CG2-CG 4.37Å; I809-L813 WeakPolarHBondContact O-CB 3.36Å; I809-L813 WeakPolarHBondContact O-CG 3.49Å; I809-L813 PolarHBondContact O-N 2.81Å
810	Q	43.9	Very low	42.7	Very low	103 Å²	103	76.6 Å²	76.6	48%	0.481	38%	0.382	S	S	.	.	H	α-helix	trans	-68.6	-32	-179.7	-153.7	66	19.9	0	0	113.7	V806 F807 W808 N814	V806-Q810 PolarHBondContact O-N 3.15Å; F807-Q810 PolarHBondContact O-N 3.18Å; W808-Q810 PolarHBondContact O-N 2.9Å; Q810-N814 WeakPolarHBondContact O-CB 3.27Å; Q810-N814 PolarHBondContact O-N 3.39Å; Q810-N814 VanDerWaalsContact O-N 3.07Å; Q810-N814 PolarHBondContact O-ND2 3.25Å
811	I	45.4	Very low	43.4	Very low	12 Å²	12	74.7 Å²	74.7	6%	0.062	37%	0.369	C	S	.	.	H	α-helix	trans	-68	-45.1	173.9	-73.3	175.1	0	0	0	111	I723 F807 W808 I809 N814 Q815	I723-I811 HydrophobicContact CG2-CG2 4.04Å; F807-I811 HydrophobicContact CD1-CD1 3.92Å; F807-I811 HydrophobicContact CE1-CD1 3.47Å; F807-I811 VanDerWaalsContact CE1-CD1 3.47Å; F807-I811 HydrophobicContact CE2-CD1 4.45Å; F807-I811 HydrophobicContact CZ-CD1 3.77Å; F807-I811 PolarHBondContact O-N 2.86Å; W808-I811 HydrophobicContact CZ3-CG2 4.46Å; W808-I811 PolarHBondContact O-N 2.65Å; W808-I811 VanDerWaalsContact O-N 3.08Å; I809-I811 PolarHBondContact O-N 3.41Å; I811-N814 PolarHBondContact O-N 2.85Å; I811-Q815 WeakPolarHBondContact O-CB 3.48Å; I811-Q815 PolarHBondContact O-N 2.91Å
812	L	45.8	Very low	44	Very low	53 Å²	53	74.7 Å²	74.7	28%	0.277	37%	0.365	S	S	.	.	H	α-helix	trans	-67.8	-36.9	179.6	-67.7	170.1	0	0	0	112.3	L711 W808 I809 S816	L711-L812 HydrophobicContact CD2-CD2 4.04Å; W808-L812 HydrophobicContact CE3-CD1 3.84Å; W808-L812 HydrophobicContact CE3-CD2 4.27Å; W808-L812 HydrophobicContact CE3-CG 3.73Å; W808-L812 HydrophobicContact CH2-CD2 4.44Å; W808-L812 HydrophobicContact CZ3-CD1 3.96Å; W808-L812 HydrophobicContact CZ3-CD2 3.65Å; W808-L812 HydrophobicContact CZ3-CG 3.64Å; W808-L812 PolarHBondContact O-N 3.39Å; W808-L812 VanDerWaalsContact O-N 3.14Å; I809-L812 PolarHBondContact O-N 3.29Å; L812-S816 WeakPolarHBondContact O-CB 3.33Å; L812-S816 PolarHBondContact O-N 3.48Å; L812-S816 PolarHBondContact O-OG 3.33Å
813	L	47.2	Very low	44.3	Very low	68 Å²	68	69.7 Å²	69.7	36%	0.356	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-46.2	172.6	-76.8	170.1	0	0	0	111.9	I628 I809 S816 R817	I628-L813 HydrophobicContact CG2-CD1 4.45Å; I628-L813 HydrophobicContact CG2-CD2 4.34Å; I809-L813 HydrophobicContact CG2-CD1 3.77Å; I809-L813 HydrophobicContact CG2-CG 4.37Å; I809-L813 WeakPolarHBondContact O-CB 3.36Å; I809-L813 WeakPolarHBondContact O-CG 3.49Å; I809-L813 PolarHBondContact O-N 2.81Å; L813-S816 PolarHBondContact O-OG 3.1Å; L813-R817 WeakPolarHBondContact O-CB 3.44Å; L813-R817 PolarHBondContact O-N 3.17Å
814	N	46.7	Very low	44.7	Very low	56 Å²	56	67.1 Å²	67.1	30%	0.299	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-40.6	178.1	-77.5	-17.7	0	0	0	112.1	Q810 I811 T818	Q810-N814 WeakPolarHBondContact O-CB 3.27Å; Q810-N814 PolarHBondContact O-N 3.39Å; Q810-N814 VanDerWaalsContact O-N 3.07Å; Q810-N814 PolarHBondContact O-ND2 3.25Å; I811-N814 PolarHBondContact O-N 2.85Å; N814-T818 PolarHBondContact O-N 3.49Å; N814-T818 PolarHBondContact O-OG1 3.47Å
815	Q	47	Very low	45.1	Very low	18 Å²	18	66.4 Å²	66.4	8%	0.084	34%	0.336	C	S	.	.	H	α-helix	trans	-68.1	-44.8	179.7	-172.3	61.3	69.8	0	0	112.4	M714 S726 I811 T818 N819	M714-Q815 HydrophobicContact SD-CG 4.35Å; S726-Q815 PolarHBondContact OG-OE1 3.47Å; S726-Q815 VanDerWaalsContact OG-OE1 3.11Å; I811-Q815 WeakPolarHBondContact O-CB 3.48Å; I811-Q815 PolarHBondContact O-N 2.91Å; Q815-T818 PolarHBondContact NE2-OG1 3.49Å; Q815-T818 PolarHBondContact O-N 3.45Å; Q815-T818 PolarHBondContact O-OG1 3.38Å; Q815-N819 PolarHBondContact NE2-OD1 3.21Å; Q815-N819 PolarHBondContact O-N 3.08Å; Q815-N819 VanDerWaalsContact O-N 3.12Å; Q815-N819 PolarHBondContact O-OD1 3.38Å; Q815-N819 VanDerWaalsContact O-OD1 3.04Å
816	S	43.2	Very low	45.1	Very low	32 Å²	32	66.7 Å²	66.7	22%	0.224	33%	0.334	C	S	.	.	H	α-helix	trans	-64.9	-40.8	177	53.9	0	0	0	0	111.3	L812 L813 N819 L820	L812-S816 WeakPolarHBondContact O-CB 3.33Å; L812-S816 PolarHBondContact O-N 3.48Å; L812-S816 PolarHBondContact O-OG 3.33Å; L813-S816 PolarHBondContact O-OG 3.1Å; S816-N819 PolarHBondContact O-N 3.12Å; S816-L820 WeakPolarHBondContact O-CB 3.41Å; S816-L820 PolarHBondContact O-N 2.66Å
817	R	44.6	Very low	45	Very low	156 Å²	156	66.8 Å²	66.8	59%	0.589	33%	0.33	S	S	*	.	H	α-helix	trans	-56.5	-50.1	171.8	180	176.4	174.4	163.5	4.7	113	L813 N819 L820 E821	L813-R817 WeakPolarHBondContact O-CB 3.44Å; L813-R817 PolarHBondContact O-N 3.17Å; R817-N819 VanDerWaalsContact C-N 3.28Å; R817-N819 PolarHBondContact O-N 3.34Å; R817-L820 WeakPolarHBondContact O-CB 3.1Å; R817-L820 PolarHBondContact O-N 3.3Å; R817-L820 VanDerWaalsContact O-N 3.17Å; R817-E821 HydrophobicContact CG-CG 4.39Å; R817-E821 IonicContact CZ-OE1 2.64Å; R817-E821 VanDerWaalsContact CZ-OE1 3.28Å; R817-E821 IonicContact NE-OE1 2.62Å; R817-E821 PolarHBondContact NE-OE1 2.7Å; R817-E821 IonicContact NH2-OE1 2.98Å; R817-E821 PolarHBondContact NH2-OE1 2.79Å; R817-E821 WeakPolarHBondContact O-CG 3.43Å; R817-E821 PolarHBondContact O-N 3.08Å
818	T	47.2	Very low	44.8	Very low	53 Å²	53	67.9 Å²	67.9	33%	0.325	34%	0.344	S	S	.	.	H	α-helix	trans	-64	-34	179.4	49.9	0	0	0	0	112.8	N814 Q815 E822	N814-T818 PolarHBondContact O-N 3.49Å; N814-T818 PolarHBondContact O-OG1 3.47Å; Q815-T818 PolarHBondContact NE2-OG1 3.49Å; Q815-T818 PolarHBondContact O-N 3.45Å; Q815-T818 PolarHBondContact O-OG1 3.38Å; T818-E822 WeakPolarHBondContact O-CB 3.39Å; T818-E822 PolarHBondContact O-N 3.18Å
819	N	45	Very low	44.7	Very low	40 Å²	40	70.2 Å²	70.2	21%	0.214	37%	0.365	C	S	.	.	H	α-helix	trans	-69.5	-36.5	176.3	-64.8	7.6	0	0	0	111.4	Q815 S816 R817 A823	Q815-N819 PolarHBondContact NE2-OD1 3.21Å; Q815-N819 PolarHBondContact O-N 3.08Å; Q815-N819 VanDerWaalsContact O-N 3.12Å; Q815-N819 PolarHBondContact O-OD1 3.38Å; Q815-N819 VanDerWaalsContact O-OD1 3.04Å; S816-N819 PolarHBondContact O-N 3.12Å; R817-N819 VanDerWaalsContact C-N 3.28Å; R817-N819 PolarHBondContact O-N 3.34Å; N819-A823 WeakPolarHBondContact O-CB 3.46Å; N819-A823 PolarHBondContact O-N 3.11Å
820	L	45.6	Very low	44.1	Very low	56 Å²	56	74.3 Å²	74.3	29%	0.293	39%	0.387	S	S	.	.	H	α-helix	trans	-67.1	-49.1	175.8	-164.7	80.4	0	0	0	111	L703 S816 R817 E822 A823 E824	L703-L820 HydrophobicContact CB-CD1 3.98Å; L703-L820 HydrophobicContact CD2-CD1 4.11Å; L703-L820 HydrophobicContact CG-CD1 4.5Å; S816-L820 WeakPolarHBondContact O-CB 3.41Å; S816-L820 PolarHBondContact O-N 2.66Å; R817-L820 WeakPolarHBondContact O-CB 3.1Å; R817-L820 PolarHBondContact O-N 3.3Å; R817-L820 VanDerWaalsContact O-N 3.17Å; L820-E822 VanDerWaalsContact C-N 3.31Å; L820-E822 PolarHBondContact O-N 2.96Å; L820-A823 PolarHBondContact O-N 3.26Å; L820-A823 VanDerWaalsContact O-N 3.1Å; L820-E824 WeakPolarHBondContact O-CG 3.47Å; L820-E824 PolarHBondContact O-N 3.35Å
821	E	47.5	Very low	43.3	Very low	89 Å²	89	76.5 Å²	76.5	42%	0.416	40%	0.402	S	S	.	.	H	α-helix	trans	-60	-39.3	177.4	-71.3	171.3	167.1	0	0	111.4	R817 S825	R817-E821 HydrophobicContact CG-CG 4.39Å; R817-E821 IonicContact CZ-OE1 2.64Å; R817-E821 VanDerWaalsContact CZ-OE1 3.28Å; R817-E821 IonicContact NE-OE1 2.62Å; R817-E821 PolarHBondContact NE-OE1 2.7Å; R817-E821 IonicContact NH2-OE1 2.98Å; R817-E821 PolarHBondContact NH2-OE1 2.79Å; R817-E821 WeakPolarHBondContact O-CG 3.43Å; R817-E821 PolarHBondContact O-N 3.08Å; E821-S825 WeakPolarHBondContact O-CB 3.28Å; E821-S825 PolarHBondContact O-N 3.38Å
822	E	48.3	Very low	42.5	Very low	103 Å²	103	87.1 Å²	87.1	48%	0.481	44%	0.443	S	S	.	.	H	α-helix	trans	-67.2	-39.2	173.9	-162.8	-171.6	144.7	0	0	112.2	T818 L820 S825 K826	T818-E822 WeakPolarHBondContact O-CB 3.39Å; T818-E822 PolarHBondContact O-N 3.18Å; L820-E822 VanDerWaalsContact C-N 3.31Å; L820-E822 PolarHBondContact O-N 2.96Å; E822-S825 PolarHBondContact O-N 2.96Å; E822-S825 PolarHBondContact O-OG 3.31Å; E822-K826 WeakPolarHBondContact O-CG 3.48Å; E822-K826 PolarHBondContact O-N 3.42Å; E822-K826 VanDerWaalsContact OE1-CE 3.28Å; E822-K826 WeakPolarHBondContact OE1-CE 3.41Å; E822-K826 IonicContact OE1-NZ 2.62Å; E822-K826 PolarHBondContact OE1-NZ 3.33Å
823	A	43.7	Very low	41.5	Very low	20 Å²	20	89.4 Å²	89.4	17%	0.165	46%	0.464	C	S	.	.	H	α-helix	trans	-69.8	-40.3	177.9	0	0	0	0	0	112.8	L703 N819 L820 K826 L827	L703-A823 HydrophobicContact CD2-CB 3.53Å; N819-A823 WeakPolarHBondContact O-CB 3.46Å; N819-A823 PolarHBondContact O-N 3.11Å; L820-A823 PolarHBondContact O-N 3.26Å; L820-A823 VanDerWaalsContact O-N 3.1Å; A823-K826 PolarHBondContact O-N 2.86Å; A823-L827 WeakPolarHBondContact O-CG 3.46Å; A823-L827 PolarHBondContact O-N 3.18Å
824	E	44.1	Very low	40.4	Very low	97 Å²	97	94.6 Å²	94.6	45%	0.453	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-38.9	172.9	-72.1	-173.7	159.8	0	0	111.8	L703 L820 K826 L827 T828	L703-E824 HydrophobicContact CD1-CG 4.32Å; L820-E824 WeakPolarHBondContact O-CG 3.47Å; L820-E824 PolarHBondContact O-N 3.35Å; E824-K826 VanDerWaalsContact C-N 3.28Å; E824-K826 PolarHBondContact O-N 3.18Å; E824-L827 PolarHBondContact O-N 2.98Å; E824-T828 WeakPolarHBondContact O-CG2 3.47Å; E824-T828 PolarHBondContact O-N 2.66Å; E824-T828 PolarHBondContact O-OG1 3.34Å
825	S	48	Very low	39.5	Very low	61 Å²	61	97.1 Å²	97.1	43%	0.427	50%	0.502	S	S	.	.	H	α-helix	trans	-59.6	-38.5	174.9	80.4	0	0	0	0	112.5	E821 E822 T828	E821-S825 WeakPolarHBondContact O-CB 3.28Å; E821-S825 PolarHBondContact O-N 3.38Å; E822-S825 PolarHBondContact O-N 2.96Å; E822-S825 PolarHBondContact O-OG 3.31Å; S825-T828 PolarHBondContact O-N 2.95Å; S825-T828 PolarHBondContact O-OG1 2.96Å
826	K	41	Very low	38.5	Very low	80 Å²	80	104.3 Å²	104.3	35%	0.348	54%	0.541	S	S	.	.	H	α-helix	trans	-73.4	-31.4	177.1	-67.8	165.5	-175	170.8	0	112.6	E822 A823 E824 T829	E822-K826 WeakPolarHBondContact O-CG 3.48Å; E822-K826 PolarHBondContact O-N 3.42Å; E822-K826 VanDerWaalsContact OE1-CE 3.28Å; E822-K826 WeakPolarHBondContact OE1-CE 3.41Å; E822-K826 IonicContact OE1-NZ 2.62Å; E822-K826 PolarHBondContact OE1-NZ 3.33Å; A823-K826 PolarHBondContact O-N 2.86Å; E824-K826 VanDerWaalsContact C-N 3.28Å; E824-K826 PolarHBondContact O-N 3.18Å; K826-T829 PolarHBondContact O-OG1 2.9Å
827	L	38.5	Very low	37.7	Very low	104 Å²	104	106.4 Å²	106.4	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-72.8	-25.7	174.7	-77.1	164.7	0	0	0	113.1	L703 A823 E824	L703-L827 HydrophobicContact CD1-CD1 3.88Å; L703-L827 HydrophobicContact CD2-CD1 4.25Å; L703-L827 HydrophobicContact CG-CD1 4.28Å; A823-L827 WeakPolarHBondContact O-CG 3.46Å; A823-L827 PolarHBondContact O-N 3.18Å; E824-L827 PolarHBondContact O-N 2.98Å
828	T	40.3	Very low	36.9	Very low	116 Å²	116	104.6 Å²	104.6	71%	0.712	58%	0.578	S	S	*	*	H	α-helix	trans	-86.4	-12.4	-180	50.8	0	0	0	0	114.3	E824 S825	E824-T828 WeakPolarHBondContact O-CG2 3.47Å; E824-T828 PolarHBondContact O-N 2.66Å; E824-T828 PolarHBondContact O-OG1 3.34Å; S825-T828 PolarHBondContact O-N 2.95Å; S825-T828 PolarHBondContact O-OG1 2.96Å
829	T	40.6	Very low	35.9	Very low	102 Å²	102	107.3 Å²	107.3	63%	0.626	60%	0.595	S	S	*	*	H	α-helix	trans	-83.8	-24.9	179.8	41.7	0	0	0	0	115.1	K826 N831	K826-T829 PolarHBondContact O-OG1 2.9Å; T829-N831 PolarHBondContact O-N 3.44Å
830	D	32.1	Very low	35.1	Very low	142 Å²	142	113.5 Å²	113.5	76%	0.759	62%	0.62	S	S	*	*			trans	-96.6	90	-173.4	-80.9	-10.1	0	0	0	112.9	Y832	D830-Y832 PolarHBondContact O-N 3.33Å
831	N	28.1	Very low	34.2	Very low	148 Å²	148	116.4 Å²	116.4	79%	0.791	64%	0.64	S	S	*	*			trans	-65.7	108.6	158.9	-78	-68.1	0	0	0	109.8	T829	T829-N831 PolarHBondContact O-N 3.44Å
832	Y	27.9	Very low	33.2	Very low	236 Å²	236	117.1 Å²	117.1	93%	0.925	65%	0.647	S	S	*	*			trans	-160.2	156.7	145.5	-100.8	-61.1	0	0	0	114	D830	D830-Y832 PolarHBondContact O-N 3.33Å
833	S	24.9	Very low	32.2	Very low	101 Å²	101	119.1 Å²	119.1	71%	0.706	66%	0.658	S	S	*	*			trans	-81.5	150.6	-173.9	52.2	0	0	0	0	114.4
834	Y	25	Very low	31.5	Very low	177 Å²	177	124.8 Å²	124.8	69%	0.694	69%	0.685	S	S	*	*			trans	-58.4	133.6	169.1	-98	-95.9	0	0	0	113.5	E695	E695-Y834 WeakPolarHBondContact OE1-CE2 3.18Å; E695-Y834 VanDerWaalsContact OE1-CZ 3.28Å; E695-Y834 PolarHBondContact OE1-OH 3.37Å
835	S	26.2	Very low	30.8	Very low	108 Å²	108	125 Å²	125	76%	0.755	69%	0.688	S	S	*	*			trans	-152.7	129.6	151.3	65.2	0	0	0	0	110.3	G837	S835-G837 PolarHBondContact O-N 2.95Å
836	N	27.3	Very low	30	Very low	170 Å²	170	130.8 Å²	130.8	91%	0.909	71%	0.706	S	S	*	*			trans	-44.8	123.3	-174.3	-59.9	-26.1	0	0	0	114.5
837	G	25.3	Very low	29.4	Very low	76 Å²	76	130.5 Å²	130.5	78%	0.784	71%	0.714	S	S	*	*			trans	-176.2	134.8	172.7	0	0	0	0	0	112.4	S835	S835-G837 PolarHBondContact O-N 2.95Å
838	S	29.4	Very low	29.1	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	71%	0.712	S	S	*	*			trans	-71.8	160.2	175.5	-172	0	0	0	0	112
839	V	25.7	Very low	28.8	Very low	110 Å²	110	127.8 Å²	127.8	67%	0.667	70%	0.7	S	S	*	*			trans	74.6	108.5	171.7	-168.3	0	0	0	0	116.7
840	K	27.2	Very low	28.3	Very low	171 Å²	171	127 Å²	127	74%	0.743	69%	0.692	S	S	*	*			trans	-178.1	57.1	132.9	-101.5	166.9	-172.9	175.9	0	114.8	D842	K840-D842 PolarHBondContact O-N 2.6Å
841	T	27.3	Very low	28.4	Very low	116 Å²	116	123.8 Å²	123.8	71%	0.712	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-71.5	-15.8	165.7	37.3	0	0	0	0	113.3	M843	T841-M843 VanDerWaalsContact C-N 3.34Å; T841-M843 PolarHBondContact O-N 2.78Å
842	D	26.2	Very low	28.9	Very low	104 Å²	104	120.4 Å²	120.4	56%	0.556	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-70.4	-12.7	-173.4	-67.7	-38.5	0	0	0	116.7	K840	K840-D842 PolarHBondContact O-N 2.6Å
843	M	27.3	Very low	29.4	Very low	145 Å²	145	111.6 Å²	111.6	71%	0.714	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-89.5	-24.9	-177.8	-75.4	-166.8	69.2	0	0	114.5	T841 L845	T841-M843 VanDerWaalsContact C-N 3.34Å; T841-M843 PolarHBondContact O-N 2.78Å; M843-L845 VanDerWaalsContact C-N 3.34Å
844	L	28.8	Very low	29.9	Very low	140 Å²	140	111.9 Å²	111.9	73%	0.733	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-70	-33	175.8	-74.5	167.4	0	0	0	112.1	K846 S847	L844-K846 PolarHBondContact O-N 2.59Å; L844-S847 PolarHBondContact O-N 3.3Å
845	L	30.4	Very low	31.5	Very low	101 Å²	101	105.1 Å²	105.1	53%	0.529	61%	0.605	S	S	.	*	G	3₁₀ helix	trans	-64.7	4.2	177.9	-79.1	164.8	0	0	0	115.5	M843 L850	M843-L845 VanDerWaalsContact C-N 3.34Å; L845-L850 HydrophobicContact CD2-CD1 4.46Å; L845-L850 HydrophobicContact CD2-CD2 4.12Å
846	K	30.5	Very low	33	Very low	182 Å²	182	100.8 Å²	100.8	79%	0.791	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-114.1	0.4	-179.3	-74.9	-176.8	176	175	0	115.3	L844	L844-K846 PolarHBondContact O-N 2.59Å
847	S	29.2	Very low	34.4	Very low	74 Å²	74	94.8 Å²	94.8	52%	0.517	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-27.7	177.2	72.2	0	0	0	0	114.4	L844	L844-S847 PolarHBondContact O-N 3.3Å
848	C	32.3	Very low	36.2	Very low	75 Å²	75	97.6 Å²	97.6	51%	0.507	54%	0.535	S	S	.	.	S	Bend	trans	-77	125.4	152.1	-67.4	0	0	0	0	107.7	L850	C848-L850 VanDerWaalsContact C-N 3.29Å; C848-L850 HydrophobicContact CB-CD1 4.02Å; C848-L850 WeakPolarHBondContact O-CD1 3.43Å; C848-L850 PolarHBondContact O-N 3.06Å
849	D	33.5	Very low	38	Very low	88 Å²	88	92 Å²	92	47%	0.471	50%	0.496	S	S	.	.			trans	-78.7	77.6	-176.9	-169.3	0.5	0	0	0	110.9	S851 Q852	D849-S851 PolarHBondContact O-N 3.23Å; D849-S851 VanDerWaalsContact OD1-CB 3.28Å; D849-S851 WeakPolarHBondContact OD1-CB 3.37Å; D849-S851 PolarHBondContact OD1-N 3.46Å; D849-S851 PolarHBondContact OD1-OG 3.45Å; D849-S851 PolarHBondContact OD2-OG 3.45Å; D849-Q852 HydrophobicContact CB-CG 4.13Å; D849-Q852 WeakPolarHBondContact O-CB 3.33Å; D849-Q852 PolarHBondContact O-N 3.44Å; D849-Q852 WeakPolarHBondContact OD2-CG 3.25Å; D849-Q852 PolarHBondContact OD2-NE2 3.38Å
850	L	30.8	Very low	39.8	Very low	85 Å²	85	87.3 Å²	87.3	45%	0.445	47%	0.468	S	S	.	.	H	α-helix	trans	-56.9	-16.5	178.8	-92.9	77.2	0	0	0	113.3	L845 C848 Q852 S853 L854	L845-L850 HydrophobicContact CD2-CD1 4.46Å; L845-L850 HydrophobicContact CD2-CD2 4.12Å; C848-L850 VanDerWaalsContact C-N 3.29Å; C848-L850 HydrophobicContact CB-CD1 4.02Å; C848-L850 WeakPolarHBondContact O-CD1 3.43Å; C848-L850 PolarHBondContact O-N 3.06Å; L850-Q852 PolarHBondContact O-N 3.04Å; L850-S853 PolarHBondContact O-N 3.03Å; L850-S853 PolarHBondContact O-OG 2.93Å; L850-L854 WeakPolarHBondContact O-CB 3.48Å; L850-L854 PolarHBondContact O-N 2.75Å; L850-L854 VanDerWaalsContact O-N 3.11Å
851	S	34.3	Very low	41.5	Very low	76 Å²	76	83.5 Å²	83.5	53%	0.531	46%	0.455	S	S	.	.	H	α-helix	trans	-60.4	-31.1	170.2	82.4	0	0	0	0	111.7	D849 S855	D849-S851 PolarHBondContact O-N 3.23Å; D849-S851 VanDerWaalsContact OD1-CB 3.28Å; D849-S851 WeakPolarHBondContact OD1-CB 3.37Å; D849-S851 PolarHBondContact OD1-N 3.46Å; D849-S851 PolarHBondContact OD1-OG 3.45Å; D849-S851 PolarHBondContact OD2-OG 3.45Å; S851-S855 WeakPolarHBondContact O-CB 3.47Å; S851-S855 PolarHBondContact O-N 3.38Å; S851-S855 VanDerWaalsContact O-N 3.15Å; S851-S855 PolarHBondContact O-OG 3.38Å
852	Q	37.7	Very low	43.3	Very low	76 Å²	76	79.6 Å²	79.6	36%	0.355	43%	0.43	S	S	.	.	H	α-helix	trans	-78.4	-43.4	-179.7	-57.7	-169.7	34.8	0	0	112.2	D849 L850 L854 S855 L856	D849-Q852 HydrophobicContact CB-CG 4.13Å; D849-Q852 WeakPolarHBondContact O-CB 3.33Å; D849-Q852 PolarHBondContact O-N 3.44Å; D849-Q852 WeakPolarHBondContact OD2-CG 3.25Å; D849-Q852 PolarHBondContact OD2-NE2 3.38Å; L850-Q852 PolarHBondContact O-N 3.04Å; Q852-L854 VanDerWaalsContact C-N 3.34Å; Q852-L854 PolarHBondContact O-N 2.89Å; Q852-S855 WeakPolarHBondContact CA-OG 3.3Å; Q852-S855 CarbonylContact O-C 3.51Å; Q852-S855 WeakPolarHBondContact O-CA 3.17Å; Q852-S855 PolarHBondContact O-N 3.1Å; Q852-S855 PolarHBondContact O-OG 2.95Å; Q852-L856 PolarHBondContact O-N 3.23Å
853	S	37.7	Very low	45.2	Very low	51 Å²	51	74.6 Å²	74.6	36%	0.357	40%	0.404	S	S	.	.	H	α-helix	trans	-65.8	-36.6	175.5	62.8	0	0	0	0	112	L850 S855 L856 S857	L850-S853 PolarHBondContact O-N 3.03Å; L850-S853 PolarHBondContact O-OG 2.93Å; S853-S855 PolarHBondContact O-N 2.93Å; S853-L856 PolarHBondContact O-N 3.37Å; S853-S857 WeakPolarHBondContact O-CB 3.26Å; S853-S857 PolarHBondContact O-N 2.94Å; S853-S857 PolarHBondContact O-OG 2.95Å
854	L	36.3	Very low	46.8	Very low	108 Å²	108	68.7 Å²	68.7	57%	0.565	38%	0.375	S	S	*	.	H	α-helix	trans	-67.1	-24	171.9	-154.5	79.1	0	0	0	113	L850 Q852 S857 K858	L850-L854 WeakPolarHBondContact O-CB 3.48Å; L850-L854 PolarHBondContact O-N 2.75Å; L850-L854 VanDerWaalsContact O-N 3.11Å; Q852-L854 VanDerWaalsContact C-N 3.34Å; Q852-L854 PolarHBondContact O-N 2.89Å; L854-S857 WeakPolarHBondContact CA-OG 3.36Å; L854-S857 PolarHBondContact O-OG 2.9Å; L854-K858 WeakPolarHBondContact O-CD 3.33Å; L854-K858 VanDerWaalsContact O-CG 3.29Å; L854-K858 WeakPolarHBondContact O-CG 3.4Å; L854-K858 PolarHBondContact O-N 3.2Å
855	S	57.5	Low	48.4	Very low	35 Å²	35	71 Å²	71	25%	0.245	37%	0.374	C	S	.	.	H	α-helix	trans	-86.5	-34.6	173.7	74.8	0	0	0	0	113.3	S851 Q852 S853 K858 C859 F924	S851-S855 WeakPolarHBondContact O-CB 3.47Å; S851-S855 PolarHBondContact O-N 3.38Å; S851-S855 VanDerWaalsContact O-N 3.15Å; S851-S855 PolarHBondContact O-OG 3.38Å; Q852-S855 WeakPolarHBondContact CA-OG 3.3Å; Q852-S855 CarbonylContact O-C 3.51Å; Q852-S855 WeakPolarHBondContact O-CA 3.17Å; Q852-S855 PolarHBondContact O-N 3.1Å; Q852-S855 PolarHBondContact O-OG 2.95Å; S853-S855 PolarHBondContact O-N 2.93Å; S855-K858 PolarHBondContact O-N 2.74Å; S855-C859 WeakPolarHBondContact O-CB 3.24Å; S855-C859 PolarHBondContact O-N 2.78Å; S855-F924 WeakPolarHBondContact OG-CE2 3.37Å
856	L	58.4	Low	49.9	Very low	17 Å²	17	67 Å²	67	9%	0.089	35%	0.354	C	S	.	.	H	α-helix	trans	-67.8	-46.8	175	-176.5	64.3	0	0	0	110.7	L718 Q852 S853 K858 C859 V860 L884 F924	L718-L856 HydrophobicContact CD2-CD2 4.26Å; Q852-L856 PolarHBondContact O-N 3.23Å; S853-L856 PolarHBondContact O-N 3.37Å; L856-K858 VanDerWaalsContact C-N 3.3Å; L856-K858 PolarHBondContact O-N 3.23Å; L856-C859 CarbonylContact O-C 3.51Å; L856-C859 WeakPolarHBondContact O-CA 3.29Å; L856-C859 WeakPolarHBondContact O-CB 3.36Å; L856-C859 PolarHBondContact O-N 3.08Å; L856-C859 VanDerWaalsContact O-N 3.09Å; L856-V860 WeakPolarHBondContact O-CG2 3.43Å; L856-V860 PolarHBondContact O-N 3.08Å; L856-L884 HydrophobicContact CD1-CD1 3.64Å; L856-L884 HydrophobicContact CD1-CD2 4.18Å; L856-F924 HydrophobicContact CB-CZ 4.24Å; L856-F924 HydrophobicContact CD1-CE1 4.09Å; L856-F924 HydrophobicContact CD1-CZ 4.25Å
857	S	56.4	Low	51	Low	44 Å²	44	58.4 Å²	58.4	31%	0.308	32%	0.317	S	S	.	.	H	α-helix	trans	-61.6	-35.3	174.3	53.3	0	0	0	0	112.6	S853 L854 N861	S853-S857 WeakPolarHBondContact O-CB 3.26Å; S853-S857 PolarHBondContact O-N 2.94Å; S853-S857 PolarHBondContact O-OG 2.95Å; L854-S857 WeakPolarHBondContact CA-OG 3.36Å; L854-S857 PolarHBondContact O-OG 2.9Å; S857-N861 WeakPolarHBondContact O-CB 3.41Å; S857-N861 PolarHBondContact O-N 3.41Å; S857-N861 PolarHBondContact O-ND2 3.33Å
858	K	63.7	Low	52.1	Low	134 Å²	134	56 Å²	56	58%	0.583	30%	0.298	S	S	*	.	H	α-helix	trans	-66.1	-43.8	169.2	-79.4	176.6	-179.2	177.7	0	112.5	L854 S855 L856 N861 D862	L854-K858 WeakPolarHBondContact O-CD 3.33Å; L854-K858 VanDerWaalsContact O-CG 3.29Å; L854-K858 WeakPolarHBondContact O-CG 3.4Å; L854-K858 PolarHBondContact O-N 3.2Å; S855-K858 PolarHBondContact O-N 2.74Å; L856-K858 VanDerWaalsContact C-N 3.3Å; L856-K858 PolarHBondContact O-N 3.23Å; K858-N861 PolarHBondContact O-N 2.98Å; K858-D862 PolarHBondContact O-N 3.31Å
859	C	66.7	Low	52.7	Low	1 Å²	1	52.5 Å²	52.5	1%	0.007	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-48.3	175.8	-176.4	0	0	0	0	111.5	S855 L856 D862 L863 T921 F924	S855-C859 WeakPolarHBondContact O-CB 3.24Å; S855-C859 PolarHBondContact O-N 2.78Å; L856-C859 CarbonylContact O-C 3.51Å; L856-C859 WeakPolarHBondContact O-CA 3.29Å; L856-C859 WeakPolarHBondContact O-CB 3.36Å; L856-C859 PolarHBondContact O-N 3.08Å; L856-C859 VanDerWaalsContact O-N 3.09Å; C859-D862 PolarHBondContact O-N 3.24Å; C859-L863 WeakPolarHBondContact O-CB 3.32Å; C859-L863 WeakPolarHBondContact O-CD1 3.12Å; C859-L863 WeakPolarHBondContact O-CG 3.07Å; C859-L863 PolarHBondContact O-N 3.13Å; C859-T921 HydrophobicContact CB-CG2 4.37Å; C859-F924 HydrophobicContact CB-CD1 3.62Å; C859-F924 HydrophobicContact CB-CE1 3.68Å
860	V	63.4	Low	53.1	Low	11 Å²	11	49.9 Å²	49.9	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-44.4	176.8	169.2	0	0	0	0	111	L856 D862 L863 N864 A880 C881 L884	L856-V860 WeakPolarHBondContact O-CG2 3.43Å; L856-V860 PolarHBondContact O-N 3.08Å; V860-D862 PolarHBondContact O-N 2.98Å; V860-L863 PolarHBondContact O-N 2.94Å; V860-N864 WeakPolarHBondContact O-CB 3.18Å; V860-N864 PolarHBondContact O-N 3.04Å; V860-N864 PolarHBondContact O-OD1 2.86Å; V860-A880 HydrophobicContact CG1-CB 4.15Å; V860-C881 VanDerWaalsContact CG2-SG 3.56Å; V860-L884 HydrophobicContact CG2-CD1 3.94Å
861	N	63.1	Low	53.4	Low	90 Å²	90	49 Å²	49	48%	0.481	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-36.4	175.7	-78.6	-54.1	0	0	0	113.3	S857 K858 R865	S857-N861 WeakPolarHBondContact O-CB 3.41Å; S857-N861 PolarHBondContact O-N 3.41Å; S857-N861 PolarHBondContact O-ND2 3.33Å; K858-N861 PolarHBondContact O-N 2.98Å; N861-R865 WeakPolarHBondContact O-CB 3.46Å; N861-R865 WeakPolarHBondContact O-CD 3.25Å; N861-R865 WeakPolarHBondContact O-CG 3.28Å; N861-R865 PolarHBondContact O-N 3.47Å
862	D	65	Low	53.5	Low	34 Å²	34	47.3 Å²	47.3	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-40.5	172.1	-95.8	11.4	0	0	0	112	K858 C859 V860 R865 C866 S918 T921	K858-D862 PolarHBondContact O-N 3.31Å; C859-D862 PolarHBondContact O-N 3.24Å; V860-D862 PolarHBondContact O-N 2.98Å; D862-R865 PolarHBondContact O-N 3.27Å; D862-C866 PolarHBondContact O-N 2.97Å; D862-C866 PolarHBondContact O-SG 2.85Å; D862-S918 VanDerWaalsContact OD2-CB 3.23Å; D862-S918 WeakPolarHBondContact OD2-CB 3.45Å; D862-S918 PolarHBondContact OD2-OG 3.37Å; D862-T921 HydrophobicContact CB-CG2 4.13Å; D862-T921 WeakPolarHBondContact OD2-CB 3.11Å; D862-T921 PolarHBondContact OD2-OG1 3.36Å
863	L	65.9	Low	53.4	Low	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-45.4	176.3	-72.7	164	0	0	0	111.2	C859 V860 C866 G867 I868 A880 L884 L887 L917	C859-L863 WeakPolarHBondContact O-CB 3.32Å; C859-L863 WeakPolarHBondContact O-CD1 3.12Å; C859-L863 WeakPolarHBondContact O-CG 3.07Å; C859-L863 PolarHBondContact O-N 3.13Å; V860-L863 PolarHBondContact O-N 2.94Å; L863-C866 CarbonylContact O-C 3.57Å; L863-C866 WeakPolarHBondContact O-CA 3.24Å; L863-C866 WeakPolarHBondContact O-CB 3.24Å; L863-C866 PolarHBondContact O-N 3.44Å; L863-C866 VanDerWaalsContact O-N 3.11Å; L863-G867 PolarHBondContact O-N 2.82Å; L863-I868 HydrophobicContact CB-CD1 4.04Å; L863-I868 HydrophobicContact CD2-CD1 3.45Å; L863-I868 VanDerWaalsContact CD2-CD1 3.45Å; L863-I868 HydrophobicContact CG-CD1 4.34Å; L863-I868 PolarHBondContact O-N 3.22Å; L863-A880 HydrophobicContact CB-CB 3.97Å; L863-A880 HydrophobicContact CD1-CB 4.4Å; L863-L884 HydrophobicContact CD1-CD1 4.02Å; L863-L884 HydrophobicContact CD1-CG 4.22Å; L863-L887 HydrophobicContact CD1-CD1 4.42Å; L863-L887 HydrophobicContact CD2-CD1 3.49Å; L863-L887 VanDerWaalsContact CD2-CD1 3.49Å; L863-L917 HydrophobicContact CD2-CD2 3.68Å; L863-L917 HydrophobicContact CG-CD2 4.31Å
864	N	61.6	Low	53.4	Low	20 Å²	20	57 Å²	57	11%	0.107	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-42	175.9	-67.3	0.9	0	0	0	111.5	V860 C866 G867 I868 T870 L876 A880	V860-N864 WeakPolarHBondContact O-CB 3.18Å; V860-N864 PolarHBondContact O-N 3.04Å; V860-N864 PolarHBondContact O-OD1 2.86Å; N864-C866 PolarHBondContact O-N 3.49Å; N864-G867 PolarHBondContact O-N 3.29Å; N864-I868 PolarHBondContact OD1-O 3.04Å; N864-T870 WeakPolarHBondContact O-CG2 3.46Å; N864-L876 PolarHBondContact ND2-O 3.21Å; N864-L876 PolarHBondContact OD1-O 3.19Å; N864-A880 WeakPolarHBondContact OD1-CB 3.22Å
865	R	63.1	Low	53.5	Low	190 Å²	190	57.1 Å²	57.1	72%	0.717	29%	0.287	S	S	*	.	H	α-helix	trans	-62.7	-30.5	172.9	-74.5	166.2	174	-168.9	-5	112.7	R582 N861 D862 G867	R582-R865 PolarHBondContact NH2-O 3.15Å; N861-R865 WeakPolarHBondContact O-CB 3.46Å; N861-R865 WeakPolarHBondContact O-CD 3.25Å; N861-R865 WeakPolarHBondContact O-CG 3.28Å; N861-R865 PolarHBondContact O-N 3.47Å; D862-R865 PolarHBondContact O-N 3.27Å; R865-G867 PolarHBondContact O-N 2.89Å
866	C	61.5	Low	52.5	Low	17 Å²	17	57.9 Å²	57.9	12%	0.115	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-0.9	172.1	-65.1	0	0	0	0	114	R582 D862 L863 N864 L915	R582-C866 VanDerWaalsContact CZ-O 3.26Å; R582-C866 PolarHBondContact NE-O 2.98Å; R582-C866 PolarHBondContact NH2-O 2.67Å; D862-C866 PolarHBondContact O-N 2.97Å; D862-C866 PolarHBondContact O-SG 2.85Å; L863-C866 CarbonylContact O-C 3.57Å; L863-C866 WeakPolarHBondContact O-CA 3.24Å; L863-C866 WeakPolarHBondContact O-CB 3.24Å; L863-C866 PolarHBondContact O-N 3.44Å; L863-C866 VanDerWaalsContact O-N 3.11Å; N864-C866 PolarHBondContact O-N 3.49Å; C866-L915 HydrophobicContact CB-CD2 3.96Å; C866-L915 HydrophobicContact CB-CG 4.42Å
867	G	53.1	Low	51.7	Low	1 Å²	1	61.6 Å²	61.6	1%	0.01	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	107	-11.9	172	0	0	0	0	0	115.7	E586 L863 N864 R865 G869 T870	E586-G867 WeakPolarHBondContact OE1-CA 3.4Å; L863-G867 PolarHBondContact O-N 2.82Å; N864-G867 PolarHBondContact O-N 3.29Å; R865-G867 PolarHBondContact O-N 2.89Å; G867-G869 PolarHBondContact O-N 2.96Å; G867-T870 PolarHBondContact O-N 3.07Å; G867-T870 PolarHBondContact O-OG1 2.69Å
868	I	52	Low	51.1	Low	22 Å²	22	62.2 Å²	62.2	11%	0.113	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	112.3	-176.6	-62.5	163.9	0	0	0	109.5	L863 N864 A880 Y883 L887 L915	L863-I868 HydrophobicContact CB-CD1 4.04Å; L863-I868 HydrophobicContact CD2-CD1 3.45Å; L863-I868 VanDerWaalsContact CD2-CD1 3.45Å; L863-I868 HydrophobicContact CG-CD1 4.34Å; L863-I868 PolarHBondContact O-N 3.22Å; N864-I868 PolarHBondContact OD1-O 3.04Å; I868-A880 HydrophobicContact CG2-CB 4.19Å; I868-Y883 HydrophobicContact CG2-CD2 3.64Å; I868-Y883 HydrophobicContact CG2-CE2 4.15Å; I868-L887 HydrophobicContact CD1-CD1 4.28Å; I868-L915 HydrophobicContact CD1-CD1 4.23Å; I868-L915 HydrophobicContact CD1-CD2 4.21Å; I868-L915 HydrophobicContact CD1-CG 4.48Å
869	G	44.9	Very low	50.2	Low	3 Å²	3	57.3 Å²	57.3	3%	0.031	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	9.9	176.3	0	0	0	0	0	116.1	G867 N871	G867-G869 PolarHBondContact O-N 2.96Å; G869-N871 PolarHBondContact O-N 3.26Å
870	T	41.4	Very low	49.5	Very low	32 Å²	32	57.3 Å²	57.3	20%	0.196	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	78.3	-178.3	56.9	0	0	0	0	113.3	N864 G867 L876	N864-T870 WeakPolarHBondContact O-CG2 3.46Å; G867-T870 PolarHBondContact O-N 3.07Å; G867-T870 PolarHBondContact O-OG1 2.69Å; T870-L876 HydrophobicContact CG2-CD2 4.14Å
871	N	38	Very low	48.9	Very low	68 Å²	68	56.9 Å²	56.9	36%	0.364	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-163.1	7	151.8	-107.4	-1.7	0	0	0	116.6	W589 F590 G869	W589-N871 HydrophobicContact CZ3-CB 4.2Å; F590-N871 HydrophobicContact CD2-CB 3.84Å; F590-N871 WeakPolarHBondContact CD2-ND2 3.47Å; F590-N871 HydrophobicContact CE2-CB 4Å; F590-N871 VanDerWaalsContact CE2-ND2 3.33Å; F590-N871 WeakPolarHBondContact CE2-ND2 3.43Å; G869-N871 PolarHBondContact O-N 3.26Å
872	C	35.8	Very low	48.3	Very low	39 Å²	39	55.3 Å²	55.3	26%	0.264	28%	0.275	S	S	.	.			trans	-129.3	115	176	39.9	0	0	0	0	111.4	D874 H875	C872-D874 VanDerWaalsContact C-N 3.26Å; C872-D874 PolarHBondContact O-N 3.24Å; C872-D874 VanDerWaalsContact O-N 3.15Å; C872-H875 PolarHBondContact O-N 2.91Å
873	H	36.4	Very low	48.1	Very low	178 Å²	178	58.7 Å²	58.7	82%	0.824	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.7	-167.4	-97.3	-85.9	0	0	0	114.6
874	D	38.1	Very low	47.9	Very low	152 Å²	152	58.7 Å²	58.7	81%	0.813	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	1	-176.5	-59.3	-49	0	0	0	114.7	C872	C872-D874 VanDerWaalsContact C-N 3.26Å; C872-D874 PolarHBondContact O-N 3.24Å; C872-D874 VanDerWaalsContact O-N 3.15Å
875	H	38.1	Very low	47.7	Very low	111 Å²	111	58.8 Å²	58.8	51%	0.514	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	8.2	-177.5	-64.8	-14.3	0	0	0	114.2	C872 K877 T878 L879	C872-H875 PolarHBondContact O-N 2.91Å; H875-K877 PolarHBondContact O-N 3.24Å; H875-K877 VanDerWaalsContact O-N 3.13Å; H875-T878 PolarHBondContact O-N 3.45Å; H875-T878 PolarHBondContact O-OG1 3.47Å; H875-L879 HydrophobicContact CB-CD1 4.39Å
876	L	36.7	Very low	47.6	Very low	52 Å²	52	54.6 Å²	54.6	27%	0.272	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-20.5	179.9	-83.6	158.5	0	0	0	115	N864 T870	N864-L876 PolarHBondContact ND2-O 3.21Å; N864-L876 PolarHBondContact OD1-O 3.19Å; T870-L876 HydrophobicContact CG2-CD2 4.14Å
877	K	41.5	Very low	48	Very low	95 Å²	95	54.4 Å²	54.4	41%	0.413	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-48.2	175.4	-73.6	-167.5	-173.2	-178.5	0	112.8	E716 N717 H875 C881	E716-K877 WeakPolarHBondContact O-CD 3.3Å; E716-K877 WeakPolarHBondContact O-CE 3.27Å; E716-K877 PolarHBondContact O-NZ 3.22Å; N717-K877 PolarHBondContact OD1-NZ 2.85Å; H875-K877 PolarHBondContact O-N 3.24Å; H875-K877 VanDerWaalsContact O-N 3.13Å; K877-C881 PolarHBondContact O-N 3.1Å; K877-C881 PolarHBondContact O-SG 3.02Å; K877-C881 VanDerWaalsContact O-SG 3.37Å
878	T	42.8	Very low	48.8	Very low	56 Å²	56	55.8 Å²	55.8	34%	0.344	28%	0.281	S	S	.	.	H	α-helix	trans	-61	-50.4	-172	20.7	0	0	0	0	111.9	H875 A880 C881 D882	H875-T878 PolarHBondContact O-N 3.45Å; H875-T878 PolarHBondContact O-OG1 3.47Å; T878-A880 PolarHBondContact O-N 2.92Å; T878-C881 CarbonylContact O-C 3.37Å; T878-C881 WeakPolarHBondContact O-CA 3.14Å; T878-C881 WeakPolarHBondContact O-CB 3.3Å; T878-C881 PolarHBondContact O-N 2.9Å; T878-D882 VanDerWaalsContact O-CG 3.3Å; T878-D882 PolarHBondContact O-N 2.88Å
879	L	44.7	Very low	49.4	Very low	32 Å²	32	60.9 Å²	60.9	17%	0.168	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-43.8	-176.7	-86.9	150.7	0	0	0	114.1	W589 H875 C881 D882 Y883	W589-L879 HydrophobicContact CH2-CD1 3.92Å; W589-L879 HydrophobicContact CZ2-CD1 3.56Å; W589-L879 HydrophobicContact CZ2-CD2 3.83Å; W589-L879 HydrophobicContact CZ2-CG 4.33Å; H875-L879 HydrophobicContact CB-CD1 4.39Å; L879-C881 VanDerWaalsContact C-N 3.31Å; L879-C881 PolarHBondContact O-N 3.5Å; L879-D882 PolarHBondContact O-N 3.29Å; L879-Y883 VanDerWaalsContact O-CD2 3.26Å; L879-Y883 WeakPolarHBondContact O-CD2 3.3Å; L879-Y883 PolarHBondContact O-N 3.42Å
880	A	51.6	Low	50.6	Low	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-70.3	-29.1	177.1	0	0	0	0	0	112.7	V860 L863 N864 I868 T878 L884	V860-A880 HydrophobicContact CG1-CB 4.15Å; L863-A880 HydrophobicContact CB-CB 3.97Å; L863-A880 HydrophobicContact CD1-CB 4.4Å; N864-A880 WeakPolarHBondContact OD1-CB 3.22Å; I868-A880 HydrophobicContact CG2-CB 4.19Å; T878-A880 PolarHBondContact O-N 2.92Å; A880-L884 WeakPolarHBondContact O-CB 3.32Å; A880-L884 PolarHBondContact O-N 3.31Å
881	C	51.8	Low	52.1	Low	2 Å²	2	62.7 Å²	62.7	1%	0.014	32%	0.315	C	S	.	.	H	α-helix	trans	-71	-36	169.9	-64.8	0	0	0	0	111.9	S719 V860 K877 T878 L879 Y883 L884 P885	S719-C881 VanDerWaalsContact CB-C 3.46Å; S719-C881 PolarHBondContact OG-O 2.89Å; V860-C881 VanDerWaalsContact CG2-SG 3.56Å; K877-C881 PolarHBondContact O-N 3.1Å; K877-C881 PolarHBondContact O-SG 3.02Å; K877-C881 VanDerWaalsContact O-SG 3.37Å; T878-C881 CarbonylContact O-C 3.37Å; T878-C881 WeakPolarHBondContact O-CA 3.14Å; T878-C881 WeakPolarHBondContact O-CB 3.3Å; T878-C881 PolarHBondContact O-N 2.9Å; L879-C881 VanDerWaalsContact C-N 3.31Å; L879-C881 PolarHBondContact O-N 3.5Å; C881-Y883 VanDerWaalsContact C-N 3.34Å; C881-Y883 PolarHBondContact O-N 2.84Å; C881-L884 WeakPolarHBondContact O-CB 3.5Å; C881-L884 PolarHBondContact O-N 3.15Å; C881-P885 WeakPolarHBondContact O-CD 3.43Å
882	D	50	Low	53.7	Low	58 Å²	58	60.7 Å²	60.7	31%	0.31	31%	0.307	S	S	.	.	H	α-helix	trans	-65.2	-34.1	-179.2	-65.5	-40.6	0	0	0	112.9	S719 T878 L879 L884	S719-D882 WeakPolarHBondContact CB-OD1 3.26Å; T878-D882 VanDerWaalsContact O-CG 3.3Å; T878-D882 PolarHBondContact O-N 2.88Å; L879-D882 PolarHBondContact O-N 3.29Å; D882-L884 VanDerWaalsContact C-N 3.34Å
883	Y	60.3	Low	55.1	Low	104 Å²	104	60 Å²	60	41%	0.408	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-15.9	171.7	-70.5	-71.7	0	0	0	113.5	I868 L879 C881 I886 L887	I868-Y883 HydrophobicContact CG2-CD2 3.64Å; I868-Y883 HydrophobicContact CG2-CE2 4.15Å; L879-Y883 VanDerWaalsContact O-CD2 3.26Å; L879-Y883 WeakPolarHBondContact O-CD2 3.3Å; L879-Y883 PolarHBondContact O-N 3.42Å; C881-Y883 VanDerWaalsContact C-N 3.34Å; C881-Y883 PolarHBondContact O-N 2.84Å; Y883-I886 PolarHBondContact O-N 2.91Å; Y883-I886 VanDerWaalsContact O-N 3.09Å; Y883-L887 VanDerWaalsContact O-CG 3.31Å; Y883-L887 WeakPolarHBondContact O-CG 3.44Å; Y883-L887 PolarHBondContact O-N 2.98Å
884	L	63.7	Low	56.8	Low	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-38.6	-169.3	-139.6	153.3	0	0	0	113.3	L856 V860 L863 A880 C881 D882 I886 L887 R888 L925	L856-L884 HydrophobicContact CD1-CD1 3.64Å; L856-L884 HydrophobicContact CD1-CD2 4.18Å; V860-L884 HydrophobicContact CG2-CD1 3.94Å; L863-L884 HydrophobicContact CD1-CD1 4.02Å; L863-L884 HydrophobicContact CD1-CG 4.22Å; A880-L884 WeakPolarHBondContact O-CB 3.32Å; A880-L884 PolarHBondContact O-N 3.31Å; C881-L884 WeakPolarHBondContact O-CB 3.5Å; C881-L884 PolarHBondContact O-N 3.15Å; D882-L884 VanDerWaalsContact C-N 3.34Å; L884-I886 PolarHBondContact O-N 3.22Å; L884-L887 PolarHBondContact O-N 2.74Å; L884-R888 HydrophobicContact CD2-CG 4.02Å; L884-R888 VanDerWaalsContact CD2-NE 3.29Å; L884-R888 VanDerWaalsContact O-CB 3.31Å; L884-R888 WeakPolarHBondContact O-CB 3.48Å; L884-R888 WeakPolarHBondContact O-CG 3.47Å; L884-R888 PolarHBondContact O-N 3.47Å; L884-L925 HydrophobicContact CD2-CD2 3.9Å; L884-L925 HydrophobicContact CG-CD2 4.29Å
885	P	56.8	Low	58.4	Low	23 Å²	23	48.9 Å²	48.9	15%	0.149	25%	0.251	C	S	.	.	H	α-helix	trans	-59.4	-41.4	170	-26.6	35	0	0	0	113.7	W721 C881 L889	W721-P885 HydrophobicContact CB-CG 4.32Å; W721-P885 HydrophobicContact CE3-CB 4.47Å; W721-P885 HydrophobicContact CE3-CG 4.36Å; C881-P885 WeakPolarHBondContact O-CD 3.43Å; P885-L889 WeakPolarHBondContact O-CB 3.38Å; P885-L889 PolarHBondContact O-N 2.97Å
886	I	60.2	Low	59.8	Low	101 Å²	101	46.8 Å²	46.8	52%	0.518	25%	0.249	S	C	.	.	H	α-helix	trans	-70.3	-43.3	179.2	-63.3	173.5	0	0	0	110.3	Y883 L884 R888 L889 L890	Y883-I886 PolarHBondContact O-N 2.91Å; Y883-I886 VanDerWaalsContact O-N 3.09Å; L884-I886 PolarHBondContact O-N 3.22Å; I886-R888 VanDerWaalsContact C-N 3.34Å; I886-R888 PolarHBondContact O-N 2.82Å; I886-L889 PolarHBondContact O-N 3.4Å; I886-L890 HydrophobicContact CG2-CD1 4.24Å; I886-L890 WeakPolarHBondContact O-CG 3.25Å; I886-L890 PolarHBondContact O-N 3.04Å
887	L	69.5	Low	61.1	Low	13 Å²	13	51.4 Å²	51.4	7%	0.068	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-37.6	177.2	-66.8	169.9	0	0	0	111.8	L863 I868 Y883 L884 A891 F910 L925	L863-L887 HydrophobicContact CD1-CD1 4.42Å; L863-L887 HydrophobicContact CD2-CD1 3.49Å; L863-L887 VanDerWaalsContact CD2-CD1 3.49Å; I868-L887 HydrophobicContact CD1-CD1 4.28Å; Y883-L887 VanDerWaalsContact O-CG 3.31Å; Y883-L887 WeakPolarHBondContact O-CG 3.44Å; Y883-L887 PolarHBondContact O-N 2.98Å; L884-L887 PolarHBondContact O-N 2.74Å; L887-A891 VanDerWaalsContact O-CB 3.28Å; L887-A891 WeakPolarHBondContact O-CB 3.39Å; L887-A891 PolarHBondContact O-N 3.03Å; L887-F910 HydrophobicContact CD2-CD1 4.44Å; L887-F910 HydrophobicContact CD2-CE1 3.69Å; L887-F910 HydrophobicContact CD2-CZ 4.5Å; L887-L925 HydrophobicContact CB-CD1 4.29Å; L887-L925 HydrophobicContact CB-CD2 4.14Å
888	R	71.4	Confident	62.4	Low	30 Å²	30	51.5 Å²	51.5	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-44	169.7	-79.7	174.7	169.2	171.6	-4.2	112.6	L884 I886 L890 A891 S892 F924 L925 F930	L884-R888 HydrophobicContact CD2-CG 4.02Å; L884-R888 VanDerWaalsContact CD2-NE 3.29Å; L884-R888 VanDerWaalsContact O-CB 3.31Å; L884-R888 WeakPolarHBondContact O-CB 3.48Å; L884-R888 WeakPolarHBondContact O-CG 3.47Å; L884-R888 PolarHBondContact O-N 3.47Å; I886-R888 VanDerWaalsContact C-N 3.34Å; I886-R888 PolarHBondContact O-N 2.82Å; R888-L890 VanDerWaalsContact C-N 3.3Å; R888-L890 PolarHBondContact O-N 2.72Å; R888-A891 PolarHBondContact O-N 3.01Å; R888-S892 VanDerWaalsContact O-CB 3.23Å; R888-S892 WeakPolarHBondContact O-CB 3.35Å; R888-S892 PolarHBondContact O-N 3.32Å; R888-S892 PolarHBondContact O-OG 3.49Å; R888-F924 VanDerWaalsContact NH2-CZ 3.3Å; R888-L925 HydrophobicContact CG-CD2 3.77Å; R888-F930 VanDerWaalsContact NH2-CZ 3.28Å
889	L	64.1	Low	63.6	Low	130 Å²	130	55 Å²	55	68%	0.681	28%	0.279	S	S	*	.	H	α-helix	trans	-61.5	-40.7	177.9	-174.9	67.9	0	0	0	111.3	P885 I886 G893	P885-L889 WeakPolarHBondContact O-CB 3.38Å; P885-L889 PolarHBondContact O-N 2.97Å; I886-L889 PolarHBondContact O-N 3.4Å; L889-G893 WeakPolarHBondContact O-CA 3.46Å; L889-G893 PolarHBondContact O-N 3.47Å
890	L	69.7	Low	64.6	Low	72 Å²	72	59.7 Å²	59.7	38%	0.377	31%	0.309	S	S	.	.	H	α-helix	trans	-64.4	-56.9	172.3	-70.8	171.4	0	0	0	111.2	I886 R888 S892 G893 E894 F910	I886-L890 HydrophobicContact CG2-CD1 4.24Å; I886-L890 WeakPolarHBondContact O-CG 3.25Å; I886-L890 PolarHBondContact O-N 3.04Å; R888-L890 VanDerWaalsContact C-N 3.3Å; R888-L890 PolarHBondContact O-N 2.72Å; L890-S892 PolarHBondContact O-N 2.9Å; L890-G893 PolarHBondContact O-N 3.01Å; L890-E894 WeakPolarHBondContact O-CB 3.33Å; L890-E894 VanDerWaalsContact O-CG 3.27Å; L890-E894 WeakPolarHBondContact O-CG 3.24Å; L890-E894 PolarHBondContact O-N 3.04Å; L890-F910 HydrophobicContact CB-CZ 4.31Å
891	A	74	Confident	64.8	Low	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.8	-42.3	-174.5	0	0	0	0	0	113.3	L887 R888 N895 F910 L925	L887-A891 VanDerWaalsContact O-CB 3.28Å; L887-A891 WeakPolarHBondContact O-CB 3.39Å; L887-A891 PolarHBondContact O-N 3.03Å; R888-A891 PolarHBondContact O-N 3.01Å; A891-N895 WeakPolarHBondContact O-CB 3.36Å; A891-N895 PolarHBondContact O-N 3.5Å; A891-F910 HydrophobicContact CB-CE2 4.36Å; A891-F910 HydrophobicContact CB-CZ 4.4Å; A891-L925 HydrophobicContact CB-CB 3.66Å
892	S	71	Confident	64.9	Low	27 Å²	27	67.7 Å²	67.7	19%	0.189	36%	0.36	C	S	.	.	H	α-helix	trans	-72	-34.3	176.1	65.7	0	0	0	0	112.6	R888 L890 S896	R888-S892 VanDerWaalsContact O-CB 3.23Å; R888-S892 WeakPolarHBondContact O-CB 3.35Å; R888-S892 PolarHBondContact O-N 3.32Å; R888-S892 PolarHBondContact O-OG 3.49Å; L890-S892 PolarHBondContact O-N 2.9Å; S892-S896 WeakPolarHBondContact O-CB 3.36Å; S892-S896 PolarHBondContact O-N 2.93Å; S892-S896 PolarHBondContact O-OG 3.44Å
893	G	65.5	Low	64.6	Low	24 Å²	24	72.3 Å²	72.3	25%	0.247	38%	0.378	C	S	.	.	H	α-helix	trans	-65.5	-47	172.8	0	0	0	0	0	112.1	L889 L890 S896 R897	L889-G893 WeakPolarHBondContact O-CA 3.46Å; L889-G893 PolarHBondContact O-N 3.47Å; L890-G893 PolarHBondContact O-N 3.01Å; G893-S896 WeakPolarHBondContact O-CB 3.19Å; G893-S896 PolarHBondContact O-N 2.68Å; G893-R897 WeakPolarHBondContact O-CG 3.3Å; G893-R897 PolarHBondContact O-N 3.27Å
894	E	70.8	Confident	63.8	Low	47 Å²	47	74.8 Å²	74.8	22%	0.22	39%	0.386	C	S	.	.	H	α-helix	trans	-67.2	-38.3	176.7	-67.5	-61	93.2	0	0	111.8	L890 R897 Q898 F906	L890-E894 WeakPolarHBondContact O-CB 3.33Å; L890-E894 VanDerWaalsContact O-CG 3.27Å; L890-E894 WeakPolarHBondContact O-CG 3.24Å; L890-E894 PolarHBondContact O-N 3.04Å; E894-R897 CarbonylContact O-C 3.51Å; E894-R897 WeakPolarHBondContact O-CB 3.48Å; E894-R897 PolarHBondContact O-N 3.43Å; E894-R897 WeakPolarHBondContact OE1-CD 3.43Å; E894-R897 IonicContact OE1-CZ 2.74Å; E894-R897 IonicContact OE1-NE 2.67Å; E894-R897 PolarHBondContact OE1-NE 3.18Å; E894-R897 IonicContact OE1-NH2 3.98Å; E894-R897 PolarHBondContact OE1-NH2 2.86Å; E894-Q898 PolarHBondContact O-N 3.49Å; E894-F906 HydrophobicContact CB-CB 4.01Å; E894-F906 HydrophobicContact CB-CD1 4.18Å; E894-F906 WeakPolarHBondContact CB-O 3.3Å; E894-F906 WeakPolarHBondContact O-CG 3.33Å; E894-F906 WeakPolarHBondContact OE2-CD1 3.37Å
895	N	72.8	Confident	63.1	Low	49 Å²	49	76.7 Å²	76.7	26%	0.262	39%	0.394	S	S	.	.	H	α-helix	trans	-60.7	-44.2	170.3	-174.7	15	0	0	0	112	A891 R897 Q898 I899 S926	A891-N895 WeakPolarHBondContact O-CB 3.36Å; A891-N895 PolarHBondContact O-N 3.5Å; N895-R897 VanDerWaalsContact C-N 3.27Å; N895-R897 PolarHBondContact O-N 3.34Å; N895-Q898 WeakPolarHBondContact O-CA 3.44Å; N895-Q898 VanDerWaalsContact O-CB 3.27Å; N895-Q898 WeakPolarHBondContact O-CB 3.41Å; N895-Q898 PolarHBondContact O-N 3.1Å; N895-I899 WeakPolarHBondContact O-CG1 3.41Å; N895-I899 PolarHBondContact O-N 2.59Å; N895-S926 PolarHBondContact ND2-O 3.19Å
896	S	66.9	Low	63.1	Low	67 Å²	67	76.4 Å²	76.4	47%	0.469	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-37.9	174.3	-60.5	0	0	0	0	112	S892 G893 V900	S892-S896 WeakPolarHBondContact O-CB 3.36Å; S892-S896 PolarHBondContact O-N 2.93Å; S892-S896 PolarHBondContact O-OG 3.44Å; G893-S896 WeakPolarHBondContact O-CB 3.19Å; G893-S896 PolarHBondContact O-N 2.68Å; S896-V900 WeakPolarHBondContact O-CG2 3.36Å; S896-V900 PolarHBondContact O-N 3.23Å
897	R	64.3	Low	63	Low	149 Å²	149	74 Å²	74	56%	0.562	38%	0.378	S	S	*	.	H	α-helix	trans	-70.1	-32.1	172.2	-63.7	-176.6	-138	-90.2	7.4	112.6	G893 E894 N895 V900 S901 F906	G893-R897 WeakPolarHBondContact O-CG 3.3Å; G893-R897 PolarHBondContact O-N 3.27Å; E894-R897 CarbonylContact O-C 3.51Å; E894-R897 WeakPolarHBondContact O-CB 3.48Å; E894-R897 PolarHBondContact O-N 3.43Å; E894-R897 WeakPolarHBondContact OE1-CD 3.43Å; E894-R897 IonicContact OE1-CZ 2.74Å; E894-R897 IonicContact OE1-NE 2.67Å; E894-R897 PolarHBondContact OE1-NE 3.18Å; E894-R897 IonicContact OE1-NH2 3.98Å; E894-R897 PolarHBondContact OE1-NH2 2.86Å; N895-R897 VanDerWaalsContact C-N 3.27Å; N895-R897 PolarHBondContact O-N 3.34Å; R897-V900 PolarHBondContact O-N 3.47Å; R897-S901 VanDerWaalsContact O-CB 3.25Å; R897-S901 WeakPolarHBondContact O-CB 3.45Å; R897-S901 PolarHBondContact O-N 2.85Å; R897-F906 HydrophobicContact CB-CD1 3.92Å; R897-F906 HydrophobicContact CB-CE1 3.27Å; R897-F906 HydrophobicContact CB-CE2 4.33Å; R897-F906 HydrophobicContact CB-CZ 3.48Å; R897-F906 VanDerWaalsContact CB-CZ 3.48Å; R897-F906 HydrophobicContact CG-CE1 4.23Å; R897-F906 WeakPolarHBondContact O-CZ 3.38Å
898	Q	69.1	Low	62.6	Low	97 Å²	97	77.6 Å²	77.6	45%	0.453	39%	0.394	S	S	.	.	H	α-helix	trans	-63.2	-44.8	175.1	-170.1	166.1	-34	0	0	112	E894 N895 V900 S901 F906	E894-Q898 PolarHBondContact O-N 3.49Å; N895-Q898 WeakPolarHBondContact O-CA 3.44Å; N895-Q898 VanDerWaalsContact O-CB 3.27Å; N895-Q898 WeakPolarHBondContact O-CB 3.41Å; N895-Q898 PolarHBondContact O-N 3.1Å; Q898-V900 VanDerWaalsContact C-N 3.35Å; Q898-V900 PolarHBondContact O-N 3.23Å; Q898-S901 CarbonylContact O-C 3.45Å; Q898-S901 PolarHBondContact O-N 3.48Å; Q898-F906 VanDerWaalsContact CA-CD2 3.41Å; Q898-F906 HydrophobicContact CB-CB 4.34Å; Q898-F906 HydrophobicContact CB-CD2 3.41Å; Q898-F906 VanDerWaalsContact CB-CD2 3.41Å; Q898-F906 HydrophobicContact CB-CE2 3.93Å; Q898-F906 HydrophobicContact CB-CG 4.05Å; Q898-F906 HydrophobicContact CG-CD2 3.81Å; Q898-F906 HydrophobicContact CG-CE2 4.43Å
899	I	67.9	Low	62.2	Low	129 Å²	129	82.4 Å²	82.4	66%	0.662	41%	0.413	S	S	*	.	H	α-helix	trans	-62.5	-41.3	176.5	-63.8	163.3	0	0	0	111.2	N895	N895-I899 WeakPolarHBondContact O-CG1 3.41Å; N895-I899 PolarHBondContact O-N 2.59Å
900	V	65.3	Low	62.3	Low	131 Å²	131	76.5 Å²	76.5	79%	0.794	38%	0.382	S	S	*	.	H	α-helix	trans	-80.3	-22.9	-179.2	176.4	0	0	0	0	113.1	S896 R897 Q898	S896-V900 WeakPolarHBondContact O-CG2 3.36Å; S896-V900 PolarHBondContact O-N 3.23Å; R897-V900 PolarHBondContact O-N 3.47Å; Q898-V900 VanDerWaalsContact C-N 3.35Å; Q898-V900 PolarHBondContact O-N 3.23Å
901	S	55.7	Low	62.1	Low	46 Å²	46	74.3 Å²	74.3	32%	0.322	37%	0.371	S	S	.	.			trans	-134.7	94.1	-173.5	-179.5	0	0	0	0	112.3	R897 Q898 K903 R904	R897-S901 VanDerWaalsContact O-CB 3.25Å; R897-S901 WeakPolarHBondContact O-CB 3.45Å; R897-S901 PolarHBondContact O-N 2.85Å; Q898-S901 CarbonylContact O-C 3.45Å; Q898-S901 PolarHBondContact O-N 3.48Å; S901-K903 PolarHBondContact O-N 3.37Å; S901-R904 PolarHBondContact O-N 3.22Å
902	T	53	Low	61.3	Low	125 Å²	125	79 Å²	79	77%	0.767	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	9.2	176.1	54.3	0	0	0	0	115.7
903	K	44.2	Very low	60.9	Low	154 Å²	154	80.9 Å²	80.9	67%	0.67	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143	18.7	-172.6	-61.1	-175	-178	172.9	0	114.5	S901	S901-K903 PolarHBondContact O-N 3.37Å
904	R	43.2	Very low	60.9	Low	157 Å²	157	79.9 Å²	79.9	59%	0.592	39%	0.385	S	S	*	.			trans	-127.2	177	169.7	-96.6	-173.4	160.9	178.7	-8.6	112.9	S901 F906	S901-R904 PolarHBondContact O-N 3.22Å; R904-F906 HydrophobicContact CB-CD2 4.47Å; R904-F906 HydrophobicContact CB-CE1 3.89Å; R904-F906 HydrophobicContact CB-CE2 3.53Å; R904-F906 HydrophobicContact CB-CZ 3.2Å; R904-F906 WeakPolarHBondContact O-CD2 3.2Å; R904-F906 VanDerWaalsContact O-CE2 3.27Å; R904-F906 WeakPolarHBondContact O-CE2 3.48Å
905	R	50.7	Low	60.7	Low	40 Å²	40	78.7 Å²	78.7	15%	0.151	38%	0.38	C	S	.	.			trans	-137.5	88.5	-134.9	-47.4	-132.1	-75.9	-165.2	-176	110	P387 F485 S487 D488	P387-R905 VanDerWaalsContact O-CZ 3.23Å; P387-R905 PolarHBondContact O-NE 3.13Å; P387-R905 PolarHBondContact O-NH1 3.47Å; F485-R905 HydrophobicContact CD1-CB 4.16Å; F485-R905 HydrophobicContact CD1-CG 4.29Å; F485-R905 VanDerWaalsContact CD2-CD 3.49Å; F485-R905 HydrophobicContact CE1-CB 3.66Å; F485-R905 HydrophobicContact CE1-CG 4.27Å; F485-R905 HydrophobicContact CE2-CB 4.45Å; F485-R905 VanDerWaalsContact CG-CD 3.4Å; F485-R905 HydrophobicContact CG-CG 4.49Å; F485-R905 HydrophobicContact CZ-CB 3.84Å; F485-R905 HydrophobicContact CZ-CG 4.49Å; S487-R905 PolarHBondContact OG-NH2 3.43Å; D488-R905 IonicContact OD1-CZ 3.24Å; D488-R905 IonicContact OD1-NH1 2.81Å; D488-R905 IonicContact OD1-NH2 3.42Å; D488-R905 PolarHBondContact OD1-NH2 3.14Å; D488-R905 IonicContact OD2-CZ 2.66Å; D488-R905 VanDerWaalsContact OD2-CZ 3.24Å; D488-R905 IonicContact OD2-NH1 3.62Å; D488-R905 PolarHBondContact OD2-NH1 3.28Å; D488-R905 IonicContact OD2-NH2 3.68Å; D488-R905 PolarHBondContact OD2-NH2 3.39Å
906	F	55.2	Low	60.5	Low	16 Å²	16	80.4 Å²	80.4	7%	0.07	39%	0.385	C	S	.	.			trans	-111.7	-15.8	-142.3	-70	-60.8	0	0	0	117	E894 R897 Q898 R904	E894-F906 HydrophobicContact CB-CB 4.01Å; E894-F906 HydrophobicContact CB-CD1 4.18Å; E894-F906 WeakPolarHBondContact CB-O 3.3Å; E894-F906 WeakPolarHBondContact O-CG 3.33Å; E894-F906 WeakPolarHBondContact OE2-CD1 3.37Å; R897-F906 HydrophobicContact CB-CD1 3.92Å; R897-F906 HydrophobicContact CB-CE1 3.27Å; R897-F906 HydrophobicContact CB-CE2 4.33Å; R897-F906 HydrophobicContact CB-CZ 3.48Å; R897-F906 VanDerWaalsContact CB-CZ 3.48Å; R897-F906 HydrophobicContact CG-CE1 4.23Å; R897-F906 WeakPolarHBondContact O-CZ 3.38Å; Q898-F906 VanDerWaalsContact CA-CD2 3.41Å; Q898-F906 HydrophobicContact CB-CB 4.34Å; Q898-F906 HydrophobicContact CB-CD2 3.41Å; Q898-F906 VanDerWaalsContact CB-CD2 3.41Å; Q898-F906 HydrophobicContact CB-CE2 3.93Å; Q898-F906 HydrophobicContact CB-CG 4.05Å; Q898-F906 HydrophobicContact CG-CD2 3.81Å; Q898-F906 HydrophobicContact CG-CE2 4.43Å; R904-F906 HydrophobicContact CB-CD2 4.47Å; R904-F906 HydrophobicContact CB-CE1 3.89Å; R904-F906 HydrophobicContact CB-CE2 3.53Å; R904-F906 HydrophobicContact CB-CZ 3.2Å; R904-F906 WeakPolarHBondContact O-CD2 3.2Å; R904-F906 VanDerWaalsContact O-CE2 3.27Å; R904-F906 WeakPolarHBondContact O-CE2 3.48Å
907	L	58	Low	60.8	Low	50 Å²	50	77.3 Å²	77.3	26%	0.262	36%	0.363	S	S	.	.	S	Bend	trans	-122.2	-2.5	-178.2	-79.6	173.6	0	0	0	116.2	Y909 F910 R922	L907-Y909 PolarHBondContact O-N 2.9Å; L907-F910 HydrophobicContact CD2-CD2 4.11Å; L907-F910 HydrophobicContact CD2-CE2 3.84Å; L907-R922 HydrophobicContact CD1-CB 4.18Å; L907-R922 HydrophobicContact CD2-CB 4.15Å; L907-R922 HydrophobicContact CD2-CG 4.49Å; L907-R922 PolarHBondContact O-NH1 3.49Å
908	H	61.3	Low	61.3	Low	90 Å²	90	71.7 Å²	71.7	42%	0.417	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-5.9	172.8	-87.6	-72	0	0	0	114	F485 F910 D911 R912	F485-H908 AromaticContact CE1-CD2 3.38Å; F485-H908 WeakPolarHBondContact CE1-CD2 3.1Å; F485-H908 HydrophobicContact CZ-CB 4.11Å; F485-H908 AromaticContact CZ-CD2 3.38Å; F485-H908 WeakPolarHBondContact CZ-CD2 3.2Å; F485-H908 AromaticContact CZ-CG 3.96Å; H908-F910 VanDerWaalsContact C-N 3.28Å; H908-F910 PolarHBondContact O-N 3.01Å; H908-D911 WeakPolarHBondContact CA-OD2 3.42Å; H908-D911 IonicContact CE1-OD2 2.65Å; H908-D911 IonicContact CG-OD2 2.66Å; H908-D911 IonicContact ND1-OD2 3.41Å; H908-D911 PolarHBondContact ND1-OD2 2.97Å; H908-D911 PolarHBondContact O-N 3.21Å; H908-R912 PolarHBondContact O-N 3.39Å
909	Y	62.7	Low	61.6	Low	131 Å²	131	72.2 Å²	72.2	51%	0.514	36%	0.359	S	S	.	.	H	α-helix	trans	-61.2	-38.6	177.7	-176.4	-98.6	0	0	0	111.8	L907 R912 I913	L907-Y909 PolarHBondContact O-N 2.9Å; Y909-R912 WeakPolarHBondContact O-CB 3.2Å; Y909-R912 PolarHBondContact O-N 2.99Å; Y909-R912 VanDerWaalsContact O-N 3.14Å; Y909-I913 HydrophobicContact CE1-CD1 4.28Å; Y909-I913 HydrophobicContact CE1-CG2 4.4Å; Y909-I913 PolarHBondContact O-N 3.4Å
910	F	66.4	Low	61.8	Low	5 Å²	5	69.8 Å²	69.8	2%	0.022	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-42.1	177.4	-63.9	-62.5	0	0	0	112.6	L887 L890 A891 L907 H908 R912 I913 S914 L915 L917	L887-F910 HydrophobicContact CD2-CD1 4.44Å; L887-F910 HydrophobicContact CD2-CE1 3.69Å; L887-F910 HydrophobicContact CD2-CZ 4.5Å; L890-F910 HydrophobicContact CB-CZ 4.31Å; A891-F910 HydrophobicContact CB-CE2 4.36Å; A891-F910 HydrophobicContact CB-CZ 4.4Å; L907-F910 HydrophobicContact CD2-CD2 4.11Å; L907-F910 HydrophobicContact CD2-CE2 3.84Å; H908-F910 VanDerWaalsContact C-N 3.28Å; H908-F910 PolarHBondContact O-N 3.01Å; F910-R912 PolarHBondContact O-N 2.91Å; F910-I913 HydrophobicContact CD1-CD1 4.4Å; F910-I913 VanDerWaalsContact O-CG1 3.22Å; F910-I913 WeakPolarHBondContact O-CG1 3.36Å; F910-I913 PolarHBondContact O-N 3.26Å; F910-S914 PolarHBondContact O-N 3.33Å; F910-L915 CarbonylContact C-O 3.45Å; F910-L915 WeakPolarHBondContact CB-O 3.42Å; F910-L915 WeakPolarHBondContact O-CB 3.36Å; F910-L915 PolarHBondContact O-N 3.45Å; F910-L917 HydrophobicContact CD1-CD1 4.21Å; F910-L917 HydrophobicContact CD2-CD1 4.35Å; F910-L917 HydrophobicContact CG-CD1 4.13Å
911	D	66.1	Low	62.3	Low	27 Å²	27	63.9 Å²	63.9	14%	0.144	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-34.5	174	-51	-58.7	0	0	0	111.8	H908 I913 S914 F916 R922	H908-D911 WeakPolarHBondContact CA-OD2 3.42Å; H908-D911 IonicContact CE1-OD2 2.65Å; H908-D911 IonicContact CG-OD2 2.66Å; H908-D911 IonicContact ND1-OD2 3.41Å; H908-D911 PolarHBondContact ND1-OD2 2.97Å; H908-D911 PolarHBondContact O-N 3.21Å; D911-I913 VanDerWaalsContact C-N 3.27Å; D911-I913 PolarHBondContact O-N 3.02Å; D911-S914 PolarHBondContact O-N 3.49Å; D911-F916 HydrophobicContact CB-CD1 4.3Å; D911-F916 HydrophobicContact CB-CE1 4.16Å; D911-R922 VanDerWaalsContact CG-NH1 3.29Å; D911-R922 IonicContact OD1-CZ 2.91Å; D911-R922 IonicContact OD1-NH1 2.73Å; D911-R922 PolarHBondContact OD1-NH1 2.69Å; D911-R922 IonicContact OD1-NH2 3.51Å; D911-R922 PolarHBondContact OD1-NH2 2.89Å; D911-R922 IonicContact OD2-CZ 2.97Å; D911-R922 IonicContact OD2-NH1 3.28Å; D911-R922 PolarHBondContact OD2-NH1 2.92Å; D911-R922 IonicContact OD2-NH2 3.43Å
912	R	57.6	Low	63.3	Low	97 Å²	97	63.2 Å²	63.2	37%	0.366	31%	0.308	S	S	.	.	H	α-helix	trans	-69.2	-25.7	-178.8	-152.6	174.2	-163.1	-120.2	-3.5	112.9	D479 E480 R581 H908 Y909 F910	D479-R912 IonicContact OD2-NH2 3.38Å; E480-R912 IonicContact OE1-NE 3.19Å; E480-R912 PolarHBondContact OE1-NE 2.92Å; E480-R912 IonicContact OE2-CZ 3.5Å; E480-R912 IonicContact OE2-NE 2.78Å; E480-R912 PolarHBondContact OE2-NE 3.31Å; E480-R912 IonicContact OE2-NH2 3.72Å; E480-R912 PolarHBondContact OE2-NH2 3.01Å; R581-R912 PolarHBondContact NH1-O 3.47Å; H908-R912 PolarHBondContact O-N 3.39Å; Y909-R912 WeakPolarHBondContact O-CB 3.2Å; Y909-R912 PolarHBondContact O-N 2.99Å; Y909-R912 VanDerWaalsContact O-N 3.14Å; F910-R912 PolarHBondContact O-N 2.91Å
913	I	62.6	Low	64.4	Low	67 Å²	67	62.8 Å²	62.8	34%	0.344	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	18.5	171.1	61.8	170	0	0	0	112.7	Y909 F910 D911 L915	Y909-I913 HydrophobicContact CE1-CD1 4.28Å; Y909-I913 HydrophobicContact CE1-CG2 4.4Å; Y909-I913 PolarHBondContact O-N 3.4Å; F910-I913 HydrophobicContact CD1-CD1 4.4Å; F910-I913 VanDerWaalsContact O-CG1 3.22Å; F910-I913 WeakPolarHBondContact O-CG1 3.36Å; F910-I913 PolarHBondContact O-N 3.26Å; D911-I913 VanDerWaalsContact C-N 3.27Å; D911-I913 PolarHBondContact O-N 3.02Å; I913-L915 HydrophobicContact CD1-CB 4.2Å; I913-L915 HydrophobicContact CD1-CD1 3.83Å; I913-L915 HydrophobicContact CG1-CB 3.86Å; I913-L915 HydrophobicContact CG1-CD1 4.4Å; I913-L915 PolarHBondContact O-N 3.25Å
914	S	64.6	Low	65.9	Low	3 Å²	3	56.6 Å²	56.6	2%	0.021	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	24.5	179	-56.3	0	0	0	0	114.8	D579 F910 D911 F916	D579-S914 VanDerWaalsContact OD2-CB 3.31Å; D579-S914 WeakPolarHBondContact OD2-CB 3.37Å; D579-S914 PolarHBondContact OD2-OG 3.44Å; F910-S914 PolarHBondContact O-N 3.33Å; D911-S914 PolarHBondContact O-N 3.49Å; S914-F916 VanDerWaalsContact O-CD2 3.3Å; S914-F916 WeakPolarHBondContact O-CD2 3.4Å; S914-F916 WeakPolarHBondContact O-CE2 3.38Å
915	L	67.6	Low	67.3	Low	23 Å²	23	49.1 Å²	49.1	12%	0.12	24%	0.242	C	C	.	.			trans	-108.8	74.6	-172.7	-150	170.2	0	0	0	108.4	C866 I868 F910 I913 L917	C866-L915 HydrophobicContact CB-CD2 3.96Å; C866-L915 HydrophobicContact CB-CG 4.42Å; I868-L915 HydrophobicContact CD1-CD1 4.23Å; I868-L915 HydrophobicContact CD1-CD2 4.21Å; I868-L915 HydrophobicContact CD1-CG 4.48Å; F910-L915 CarbonylContact C-O 3.45Å; F910-L915 WeakPolarHBondContact CB-O 3.42Å; F910-L915 WeakPolarHBondContact O-CB 3.36Å; F910-L915 PolarHBondContact O-N 3.45Å; I913-L915 HydrophobicContact CD1-CB 4.2Å; I913-L915 HydrophobicContact CD1-CD1 3.83Å; I913-L915 HydrophobicContact CG1-CB 3.86Å; I913-L915 HydrophobicContact CG1-CD1 4.4Å; I913-L915 PolarHBondContact O-N 3.25Å; L915-L917 HydrophobicContact CD2-CD1 4.03Å; L915-L917 HydrophobicContact CD2-CD2 3.53Å; L915-L917 HydrophobicContact CD2-CG 3.57Å; L915-L917 PolarHBondContact O-N 3.22Å
916	F	68.3	Low	68.5	Low	85 Å²	85	47.9 Å²	47.9	37%	0.373	24%	0.24	S	C	.	.			trans	-76.9	56.9	-163.8	-61.3	-77.2	0	0	0	114.7	H363 D911 S914	H363-F916 HydrophobicContact CB-CZ 4.16Å; H363-F916 AromaticContact CD2-CZ 3.83Å; H363-F916 AromaticContact CG-CZ 3.91Å; D911-F916 HydrophobicContact CB-CD1 4.3Å; D911-F916 HydrophobicContact CB-CE1 4.16Å; S914-F916 VanDerWaalsContact O-CD2 3.3Å; S914-F916 WeakPolarHBondContact O-CD2 3.4Å; S914-F916 WeakPolarHBondContact O-CE2 3.38Å
917	L	73.8	Confident	69.1	Low	1 Å²	1	52.7 Å²	52.7	1%	0.005	26%	0.261	C	S	.	.			trans	-55.4	139.5	179.4	-60.3	176.1	0	0	0	112.3	L863 F910 L915 T921 R922 L925	L863-L917 HydrophobicContact CD2-CD2 3.68Å; L863-L917 HydrophobicContact CG-CD2 4.31Å; F910-L917 HydrophobicContact CD1-CD1 4.21Å; F910-L917 HydrophobicContact CD2-CD1 4.35Å; F910-L917 HydrophobicContact CG-CD1 4.13Å; L915-L917 HydrophobicContact CD2-CD1 4.03Å; L915-L917 HydrophobicContact CD2-CD2 3.53Å; L915-L917 HydrophobicContact CD2-CG 3.57Å; L915-L917 PolarHBondContact O-N 3.22Å; L917-T921 HydrophobicContact CB-CG2 4.35Å; L917-T921 HydrophobicContact CD2-CG2 4.02Å; L917-R922 HydrophobicContact CB-CG 3.77Å; L917-R922 HydrophobicContact CD1-CG 4.44Å; L917-R922 VanDerWaalsContact O-CZ 3.27Å; L917-R922 PolarHBondContact O-NE 3.3Å; L917-R922 PolarHBondContact O-NH2 3.44Å; L917-L925 HydrophobicContact CD1-CD1 3.68Å
918	S	74.6	Confident	68.7	Low	31 Å²	31	55.4 Å²	55.4	22%	0.217	28%	0.283	C	S	.	.			trans	-61.5	153.4	173.7	71.5	0	0	0	0	111.6	D862 S920 T921 R922	D862-S918 VanDerWaalsContact OD2-CB 3.23Å; D862-S918 WeakPolarHBondContact OD2-CB 3.45Å; D862-S918 PolarHBondContact OD2-OG 3.37Å; S918-S920 PolarHBondContact O-N 2.81Å; S918-S920 PolarHBondContact OG-OG 2.57Å; S918-T921 PolarHBondContact O-N 3.14Å; S918-T921 WeakPolarHBondContact OG-CB 3.34Å; S918-T921 PolarHBondContact OG-N 2.95Å; S918-T921 PolarHBondContact OG-OG1 2.97Å; S918-T921 VanDerWaalsContact OG-OG1 3.1Å; S918-R922 PolarHBondContact O-N 3.28Å
919	P	74.1	Confident	68	Low	108 Å²	108	54.6 Å²	54.6	70%	0.701	29%	0.288	S	S	*	.	H	α-helix	trans	-55.4	-40.2	177.3	-26.9	35.6	0	0	0	112.8	T921 R922 E923	P919-T921 PolarHBondContact O-N 3.16Å; P919-R922 PolarHBondContact O-N 3.15Å; P919-E923 WeakPolarHBondContact O-CB 3.36Å; P919-E923 PolarHBondContact O-N 3.42Å
920	S	72.8	Confident	66.9	Low	79 Å²	79	53.9 Å²	53.9	55%	0.552	29%	0.288	S	S	*	.	H	α-helix	trans	-58.9	-41.8	173.1	32.6	0	0	0	0	113.3	S918 E923 F924	S918-S920 PolarHBondContact O-N 2.81Å; S918-S920 PolarHBondContact OG-OG 2.57Å; S920-E923 PolarHBondContact O-N 3.3Å; S920-F924 WeakPolarHBondContact O-CB 3.32Å; S920-F924 PolarHBondContact O-N 3.13Å
921	T	76.4	Confident	65.1	Low	7 Å²	7	63.6 Å²	63.6	4%	0.043	34%	0.339	C	S	.	.	H	α-helix	trans	-73.4	-36.7	178.8	-67.8	0	0	0	0	111.4	C859 D862 L917 S918 P919 F924 L925	C859-T921 HydrophobicContact CB-CG2 4.37Å; D862-T921 HydrophobicContact CB-CG2 4.13Å; D862-T921 WeakPolarHBondContact OD2-CB 3.11Å; D862-T921 PolarHBondContact OD2-OG1 3.36Å; L917-T921 HydrophobicContact CB-CG2 4.35Å; L917-T921 HydrophobicContact CD2-CG2 4.02Å; S918-T921 PolarHBondContact O-N 3.14Å; S918-T921 WeakPolarHBondContact OG-CB 3.34Å; S918-T921 PolarHBondContact OG-N 2.95Å; S918-T921 PolarHBondContact OG-OG1 2.97Å; S918-T921 VanDerWaalsContact OG-OG1 3.1Å; P919-T921 PolarHBondContact O-N 3.16Å; T921-F924 PolarHBondContact O-N 2.57Å; T921-L925 HydrophobicContact CG2-CD1 4.25Å; T921-L925 VanDerWaalsContact O-CG 3.3Å; T921-L925 WeakPolarHBondContact O-CG 3.4Å; T921-L925 PolarHBondContact O-N 2.84Å
922	R	76.8	Confident	65.1	Low	32 Å²	32	65.5 Å²	65.5	12%	0.121	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-42.9	170.7	-64.5	-177.8	-149.4	-154.3	5.1	111.9	L907 D911 L917 S918 P919 L925 S926	L907-R922 HydrophobicContact CD1-CB 4.18Å; L907-R922 HydrophobicContact CD2-CB 4.15Å; L907-R922 HydrophobicContact CD2-CG 4.49Å; L907-R922 PolarHBondContact O-NH1 3.49Å; D911-R922 VanDerWaalsContact CG-NH1 3.29Å; D911-R922 IonicContact OD1-CZ 2.91Å; D911-R922 IonicContact OD1-NH1 2.73Å; D911-R922 PolarHBondContact OD1-NH1 2.69Å; D911-R922 IonicContact OD1-NH2 3.51Å; D911-R922 PolarHBondContact OD1-NH2 2.89Å; D911-R922 IonicContact OD2-CZ 2.97Å; D911-R922 IonicContact OD2-NH1 3.28Å; D911-R922 PolarHBondContact OD2-NH1 2.92Å; D911-R922 IonicContact OD2-NH2 3.43Å; L917-R922 HydrophobicContact CB-CG 3.77Å; L917-R922 HydrophobicContact CD1-CG 4.44Å; L917-R922 VanDerWaalsContact O-CZ 3.27Å; L917-R922 PolarHBondContact O-NE 3.3Å; L917-R922 PolarHBondContact O-NH2 3.44Å; S918-R922 PolarHBondContact O-N 3.28Å; P919-R922 PolarHBondContact O-N 3.15Å; R922-L925 PolarHBondContact O-N 3.09Å; R922-S926 WeakPolarHBondContact O-CB 3.2Å; R922-S926 PolarHBondContact O-N 3.05Å
923	E	76.2	Confident	65.4	Low	116 Å²	116	63.8 Å²	63.8	54%	0.542	35%	0.348	S	S	.	.	H	α-helix	trans	-64.4	-44	176.8	-167.2	-173.9	153.6	0	0	111.2	P919 S920 S926 K927	P919-E923 WeakPolarHBondContact O-CB 3.36Å; P919-E923 PolarHBondContact O-N 3.42Å; S920-E923 PolarHBondContact O-N 3.3Å; E923-S926 WeakPolarHBondContact CA-OG 3.34Å; E923-S926 WeakPolarHBondContact O-CB 3.23Å; E923-S926 PolarHBondContact O-N 2.84Å; E923-S926 VanDerWaalsContact O-N 3.08Å; E923-S926 PolarHBondContact O-OG 3.21Å; E923-K927 PolarHBondContact O-N 3.09Å
924	F	74.4	Confident	65.6	Low	24 Å²	24	63.6 Å²	63.6	11%	0.105	35%	0.348	C	S	.	.	H	α-helix	trans	-58.3	-47.8	175.1	176.9	-109	0	0	0	112.6	S855 L856 C859 R888 S920 T921 S926 K927 F930	S855-F924 WeakPolarHBondContact OG-CE2 3.37Å; L856-F924 HydrophobicContact CB-CZ 4.24Å; L856-F924 HydrophobicContact CD1-CE1 4.09Å; L856-F924 HydrophobicContact CD1-CZ 4.25Å; C859-F924 HydrophobicContact CB-CD1 3.62Å; C859-F924 HydrophobicContact CB-CE1 3.68Å; R888-F924 VanDerWaalsContact NH2-CZ 3.3Å; S920-F924 WeakPolarHBondContact O-CB 3.32Å; S920-F924 PolarHBondContact O-N 3.13Å; T921-F924 PolarHBondContact O-N 2.57Å; F924-S926 PolarHBondContact O-N 3.08Å; F924-K927 PolarHBondContact O-N 3.25Å; F924-F930 HydrophobicContact CE2-CE2 4.4Å; F924-F930 HydrophobicContact CZ-CE2 4.3Å; F924-F930 HydrophobicContact CZ-CZ 4.44Å
925	L	73.8	Confident	65.7	Low	0 Å²	0	67.2 Å²	67.2	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-63.6	-25.4	175.5	-68.5	168.2	0	0	0	112.8	L884 L887 R888 A891 L917 T921 R922	L884-L925 HydrophobicContact CD2-CD2 3.9Å; L884-L925 HydrophobicContact CG-CD2 4.29Å; L887-L925 HydrophobicContact CB-CD1 4.29Å; L887-L925 HydrophobicContact CB-CD2 4.14Å; R888-L925 HydrophobicContact CG-CD2 3.77Å; A891-L925 HydrophobicContact CB-CB 3.66Å; L917-L925 HydrophobicContact CD1-CD1 3.68Å; T921-L925 HydrophobicContact CG2-CD1 4.25Å; T921-L925 VanDerWaalsContact O-CG 3.3Å; T921-L925 WeakPolarHBondContact O-CG 3.4Å; T921-L925 PolarHBondContact O-N 2.84Å; R922-L925 PolarHBondContact O-N 3.09Å
926	S	74.1	Confident	65.6	Low	13 Å²	13	69.9 Å²	69.9	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-82.4	-9.5	-178.8	82.2	0	0	0	0	115.1	N895 R922 E923 F924	N895-S926 PolarHBondContact ND2-O 3.19Å; R922-S926 WeakPolarHBondContact O-CB 3.2Å; R922-S926 PolarHBondContact O-N 3.05Å; E923-S926 WeakPolarHBondContact CA-OG 3.34Å; E923-S926 WeakPolarHBondContact O-CB 3.23Å; E923-S926 PolarHBondContact O-N 2.84Å; E923-S926 VanDerWaalsContact O-N 3.08Å; E923-S926 PolarHBondContact O-OG 3.21Å; F924-S926 PolarHBondContact O-N 3.08Å
927	K	68.5	Low	65.4	Low	118 Å²	118	68.9 Å²	68.9	51%	0.513	38%	0.383	S	S	.	.			trans	-74.9	134.2	178.9	-71.6	175.8	-178	-179.3	0	110.3	E923 F924 S929	E923-K927 PolarHBondContact O-N 3.09Å; F924-K927 PolarHBondContact O-N 3.25Å; K927-S929 VanDerWaalsContact C-N 3.34Å; K927-S929 PolarHBondContact O-N 3.27Å
928	S	50.2	Low	64.8	Low	106 Å²	106	73.8 Å²	73.8	74%	0.741	41%	0.41	S	S	*	.			trans	-87.8	9.4	-170	57.7	0	0	0	0	115.1
929	S	46.2	Very low	64	Low	73 Å²	73	77.1 Å²	77.1	51%	0.51	43%	0.425	S	S	.	.			trans	-126.3	93	-166.6	56.5	0	0	0	0	112.6	K927	K927-S929 VanDerWaalsContact C-N 3.34Å; K927-S929 PolarHBondContact O-N 3.27Å
930	F	39.7	Very low	63.2	Low	116 Å²	116	74.5 Å²	74.5	51%	0.509	40%	0.402	S	S	.	.			trans	-123.2	44.1	149.1	-96.1	-107.8	0	0	0	107.6	R888 F924	R888-F930 VanDerWaalsContact NH2-CZ 3.28Å; F924-F930 HydrophobicContact CE2-CE2 4.4Å; F924-F930 HydrophobicContact CZ-CE2 4.3Å; F924-F930 HydrophobicContact CZ-CZ 4.44Å
931	L	28.7	Very low	62.3	Low	210 Å²	210	74.1 Å²	74.1	100%	1.099	39%	0.389	S	S	*	.			trans	-105.2	0	173.8	-90.7	170.4	0	0	0	108.2

Retrieved 931 of 931 residues in 1528.9 ms (Link to these results)

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